USER MOD reduce.3.24.130724 H: found=0, std=0, add=579, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 582 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= -0.122 X(o=-0.12,f=-0.19) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 LYS NZ :NH3+ -115:sc= 0 (180deg=-0.12) USER MOD Single : A 80 GLN : amide:sc= -2.39! C(o=-2.4!,f=-3.5!) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 HIS : no HD1:sc= -0.188 X(o=-0.19,f=-0.29) USER MOD Single : A 85 GLN : amide:sc= -0.362 X(o=-0.36,f=0) USER MOD Single : A 89 GLN : amide:sc= -0.171 X(o=-0.17,f=0) USER MOD Single : B 168 SER OG : rot 13:sc= 0.135 USER MOD Single : B 169 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 174 GLN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : B 175 ASN : amide:sc= -0.369 X(o=-0.37,f=-0.24) USER MOD Single : B 176 MET CE :methyl 131:sc= -7.68! (180deg=-12.8!) USER MOD Single : B 184 THR OG1 : rot 180:sc= -1.45 USER MOD Single : B 185 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 188 GLN : amide:sc= -0.255 X(o=-0.26,f=-0.22) USER MOD Single : B 189 GLN : amide:sc= -0.381 X(o=-0.38,f=0) USER MOD Single : B 191 SER OG : rot 180:sc= 0 USER MOD Single : B 192 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 194 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 195 LYS NZ :NH3+ -115:sc= 0 (180deg=-0.13) USER MOD Single : B 196 LYS NZ :NH3+ 149:sc= -0.0199 (180deg=-1.28) USER MOD Single : B 197 GLN : amide:sc= -2.42 K(o=-2.4,f=-5.8!) USER MOD Single : B 198 GLN : amide:sc= -0.394 X(o=-0.39,f=-0.043) USER MOD Single : B 199 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 161 N LEU A 62 1.109 -18.186 3.529 1.00 0.00 N ATOM 162 CA LEU A 62 0.838 -17.283 2.369 1.00 0.00 C ATOM 163 C LEU A 62 -0.590 -16.739 2.451 1.00 0.00 C ATOM 164 O LEU A 62 -0.874 -15.650 1.991 1.00 0.00 O ATOM 165 CB LEU A 62 1.009 -18.159 1.125 1.00 0.00 C ATOM 166 CG LEU A 62 1.051 -17.272 -0.121 1.00 0.00 C ATOM 167 CD1 LEU A 62 1.992 -17.892 -1.157 1.00 0.00 C ATOM 168 CD2 LEU A 62 -0.355 -17.158 -0.714 1.00 0.00 C ATOM 0 HA LEU A 62 1.508 -16.424 2.351 1.00 0.00 H new ATOM 0 HB2 LEU A 62 1.927 -18.742 1.201 1.00 0.00 H new ATOM 0 HB3 LEU A 62 0.186 -18.869 1.051 1.00 0.00 H new ATOM 0 HG LEU A 62 1.412 -16.280 0.151 1.00 0.00 H new ATOM 0 HD11 LEU A 62 2.022 -17.261 -2.045 1.00 0.00 H new ATOM 0 HD12 LEU A 62 2.994 -17.974 -0.736 1.00 0.00 H new ATOM 0 HD13 LEU A 62 1.631 -18.884 -1.429 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -0.325 -16.526 -1.602 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -0.717 -18.150 -0.986 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -1.026 -16.717 0.023 1.00 0.00 H new ATOM 180 N GLU A 63 -1.487 -17.491 3.038 1.00 0.00 N ATOM 181 CA GLU A 63 -2.902 -17.020 3.157 1.00 0.00 C ATOM 182 C GLU A 63 -2.971 -15.806 4.084 1.00 0.00 C ATOM 183 O GLU A 63 -3.703 -14.865 3.836 1.00 0.00 O ATOM 184 CB GLU A 63 -3.674 -18.198 3.753 1.00 0.00 C ATOM 185 CG GLU A 63 -5.141 -18.116 3.328 1.00 0.00 C ATOM 186 CD GLU A 63 -5.909 -19.306 3.904 1.00 0.00 C ATOM 187 OE1 GLU A 63 -5.971 -20.326 3.236 1.00 0.00 O ATOM 188 OE2 GLU A 63 -6.420 -19.179 5.005 1.00 0.00 O ATOM 0 H GLU A 63 -1.301 -18.410 3.440 1.00 0.00 H new ATOM 0 HA GLU A 63 -3.317 -16.715 2.196 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -3.239 -19.139 3.416 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -3.598 -18.183 4.840 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -5.580 -17.182 3.679 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -5.216 -18.114 2.241 1.00 0.00 H new ATOM 195 N GLU A 64 -2.208 -15.822 5.144 1.00 0.00 N ATOM 196 CA GLU A 64 -2.214 -14.669 6.094 1.00 0.00 C ATOM 197 C GLU A 64 -1.514 -13.468 5.456 1.00 0.00 C ATOM 198 O GLU A 64 -1.835 -12.328 5.740 1.00 0.00 O ATOM 199 CB GLU A 64 -1.441 -15.152 7.323 1.00 0.00 C ATOM 200 CG GLU A 64 -2.327 -16.085 8.150 1.00 0.00 C ATOM 201 CD GLU A 64 -1.784 -16.174 9.577 1.00 0.00 C ATOM 202 OE1 GLU A 64 -0.727 -16.758 9.752 1.00 0.00 O ATOM 203 OE2 GLU A 64 -2.434 -15.658 10.472 1.00 0.00 O ATOM 0 H GLU A 64 -1.579 -16.585 5.394 1.00 0.00 H new ATOM 0 HA GLU A 64 -3.224 -14.353 6.355 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -0.535 -15.673 7.014 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -1.129 -14.300 7.927 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -3.352 -15.714 8.162 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -2.352 -17.076 7.697 1.00 0.00 H new ATOM 210 N THR A 65 -0.564 -13.718 4.593 1.00 0.00 N ATOM 211 CA THR A 65 0.161 -12.598 3.922 1.00 0.00 C ATOM 212 C THR A 65 -0.747 -11.940 2.881 1.00 0.00 C ATOM 213 O THR A 65 -0.636 -10.760 2.604 1.00 0.00 O ATOM 214 CB THR A 65 1.372 -13.247 3.246 1.00 0.00 C ATOM 215 OG1 THR A 65 2.142 -13.937 4.221 1.00 0.00 O ATOM 216 CG2 THR A 65 2.229 -12.167 2.585 1.00 0.00 C ATOM 0 H THR A 65 -0.258 -14.653 4.323 1.00 0.00 H new ATOM 0 HA THR A 65 0.462 -11.821 4.625 1.00 0.00 H new ATOM 0 HB THR A 65 1.032 -13.951 2.487 1.00 0.00 H new ATOM 0 HG1 THR A 65 2.917 -14.355 3.790 1.00 0.00 H new ATOM 0 HG21 THR A 65 3.091 -12.630 2.104 1.00 0.00 H new ATOM 0 HG22 THR A 65 1.637 -11.639 1.838 1.00 0.00 H new ATOM 0 HG23 THR A 65 2.572 -11.461 3.341 1.00 0.00 H new ATOM 224 N LYS A 66 -1.647 -12.698 2.305 1.00 0.00 N ATOM 225 CA LYS A 66 -2.573 -12.123 1.281 1.00 0.00 C ATOM 226 C LYS A 66 -3.582 -11.186 1.951 1.00 0.00 C ATOM 227 O LYS A 66 -4.083 -10.262 1.338 1.00 0.00 O ATOM 228 CB LYS A 66 -3.288 -13.327 0.661 1.00 0.00 C ATOM 229 CG LYS A 66 -2.600 -13.711 -0.651 1.00 0.00 C ATOM 230 CD LYS A 66 -3.184 -12.880 -1.796 1.00 0.00 C ATOM 231 CE LYS A 66 -2.354 -11.608 -1.979 1.00 0.00 C ATOM 232 NZ LYS A 66 -2.671 -11.137 -3.357 1.00 0.00 N ATOM 0 H LYS A 66 -1.780 -13.690 2.500 1.00 0.00 H new ATOM 0 HA LYS A 66 -2.042 -11.538 0.530 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -3.271 -14.169 1.353 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -4.335 -13.086 0.478 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -1.526 -13.540 -0.574 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -2.740 -14.773 -0.850 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -3.185 -13.462 -2.718 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -4.221 -12.622 -1.580 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -2.615 -10.856 -1.235 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -1.289 -11.812 -1.866 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -2.139 -10.266 -3.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -2.406 -11.871 -4.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -3.690 -10.945 -3.432 1.00 0.00 H new ATOM 246 N GLU A 67 -3.884 -11.420 3.204 1.00 0.00 N ATOM 247 CA GLU A 67 -4.861 -10.545 3.920 1.00 0.00 C ATOM 248 C GLU A 67 -4.204 -9.214 4.295 1.00 0.00 C ATOM 249 O GLU A 67 -4.864 -8.198 4.402 1.00 0.00 O ATOM 250 CB GLU A 67 -5.253 -11.324 5.177 1.00 0.00 C ATOM 251 CG GLU A 67 -6.456 -12.218 4.869 1.00 0.00 C ATOM 252 CD GLU A 67 -6.887 -12.950 6.140 1.00 0.00 C ATOM 253 OE1 GLU A 67 -7.266 -12.281 7.087 1.00 0.00 O ATOM 254 OE2 GLU A 67 -6.832 -14.169 6.146 1.00 0.00 O ATOM 0 H GLU A 67 -3.495 -12.180 3.762 1.00 0.00 H new ATOM 0 HA GLU A 67 -5.728 -10.309 3.304 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -4.414 -11.930 5.518 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -5.497 -10.634 5.984 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -7.280 -11.617 4.486 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -6.198 -12.938 4.092 1.00 0.00 H new ATOM 261 N GLN A 68 -2.910 -9.214 4.490 1.00 0.00 N ATOM 262 CA GLN A 68 -2.203 -7.950 4.855 1.00 0.00 C ATOM 263 C GLN A 68 -2.018 -7.080 3.610 1.00 0.00 C ATOM 264 O GLN A 68 -2.052 -5.866 3.680 1.00 0.00 O ATOM 265 CB GLN A 68 -0.848 -8.392 5.411 1.00 0.00 C ATOM 266 CG GLN A 68 -0.051 -7.165 5.864 1.00 0.00 C ATOM 267 CD GLN A 68 -0.762 -6.499 7.044 1.00 0.00 C ATOM 268 OE1 GLN A 68 -1.041 -7.138 8.040 1.00 0.00 O ATOM 269 NE2 GLN A 68 -1.068 -5.233 6.975 1.00 0.00 N ATOM 0 H GLN A 68 -2.312 -10.036 4.412 1.00 0.00 H new ATOM 0 HA GLN A 68 -2.760 -7.358 5.581 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -0.993 -9.073 6.249 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -0.292 -8.938 4.649 1.00 0.00 H new ATOM 0 HG2 GLN A 68 0.957 -7.460 6.154 1.00 0.00 H new ATOM 0 HG3 GLN A 68 0.048 -6.458 5.040 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -0.834 -4.697 6.140 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -1.541 -4.779 7.756 1.00 0.00 H new ATOM 278 N ILE A 69 -1.832 -7.698 2.473 1.00 0.00 N ATOM 279 CA ILE A 69 -1.650 -6.917 1.212 1.00 0.00 C ATOM 280 C ILE A 69 -2.996 -6.335 0.770 1.00 0.00 C ATOM 281 O ILE A 69 -3.054 -5.299 0.135 1.00 0.00 O ATOM 282 CB ILE A 69 -1.125 -7.920 0.179 1.00 0.00 C ATOM 283 CG1 ILE A 69 0.183 -8.543 0.680 1.00 0.00 C ATOM 284 CG2 ILE A 69 -0.863 -7.203 -1.148 1.00 0.00 C ATOM 285 CD1 ILE A 69 0.510 -9.782 -0.155 1.00 0.00 C ATOM 0 H ILE A 69 -1.798 -8.711 2.362 1.00 0.00 H new ATOM 0 HA ILE A 69 -0.961 -6.082 1.336 1.00 0.00 H new ATOM 0 HB ILE A 69 -1.870 -8.702 0.033 1.00 0.00 H new ATOM 0 HG12 ILE A 69 0.994 -7.819 0.608 1.00 0.00 H new ATOM 0 HG13 ILE A 69 0.090 -8.814 1.732 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -0.490 -7.919 -1.881 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -1.791 -6.761 -1.512 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -0.122 -6.418 -0.997 1.00 0.00 H new ATOM 0 HD11 ILE A 69 1.440 -10.225 0.201 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -0.298 -10.508 -0.061 1.00 0.00 H new ATOM 0 HD13 ILE A 69 0.621 -9.497 -1.201 1.00 0.00 H new ATOM 297 N LEU A 70 -4.076 -6.991 1.110 1.00 0.00 N ATOM 298 CA LEU A 70 -5.424 -6.475 0.721 1.00 0.00 C ATOM 299 C LEU A 70 -5.774 -5.257 1.575 1.00 0.00 C ATOM 300 O LEU A 70 -6.367 -4.305 1.101 1.00 0.00 O ATOM 301 CB LEU A 70 -6.394 -7.625 0.999 1.00 0.00 C ATOM 302 CG LEU A 70 -7.479 -7.650 -0.078 1.00 0.00 C ATOM 303 CD1 LEU A 70 -8.108 -9.043 -0.138 1.00 0.00 C ATOM 304 CD2 LEU A 70 -8.558 -6.620 0.264 1.00 0.00 C ATOM 0 H LEU A 70 -4.083 -7.862 1.640 1.00 0.00 H new ATOM 0 HA LEU A 70 -5.464 -6.162 -0.322 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -5.857 -8.573 1.011 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -6.847 -7.503 1.983 1.00 0.00 H new ATOM 0 HG LEU A 70 -7.037 -7.409 -1.045 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -8.881 -9.060 -0.906 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -7.341 -9.779 -0.379 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -8.551 -9.284 0.828 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -9.333 -6.636 -0.503 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -8.999 -6.863 1.231 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -8.112 -5.627 0.308 1.00 0.00 H new ATOM 316 N LYS A 71 -5.399 -5.275 2.831 1.00 0.00 N ATOM 317 CA LYS A 71 -5.697 -4.112 3.721 1.00 0.00 C ATOM 318 C LYS A 71 -4.976 -2.867 3.199 1.00 0.00 C ATOM 319 O LYS A 71 -5.437 -1.755 3.372 1.00 0.00 O ATOM 320 CB LYS A 71 -5.160 -4.504 5.098 1.00 0.00 C ATOM 321 CG LYS A 71 -5.660 -3.507 6.144 1.00 0.00 C ATOM 322 CD LYS A 71 -7.162 -3.702 6.360 1.00 0.00 C ATOM 323 CE LYS A 71 -7.629 -2.824 7.523 1.00 0.00 C ATOM 324 NZ LYS A 71 -8.973 -2.329 7.115 1.00 0.00 N ATOM 0 H LYS A 71 -4.900 -6.045 3.277 1.00 0.00 H new ATOM 0 HA LYS A 71 -6.762 -3.882 3.759 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -5.488 -5.511 5.355 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -4.070 -4.517 5.085 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -5.125 -3.650 7.083 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -5.459 -2.487 5.815 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -7.707 -3.442 5.453 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -7.377 -4.749 6.572 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -7.683 -3.393 8.451 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -6.939 -1.998 7.696 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -9.360 -1.718 7.863 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -8.889 -1.785 6.233 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -9.610 -3.137 6.964 1.00 0.00 H new ATOM 338 N LEU A 72 -3.850 -3.053 2.553 1.00 0.00 N ATOM 339 CA LEU A 72 -3.096 -1.884 2.007 1.00 0.00 C ATOM 340 C LEU A 72 -3.953 -1.147 0.976 1.00 0.00 C ATOM 341 O LEU A 72 -3.831 0.051 0.799 1.00 0.00 O ATOM 342 CB LEU A 72 -1.851 -2.478 1.345 1.00 0.00 C ATOM 343 CG LEU A 72 -0.710 -2.536 2.363 1.00 0.00 C ATOM 344 CD1 LEU A 72 0.436 -3.377 1.799 1.00 0.00 C ATOM 345 CD2 LEU A 72 -0.211 -1.118 2.651 1.00 0.00 C ATOM 0 H LEU A 72 -3.422 -3.963 2.381 1.00 0.00 H new ATOM 0 HA LEU A 72 -2.834 -1.164 2.782 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -2.068 -3.478 0.969 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -1.557 -1.872 0.488 1.00 0.00 H new ATOM 0 HG LEU A 72 -1.070 -2.989 3.287 1.00 0.00 H new ATOM 0 HD11 LEU A 72 1.248 -3.418 2.524 1.00 0.00 H new ATOM 0 HD12 LEU A 72 0.080 -4.387 1.595 1.00 0.00 H new ATOM 0 HD13 LEU A 72 0.797 -2.926 0.875 1.00 0.00 H new ATOM 0 HD21 LEU A 72 0.602 -1.159 3.376 1.00 0.00 H new ATOM 0 HD22 LEU A 72 0.149 -0.664 1.728 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -1.028 -0.520 3.055 1.00 0.00 H new ATOM 357 N GLU A 73 -4.824 -1.856 0.300 1.00 0.00 N ATOM 358 CA GLU A 73 -5.701 -1.197 -0.718 1.00 0.00 C ATOM 359 C GLU A 73 -6.591 -0.159 -0.037 1.00 0.00 C ATOM 360 O GLU A 73 -6.829 0.912 -0.565 1.00 0.00 O ATOM 361 CB GLU A 73 -6.546 -2.322 -1.319 1.00 0.00 C ATOM 362 CG GLU A 73 -6.720 -2.084 -2.820 1.00 0.00 C ATOM 363 CD GLU A 73 -6.795 -3.430 -3.546 1.00 0.00 C ATOM 364 OE1 GLU A 73 -7.501 -4.301 -3.064 1.00 0.00 O ATOM 365 OE2 GLU A 73 -6.147 -3.566 -4.569 1.00 0.00 O ATOM 0 H GLU A 73 -4.965 -2.860 0.409 1.00 0.00 H new ATOM 0 HA GLU A 73 -5.127 -0.678 -1.485 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -6.065 -3.285 -1.146 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -7.520 -2.360 -0.831 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -7.627 -1.508 -3.005 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -5.886 -1.497 -3.205 1.00 0.00 H new ATOM 372 N GLU A 74 -7.069 -0.464 1.140 1.00 0.00 N ATOM 373 CA GLU A 74 -7.934 0.506 1.877 1.00 0.00 C ATOM 374 C GLU A 74 -7.060 1.614 2.468 1.00 0.00 C ATOM 375 O GLU A 74 -7.476 2.749 2.591 1.00 0.00 O ATOM 376 CB GLU A 74 -8.602 -0.307 2.991 1.00 0.00 C ATOM 377 CG GLU A 74 -10.078 -0.533 2.652 1.00 0.00 C ATOM 378 CD GLU A 74 -10.798 -1.120 3.868 1.00 0.00 C ATOM 379 OE1 GLU A 74 -10.864 -0.439 4.878 1.00 0.00 O ATOM 380 OE2 GLU A 74 -11.270 -2.241 3.768 1.00 0.00 O ATOM 0 H GLU A 74 -6.898 -1.345 1.625 1.00 0.00 H new ATOM 0 HA GLU A 74 -8.676 0.979 1.233 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -8.095 -1.265 3.109 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -8.514 0.219 3.941 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -10.543 0.409 2.360 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -10.167 -1.209 1.802 1.00 0.00 H new ATOM 387 N LYS A 75 -5.845 1.283 2.825 1.00 0.00 N ATOM 388 CA LYS A 75 -4.924 2.306 3.402 1.00 0.00 C ATOM 389 C LYS A 75 -4.406 3.219 2.290 1.00 0.00 C ATOM 390 O LYS A 75 -4.157 4.391 2.505 1.00 0.00 O ATOM 391 CB LYS A 75 -3.776 1.507 4.024 1.00 0.00 C ATOM 392 CG LYS A 75 -3.302 2.204 5.300 1.00 0.00 C ATOM 393 CD LYS A 75 -1.920 1.674 5.688 1.00 0.00 C ATOM 394 CE LYS A 75 -1.356 2.511 6.838 1.00 0.00 C ATOM 395 NZ LYS A 75 -0.773 3.717 6.186 1.00 0.00 N ATOM 0 H LYS A 75 -5.451 0.346 2.741 1.00 0.00 H new ATOM 0 HA LYS A 75 -5.415 2.942 4.139 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -4.106 0.493 4.252 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -2.952 1.422 3.316 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -3.259 3.282 5.144 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -4.011 2.027 6.109 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -1.991 0.628 5.986 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -1.249 1.716 4.830 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -2.137 2.784 7.547 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -0.599 1.958 7.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 0.257 3.724 6.327 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -0.983 3.697 5.168 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -1.186 4.573 6.607 1.00 0.00 H new ATOM 409 N LEU A 76 -4.252 2.691 1.100 1.00 0.00 N ATOM 410 CA LEU A 76 -3.761 3.529 -0.035 1.00 0.00 C ATOM 411 C LEU A 76 -4.893 4.425 -0.540 1.00 0.00 C ATOM 412 O LEU A 76 -4.666 5.526 -1.003 1.00 0.00 O ATOM 413 CB LEU A 76 -3.334 2.536 -1.118 1.00 0.00 C ATOM 414 CG LEU A 76 -2.744 3.298 -2.306 1.00 0.00 C ATOM 415 CD1 LEU A 76 -1.340 3.790 -1.953 1.00 0.00 C ATOM 416 CD2 LEU A 76 -2.668 2.368 -3.519 1.00 0.00 C ATOM 0 H LEU A 76 -4.445 1.717 0.867 1.00 0.00 H new ATOM 0 HA LEU A 76 -2.937 4.180 0.255 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -2.598 1.839 -0.717 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -4.190 1.944 -1.441 1.00 0.00 H new ATOM 0 HG LEU A 76 -3.379 4.153 -2.540 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -0.921 4.333 -2.800 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -1.393 4.452 -1.089 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -0.704 2.937 -1.718 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -2.248 2.909 -4.367 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -2.033 1.514 -3.283 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -3.669 2.018 -3.772 1.00 0.00 H new ATOM 428 N LEU A 77 -6.110 3.956 -0.443 1.00 0.00 N ATOM 429 CA LEU A 77 -7.270 4.774 -0.903 1.00 0.00 C ATOM 430 C LEU A 77 -7.546 5.887 0.108 1.00 0.00 C ATOM 431 O LEU A 77 -7.948 6.979 -0.249 1.00 0.00 O ATOM 432 CB LEU A 77 -8.451 3.802 -0.970 1.00 0.00 C ATOM 433 CG LEU A 77 -9.628 4.475 -1.676 1.00 0.00 C ATOM 434 CD1 LEU A 77 -9.605 4.118 -3.163 1.00 0.00 C ATOM 435 CD2 LEU A 77 -10.941 3.987 -1.057 1.00 0.00 C ATOM 0 H LEU A 77 -6.350 3.040 -0.064 1.00 0.00 H new ATOM 0 HA LEU A 77 -7.088 5.248 -1.868 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -8.161 2.898 -1.505 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -8.742 3.498 0.035 1.00 0.00 H new ATOM 0 HG LEU A 77 -9.549 5.556 -1.560 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -10.445 4.598 -3.666 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -8.671 4.464 -3.606 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -9.683 3.037 -3.279 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -11.781 4.467 -1.560 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -11.018 2.906 -1.173 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -10.960 4.241 0.003 1.00 0.00 H new ATOM 447 N ALA A 78 -7.323 5.614 1.369 1.00 0.00 N ATOM 448 CA ALA A 78 -7.560 6.653 2.416 1.00 0.00 C ATOM 449 C ALA A 78 -6.516 7.764 2.287 1.00 0.00 C ATOM 450 O ALA A 78 -6.782 8.915 2.576 1.00 0.00 O ATOM 451 CB ALA A 78 -7.404 5.925 3.752 1.00 0.00 C ATOM 0 H ALA A 78 -6.987 4.716 1.718 1.00 0.00 H new ATOM 0 HA ALA A 78 -8.542 7.117 2.324 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -7.565 6.627 4.570 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -8.136 5.120 3.816 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -6.400 5.508 3.824 1.00 0.00 H new ATOM 457 N LEU A 79 -5.332 7.422 1.847 1.00 0.00 N ATOM 458 CA LEU A 79 -4.262 8.452 1.685 1.00 0.00 C ATOM 459 C LEU A 79 -4.607 9.373 0.513 1.00 0.00 C ATOM 460 O LEU A 79 -4.480 10.580 0.604 1.00 0.00 O ATOM 461 CB LEU A 79 -2.974 7.663 1.397 1.00 0.00 C ATOM 462 CG LEU A 79 -2.046 7.687 2.622 1.00 0.00 C ATOM 463 CD1 LEU A 79 -1.680 9.133 2.973 1.00 0.00 C ATOM 464 CD2 LEU A 79 -2.741 7.026 3.819 1.00 0.00 C ATOM 0 H LEU A 79 -5.060 6.472 1.593 1.00 0.00 H new ATOM 0 HA LEU A 79 -4.153 9.080 2.569 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -3.221 6.633 1.140 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -2.462 8.092 0.536 1.00 0.00 H new ATOM 0 HG LEU A 79 -1.137 7.134 2.386 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -1.022 9.141 3.842 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -1.170 9.595 2.128 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -2.587 9.693 3.199 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -2.077 7.047 4.683 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -3.657 7.568 4.053 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -2.984 5.992 3.573 1.00 0.00 H new ATOM 476 N GLN A 80 -5.049 8.808 -0.583 1.00 0.00 N ATOM 477 CA GLN A 80 -5.416 9.647 -1.764 1.00 0.00 C ATOM 478 C GLN A 80 -6.637 10.505 -1.428 1.00 0.00 C ATOM 479 O GLN A 80 -6.798 11.599 -1.935 1.00 0.00 O ATOM 480 CB GLN A 80 -5.748 8.654 -2.880 1.00 0.00 C ATOM 481 CG GLN A 80 -4.507 7.818 -3.207 1.00 0.00 C ATOM 482 CD GLN A 80 -3.713 8.490 -4.331 1.00 0.00 C ATOM 483 OE1 GLN A 80 -4.248 9.281 -5.083 1.00 0.00 O ATOM 484 NE2 GLN A 80 -2.448 8.206 -4.477 1.00 0.00 N ATOM 0 H GLN A 80 -5.171 7.803 -0.710 1.00 0.00 H new ATOM 0 HA GLN A 80 -4.614 10.324 -2.057 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -6.566 8.004 -2.571 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -6.084 9.188 -3.769 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -3.883 7.714 -2.320 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -4.803 6.813 -3.508 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -1.998 7.542 -3.846 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -1.909 8.648 -5.222 1.00 0.00 H new ATOM 493 N GLU A 81 -7.494 10.012 -0.570 1.00 0.00 N ATOM 494 CA GLU A 81 -8.709 10.792 -0.185 1.00 0.00 C ATOM 495 C GLU A 81 -8.298 12.028 0.617 1.00 0.00 C ATOM 496 O GLU A 81 -8.940 13.060 0.557 1.00 0.00 O ATOM 497 CB GLU A 81 -9.544 9.844 0.679 1.00 0.00 C ATOM 498 CG GLU A 81 -10.980 10.364 0.767 1.00 0.00 C ATOM 499 CD GLU A 81 -11.732 10.005 -0.516 1.00 0.00 C ATOM 500 OE1 GLU A 81 -11.927 8.824 -0.755 1.00 0.00 O ATOM 501 OE2 GLU A 81 -12.101 10.917 -1.238 1.00 0.00 O ATOM 0 H GLU A 81 -7.404 9.102 -0.119 1.00 0.00 H new ATOM 0 HA GLU A 81 -9.269 11.140 -1.053 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -9.535 8.842 0.251 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -9.112 9.769 1.677 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -11.483 9.929 1.630 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -10.979 11.445 0.910 1.00 0.00 H new ATOM 508 N GLU A 82 -7.229 11.928 1.364 1.00 0.00 N ATOM 509 CA GLU A 82 -6.761 13.096 2.172 1.00 0.00 C ATOM 510 C GLU A 82 -6.326 14.227 1.237 1.00 0.00 C ATOM 511 O GLU A 82 -6.669 15.376 1.442 1.00 0.00 O ATOM 512 CB GLU A 82 -5.571 12.579 2.990 1.00 0.00 C ATOM 513 CG GLU A 82 -5.985 12.412 4.454 1.00 0.00 C ATOM 514 CD GLU A 82 -5.995 13.779 5.141 1.00 0.00 C ATOM 515 OE1 GLU A 82 -6.395 14.739 4.502 1.00 0.00 O ATOM 516 OE2 GLU A 82 -5.603 13.844 6.294 1.00 0.00 O ATOM 0 H GLU A 82 -6.658 11.087 1.450 1.00 0.00 H new ATOM 0 HA GLU A 82 -7.543 13.493 2.819 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -5.228 11.626 2.588 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -4.736 13.276 2.915 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -6.973 11.956 4.514 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -5.293 11.742 4.964 1.00 0.00 H new ATOM 523 N LYS A 83 -5.585 13.905 0.208 1.00 0.00 N ATOM 524 CA LYS A 83 -5.137 14.961 -0.752 1.00 0.00 C ATOM 525 C LYS A 83 -6.356 15.568 -1.451 1.00 0.00 C ATOM 526 O LYS A 83 -6.345 16.719 -1.845 1.00 0.00 O ATOM 527 CB LYS A 83 -4.240 14.240 -1.760 1.00 0.00 C ATOM 528 CG LYS A 83 -3.668 15.255 -2.752 1.00 0.00 C ATOM 529 CD LYS A 83 -2.324 14.749 -3.280 1.00 0.00 C ATOM 530 CE LYS A 83 -1.665 15.841 -4.126 1.00 0.00 C ATOM 531 NZ LYS A 83 -2.061 15.531 -5.527 1.00 0.00 N ATOM 0 H LYS A 83 -5.271 12.959 -0.010 1.00 0.00 H new ATOM 0 HA LYS A 83 -4.606 15.775 -0.258 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -3.430 13.727 -1.241 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -4.811 13.478 -2.291 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -4.363 15.404 -3.578 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -3.539 16.222 -2.266 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -1.674 14.476 -2.449 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -2.471 13.850 -3.878 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -2.008 16.832 -3.829 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -0.581 15.831 -4.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -1.647 16.237 -6.169 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -1.715 14.584 -5.784 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -3.098 15.555 -5.608 1.00 0.00 H new ATOM 545 N HIS A 84 -7.405 14.800 -1.601 1.00 0.00 N ATOM 546 CA HIS A 84 -8.636 15.323 -2.269 1.00 0.00 C ATOM 547 C HIS A 84 -9.265 16.429 -1.421 1.00 0.00 C ATOM 548 O HIS A 84 -9.908 17.325 -1.935 1.00 0.00 O ATOM 549 CB HIS A 84 -9.582 14.124 -2.375 1.00 0.00 C ATOM 550 CG HIS A 84 -10.682 14.439 -3.349 1.00 0.00 C ATOM 551 ND1 HIS A 84 -10.442 15.083 -4.553 1.00 0.00 N ATOM 552 CD2 HIS A 84 -12.035 14.204 -3.314 1.00 0.00 C ATOM 553 CE1 HIS A 84 -11.622 15.214 -5.186 1.00 0.00 C ATOM 554 NE2 HIS A 84 -12.626 14.695 -4.474 1.00 0.00 N ATOM 0 H HIS A 84 -7.462 13.831 -1.289 1.00 0.00 H new ATOM 0 HA HIS A 84 -8.420 15.753 -3.247 1.00 0.00 H new ATOM 0 HB2 HIS A 84 -9.033 13.242 -2.703 1.00 0.00 H new ATOM 0 HB3 HIS A 84 -10.003 13.892 -1.397 1.00 0.00 H new ATOM 0 HD2 HIS A 84 -12.560 13.713 -2.508 1.00 0.00 H new ATOM 0 HE1 HIS A 84 -11.743 15.682 -6.152 1.00 0.00 H new ATOM 0 HE2 HIS A 84 -13.614 14.665 -4.726 1.00 0.00 H new ATOM 562 N GLN A 85 -9.080 16.375 -0.126 1.00 0.00 N ATOM 563 CA GLN A 85 -9.662 17.430 0.759 1.00 0.00 C ATOM 564 C GLN A 85 -8.941 18.758 0.523 1.00 0.00 C ATOM 565 O GLN A 85 -9.547 19.813 0.531 1.00 0.00 O ATOM 566 CB GLN A 85 -9.429 16.937 2.189 1.00 0.00 C ATOM 567 CG GLN A 85 -10.652 16.147 2.665 1.00 0.00 C ATOM 568 CD GLN A 85 -11.574 17.064 3.471 1.00 0.00 C ATOM 569 OE1 GLN A 85 -11.752 16.876 4.658 1.00 0.00 O ATOM 570 NE2 GLN A 85 -12.174 18.057 2.871 1.00 0.00 N ATOM 0 H GLN A 85 -8.552 15.647 0.356 1.00 0.00 H new ATOM 0 HA GLN A 85 -10.721 17.597 0.562 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -8.540 16.308 2.227 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -9.250 17.784 2.852 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -11.188 15.737 1.809 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -10.336 15.303 3.278 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -12.025 18.216 1.874 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -12.791 18.674 3.399 1.00 0.00 H new ATOM 579 N LEU A 86 -7.652 18.708 0.304 1.00 0.00 N ATOM 580 CA LEU A 86 -6.881 19.964 0.057 1.00 0.00 C ATOM 581 C LEU A 86 -7.382 20.638 -1.222 1.00 0.00 C ATOM 582 O LEU A 86 -7.326 21.845 -1.358 1.00 0.00 O ATOM 583 CB LEU A 86 -5.423 19.524 -0.102 1.00 0.00 C ATOM 584 CG LEU A 86 -4.677 19.742 1.215 1.00 0.00 C ATOM 585 CD1 LEU A 86 -3.449 18.833 1.263 1.00 0.00 C ATOM 586 CD2 LEU A 86 -4.233 21.203 1.314 1.00 0.00 C ATOM 0 H LEU A 86 -7.099 17.851 0.286 1.00 0.00 H new ATOM 0 HA LEU A 86 -6.995 20.684 0.868 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -5.378 18.473 -0.388 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -4.946 20.092 -0.901 1.00 0.00 H new ATOM 0 HG LEU A 86 -5.337 19.505 2.049 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -2.918 18.989 2.202 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -3.764 17.792 1.193 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -2.789 19.069 0.429 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -3.701 21.359 2.253 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -3.573 21.440 0.479 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -5.108 21.852 1.281 1.00 0.00 H new ATOM 598 N PHE A 87 -7.880 19.865 -2.158 1.00 0.00 N ATOM 599 CA PHE A 87 -8.395 20.460 -3.430 1.00 0.00 C ATOM 600 C PHE A 87 -9.567 21.392 -3.120 1.00 0.00 C ATOM 601 O PHE A 87 -9.668 22.478 -3.659 1.00 0.00 O ATOM 602 CB PHE A 87 -8.858 19.272 -4.281 1.00 0.00 C ATOM 603 CG PHE A 87 -7.840 18.992 -5.360 1.00 0.00 C ATOM 604 CD1 PHE A 87 -7.865 19.725 -6.553 1.00 0.00 C ATOM 605 CD2 PHE A 87 -6.870 18.000 -5.169 1.00 0.00 C ATOM 606 CE1 PHE A 87 -6.921 19.466 -7.554 1.00 0.00 C ATOM 607 CE2 PHE A 87 -5.926 17.741 -6.169 1.00 0.00 C ATOM 608 CZ PHE A 87 -5.951 18.475 -7.361 1.00 0.00 C ATOM 0 H PHE A 87 -7.952 18.849 -2.095 1.00 0.00 H new ATOM 0 HA PHE A 87 -7.639 21.048 -3.950 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -8.988 18.391 -3.653 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -9.827 19.489 -4.730 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -8.613 20.490 -6.701 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -6.851 17.434 -4.249 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -6.941 20.030 -8.475 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -5.179 16.975 -6.021 1.00 0.00 H new ATOM 0 HZ PHE A 87 -5.221 18.277 -8.132 1.00 0.00 H new ATOM 618 N LEU A 88 -10.440 20.977 -2.240 1.00 0.00 N ATOM 619 CA LEU A 88 -11.603 21.840 -1.870 1.00 0.00 C ATOM 620 C LEU A 88 -11.107 23.059 -1.089 1.00 0.00 C ATOM 621 O LEU A 88 -11.684 24.128 -1.150 1.00 0.00 O ATOM 622 CB LEU A 88 -12.495 20.963 -0.988 1.00 0.00 C ATOM 623 CG LEU A 88 -13.285 19.990 -1.865 1.00 0.00 C ATOM 624 CD1 LEU A 88 -13.512 18.684 -1.104 1.00 0.00 C ATOM 625 CD2 LEU A 88 -14.637 20.612 -2.224 1.00 0.00 C ATOM 0 H LEU A 88 -10.399 20.078 -1.761 1.00 0.00 H new ATOM 0 HA LEU A 88 -12.143 22.208 -2.742 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -11.886 20.411 -0.272 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -13.179 21.586 -0.411 1.00 0.00 H new ATOM 0 HG LEU A 88 -12.724 19.785 -2.777 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -14.075 17.991 -1.730 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -12.550 18.241 -0.847 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -14.073 18.887 -0.192 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -15.201 19.920 -2.849 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -15.197 20.816 -1.312 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -14.476 21.543 -2.767 1.00 0.00 H new ATOM 637 N GLN A 89 -10.031 22.899 -0.360 1.00 0.00 N ATOM 638 CA GLN A 89 -9.469 24.035 0.428 1.00 0.00 C ATOM 639 C GLN A 89 -8.527 24.880 -0.442 1.00 0.00 C ATOM 640 O GLN A 89 -8.240 26.019 -0.127 1.00 0.00 O ATOM 641 CB GLN A 89 -8.693 23.372 1.566 1.00 0.00 C ATOM 642 CG GLN A 89 -8.862 24.188 2.850 1.00 0.00 C ATOM 643 CD GLN A 89 -8.544 23.309 4.063 1.00 0.00 C ATOM 644 OE1 GLN A 89 -9.197 23.404 5.084 1.00 0.00 O ATOM 645 NE2 GLN A 89 -7.562 22.449 3.996 1.00 0.00 N ATOM 0 H GLN A 89 -9.515 22.023 -0.277 1.00 0.00 H new ATOM 0 HA GLN A 89 -10.245 24.707 0.793 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -9.053 22.355 1.720 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -7.637 23.300 1.306 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -8.200 25.054 2.832 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -9.881 24.567 2.920 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -7.013 22.368 3.140 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -7.345 21.859 4.799 1.00 0.00 H new ATOM 654 N LEU A 90 -8.040 24.329 -1.532 1.00 0.00 N ATOM 655 CA LEU A 90 -7.111 25.096 -2.425 1.00 0.00 C ATOM 656 C LEU A 90 -7.737 26.434 -2.838 1.00 0.00 C ATOM 657 O LEU A 90 -7.221 27.460 -2.426 1.00 0.00 O ATOM 658 CB LEU A 90 -6.910 24.202 -3.657 1.00 0.00 C ATOM 659 CG LEU A 90 -5.479 24.339 -4.197 1.00 0.00 C ATOM 660 CD1 LEU A 90 -5.199 25.796 -4.581 1.00 0.00 C ATOM 661 CD2 LEU A 90 -4.477 23.889 -3.130 1.00 0.00 C ATOM 662 OXT LEU A 90 -8.721 26.407 -3.560 1.00 0.00 O ATOM 0 H LEU A 90 -8.247 23.379 -1.841 1.00 0.00 H new ATOM 0 HA LEU A 90 -6.170 25.328 -1.926 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -7.107 23.163 -3.395 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -7.625 24.476 -4.433 1.00 0.00 H new ATOM 0 HG LEU A 90 -5.374 23.710 -5.081 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -4.182 25.883 -4.963 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -5.903 26.111 -5.351 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -5.312 26.432 -3.703 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -3.463 23.988 -3.518 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -4.588 24.511 -2.242 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -4.666 22.847 -2.870 1.00 0.00 H new ATOM 675 N GLY B 166 -8.113 27.994 1.932 1.00 0.00 N ATOM 676 CA GLY B 166 -7.081 28.748 1.167 1.00 0.00 C ATOM 677 C GLY B 166 -6.534 29.888 2.030 1.00 0.00 C ATOM 678 O GLY B 166 -7.191 30.355 2.942 1.00 0.00 O ATOM 0 HA2 GLY B 166 -6.271 28.080 0.873 1.00 0.00 H new ATOM 0 HA3 GLY B 166 -7.513 29.148 0.250 1.00 0.00 H new ATOM 684 N LEU B 167 -5.339 30.337 1.746 1.00 0.00 N ATOM 685 CA LEU B 167 -4.739 31.454 2.549 1.00 0.00 C ATOM 686 C LEU B 167 -4.189 32.516 1.598 1.00 0.00 C ATOM 687 O LEU B 167 -4.643 33.644 1.574 1.00 0.00 O ATOM 688 CB LEU B 167 -3.576 30.858 3.377 1.00 0.00 C ATOM 689 CG LEU B 167 -3.844 29.398 3.774 1.00 0.00 C ATOM 690 CD1 LEU B 167 -3.392 28.469 2.638 1.00 0.00 C ATOM 691 CD2 LEU B 167 -3.064 29.069 5.051 1.00 0.00 C ATOM 0 H LEU B 167 -4.750 29.981 0.993 1.00 0.00 H new ATOM 0 HA LEU B 167 -5.485 31.909 3.201 1.00 0.00 H new ATOM 0 HB2 LEU B 167 -2.653 30.913 2.799 1.00 0.00 H new ATOM 0 HB3 LEU B 167 -3.426 31.457 4.275 1.00 0.00 H new ATOM 0 HG LEU B 167 -4.910 29.256 3.953 1.00 0.00 H new ATOM 0 HD11 LEU B 167 -3.581 27.433 2.918 1.00 0.00 H new ATOM 0 HD12 LEU B 167 -3.947 28.707 1.731 1.00 0.00 H new ATOM 0 HD13 LEU B 167 -2.326 28.607 2.458 1.00 0.00 H new ATOM 0 HD21 LEU B 167 -3.252 28.034 5.336 1.00 0.00 H new ATOM 0 HD22 LEU B 167 -1.998 29.208 4.872 1.00 0.00 H new ATOM 0 HD23 LEU B 167 -3.387 29.731 5.855 1.00 0.00 H new ATOM 703 N SER B 168 -3.213 32.148 0.809 1.00 0.00 N ATOM 704 CA SER B 168 -2.613 33.110 -0.157 1.00 0.00 C ATOM 705 C SER B 168 -2.225 32.374 -1.437 1.00 0.00 C ATOM 706 O SER B 168 -1.208 32.652 -2.043 1.00 0.00 O ATOM 707 CB SER B 168 -1.372 33.659 0.545 1.00 0.00 C ATOM 708 OG SER B 168 -1.757 34.702 1.432 1.00 0.00 O ATOM 0 H SER B 168 -2.804 31.214 0.794 1.00 0.00 H new ATOM 0 HA SER B 168 -3.301 33.907 -0.437 1.00 0.00 H new ATOM 0 HB2 SER B 168 -0.870 32.864 1.096 1.00 0.00 H new ATOM 0 HB3 SER B 168 -0.661 34.035 -0.190 1.00 0.00 H new ATOM 0 HG SER B 168 -2.730 34.691 1.547 1.00 0.00 H new ATOM 714 N LYS B 169 -3.026 31.415 -1.844 1.00 0.00 N ATOM 715 CA LYS B 169 -2.713 30.624 -3.078 1.00 0.00 C ATOM 716 C LYS B 169 -1.284 30.072 -3.004 1.00 0.00 C ATOM 717 O LYS B 169 -0.652 29.816 -4.013 1.00 0.00 O ATOM 718 CB LYS B 169 -2.855 31.603 -4.246 1.00 0.00 C ATOM 719 CG LYS B 169 -2.977 30.820 -5.557 1.00 0.00 C ATOM 720 CD LYS B 169 -4.271 30.002 -5.550 1.00 0.00 C ATOM 721 CE LYS B 169 -4.738 29.770 -6.989 1.00 0.00 C ATOM 722 NZ LYS B 169 -6.217 29.621 -6.894 1.00 0.00 N ATOM 0 H LYS B 169 -3.888 31.145 -1.371 1.00 0.00 H new ATOM 0 HA LYS B 169 -3.380 29.769 -3.193 1.00 0.00 H new ATOM 0 HB2 LYS B 169 -3.734 32.232 -4.103 1.00 0.00 H new ATOM 0 HB3 LYS B 169 -1.991 32.267 -4.285 1.00 0.00 H new ATOM 0 HG2 LYS B 169 -2.974 31.507 -6.404 1.00 0.00 H new ATOM 0 HG3 LYS B 169 -2.118 30.160 -5.679 1.00 0.00 H new ATOM 0 HD2 LYS B 169 -4.107 29.047 -5.052 1.00 0.00 H new ATOM 0 HD3 LYS B 169 -5.042 30.527 -4.987 1.00 0.00 H new ATOM 0 HE2 LYS B 169 -4.466 30.607 -7.632 1.00 0.00 H new ATOM 0 HE3 LYS B 169 -4.278 28.878 -7.415 1.00 0.00 H new ATOM 0 HZ1 LYS B 169 -6.611 29.459 -7.843 1.00 0.00 H new ATOM 0 HZ2 LYS B 169 -6.446 28.813 -6.281 1.00 0.00 H new ATOM 0 HZ3 LYS B 169 -6.628 30.488 -6.492 1.00 0.00 H new ATOM 736 N GLU B 170 -0.777 29.890 -1.811 1.00 0.00 N ATOM 737 CA GLU B 170 0.603 29.358 -1.648 1.00 0.00 C ATOM 738 C GLU B 170 0.684 28.498 -0.392 1.00 0.00 C ATOM 739 O GLU B 170 1.237 27.414 -0.413 1.00 0.00 O ATOM 740 CB GLU B 170 1.497 30.592 -1.521 1.00 0.00 C ATOM 741 CG GLU B 170 2.826 30.336 -2.232 1.00 0.00 C ATOM 742 CD GLU B 170 3.421 31.664 -2.701 1.00 0.00 C ATOM 743 OE1 GLU B 170 4.125 32.283 -1.921 1.00 0.00 O ATOM 744 OE2 GLU B 170 3.162 32.041 -3.832 1.00 0.00 O ATOM 0 H GLU B 170 -1.266 30.090 -0.939 1.00 0.00 H new ATOM 0 HA GLU B 170 0.907 28.728 -2.484 1.00 0.00 H new ATOM 0 HB2 GLU B 170 1.001 31.460 -1.956 1.00 0.00 H new ATOM 0 HB3 GLU B 170 1.673 30.820 -0.470 1.00 0.00 H new ATOM 0 HG2 GLU B 170 3.520 29.833 -1.558 1.00 0.00 H new ATOM 0 HG3 GLU B 170 2.673 29.674 -3.084 1.00 0.00 H new ATOM 751 N GLU B 171 0.127 28.963 0.700 1.00 0.00 N ATOM 752 CA GLU B 171 0.169 28.150 1.952 1.00 0.00 C ATOM 753 C GLU B 171 -0.631 26.864 1.742 1.00 0.00 C ATOM 754 O GLU B 171 -0.302 25.821 2.275 1.00 0.00 O ATOM 755 CB GLU B 171 -0.465 29.024 3.035 1.00 0.00 C ATOM 756 CG GLU B 171 0.632 29.639 3.908 1.00 0.00 C ATOM 757 CD GLU B 171 1.262 28.550 4.779 1.00 0.00 C ATOM 758 OE1 GLU B 171 0.641 28.169 5.757 1.00 0.00 O ATOM 759 OE2 GLU B 171 2.355 28.117 4.454 1.00 0.00 O ATOM 0 H GLU B 171 -0.350 29.861 0.777 1.00 0.00 H new ATOM 0 HA GLU B 171 1.182 27.862 2.233 1.00 0.00 H new ATOM 0 HB2 GLU B 171 -1.063 29.812 2.577 1.00 0.00 H new ATOM 0 HB3 GLU B 171 -1.140 28.427 3.649 1.00 0.00 H new ATOM 0 HG2 GLU B 171 1.393 30.103 3.281 1.00 0.00 H new ATOM 0 HG3 GLU B 171 0.213 30.425 4.536 1.00 0.00 H new ATOM 766 N LEU B 172 -1.666 26.933 0.944 1.00 0.00 N ATOM 767 CA LEU B 172 -2.484 25.718 0.658 1.00 0.00 C ATOM 768 C LEU B 172 -1.778 24.875 -0.407 1.00 0.00 C ATOM 769 O LEU B 172 -1.919 23.667 -0.453 1.00 0.00 O ATOM 770 CB LEU B 172 -3.824 26.249 0.124 1.00 0.00 C ATOM 771 CG LEU B 172 -5.000 25.506 0.777 1.00 0.00 C ATOM 772 CD1 LEU B 172 -4.898 24.006 0.486 1.00 0.00 C ATOM 773 CD2 LEU B 172 -4.991 25.737 2.295 1.00 0.00 C ATOM 0 H LEU B 172 -1.980 27.783 0.477 1.00 0.00 H new ATOM 0 HA LEU B 172 -2.626 25.089 1.537 1.00 0.00 H new ATOM 0 HB2 LEU B 172 -3.904 27.317 0.326 1.00 0.00 H new ATOM 0 HB3 LEU B 172 -3.865 26.126 -0.958 1.00 0.00 H new ATOM 0 HG LEU B 172 -5.932 25.890 0.362 1.00 0.00 H new ATOM 0 HD11 LEU B 172 -5.735 23.487 0.953 1.00 0.00 H new ATOM 0 HD12 LEU B 172 -4.924 23.842 -0.591 1.00 0.00 H new ATOM 0 HD13 LEU B 172 -3.962 23.620 0.889 1.00 0.00 H new ATOM 0 HD21 LEU B 172 -5.828 25.206 2.749 1.00 0.00 H new ATOM 0 HD22 LEU B 172 -4.056 25.365 2.714 1.00 0.00 H new ATOM 0 HD23 LEU B 172 -5.083 26.803 2.501 1.00 0.00 H new ATOM 785 N ILE B 173 -1.012 25.511 -1.260 1.00 0.00 N ATOM 786 CA ILE B 173 -0.282 24.763 -2.326 1.00 0.00 C ATOM 787 C ILE B 173 0.893 24.004 -1.708 1.00 0.00 C ATOM 788 O ILE B 173 1.281 22.952 -2.179 1.00 0.00 O ATOM 789 CB ILE B 173 0.231 25.828 -3.306 1.00 0.00 C ATOM 790 CG1 ILE B 173 -0.932 26.701 -3.815 1.00 0.00 C ATOM 791 CG2 ILE B 173 0.913 25.142 -4.492 1.00 0.00 C ATOM 792 CD1 ILE B 173 -1.979 25.838 -4.528 1.00 0.00 C ATOM 0 H ILE B 173 -0.862 26.520 -1.262 1.00 0.00 H new ATOM 0 HA ILE B 173 -0.921 24.035 -2.826 1.00 0.00 H new ATOM 0 HB ILE B 173 0.946 26.467 -2.787 1.00 0.00 H new ATOM 0 HG12 ILE B 173 -1.393 27.226 -2.979 1.00 0.00 H new ATOM 0 HG13 ILE B 173 -0.552 27.461 -4.498 1.00 0.00 H new ATOM 0 HG21 ILE B 173 1.278 25.897 -5.189 1.00 0.00 H new ATOM 0 HG22 ILE B 173 1.751 24.544 -4.134 1.00 0.00 H new ATOM 0 HG23 ILE B 173 0.197 24.496 -5.000 1.00 0.00 H new ATOM 0 HD11 ILE B 173 -2.793 26.471 -4.881 1.00 0.00 H new ATOM 0 HD12 ILE B 173 -1.518 25.333 -5.377 1.00 0.00 H new ATOM 0 HD13 ILE B 173 -2.372 25.095 -3.834 1.00 0.00 H new ATOM 804 N GLN B 174 1.459 24.534 -0.652 1.00 0.00 N ATOM 805 CA GLN B 174 2.612 23.849 0.009 1.00 0.00 C ATOM 806 C GLN B 174 2.123 22.624 0.783 1.00 0.00 C ATOM 807 O GLN B 174 2.840 21.654 0.946 1.00 0.00 O ATOM 808 CB GLN B 174 3.204 24.887 0.964 1.00 0.00 C ATOM 809 CG GLN B 174 4.204 25.765 0.210 1.00 0.00 C ATOM 810 CD GLN B 174 5.245 26.310 1.190 1.00 0.00 C ATOM 811 OE1 GLN B 174 4.928 26.618 2.322 1.00 0.00 O ATOM 812 NE2 GLN B 174 6.483 26.443 0.799 1.00 0.00 N ATOM 0 H GLN B 174 1.172 25.412 -0.219 1.00 0.00 H new ATOM 0 HA GLN B 174 3.350 23.497 -0.712 1.00 0.00 H new ATOM 0 HB2 GLN B 174 2.410 25.503 1.386 1.00 0.00 H new ATOM 0 HB3 GLN B 174 3.698 24.389 1.798 1.00 0.00 H new ATOM 0 HG2 GLN B 174 4.694 25.186 -0.573 1.00 0.00 H new ATOM 0 HG3 GLN B 174 3.684 26.588 -0.280 1.00 0.00 H new ATOM 0 HE21 GLN B 174 6.748 26.184 -0.151 1.00 0.00 H new ATOM 0 HE22 GLN B 174 7.185 26.806 1.444 1.00 0.00 H new ATOM 821 N ASN B 175 0.905 22.664 1.259 1.00 0.00 N ATOM 822 CA ASN B 175 0.356 21.503 2.024 1.00 0.00 C ATOM 823 C ASN B 175 0.042 20.345 1.074 1.00 0.00 C ATOM 824 O ASN B 175 0.068 19.192 1.462 1.00 0.00 O ATOM 825 CB ASN B 175 -0.925 22.024 2.680 1.00 0.00 C ATOM 826 CG ASN B 175 -0.575 22.758 3.975 1.00 0.00 C ATOM 827 OD1 ASN B 175 0.119 22.228 4.819 1.00 0.00 O ATOM 828 ND2 ASN B 175 -1.028 23.968 4.168 1.00 0.00 N ATOM 0 H ASN B 175 0.266 23.451 1.151 1.00 0.00 H new ATOM 0 HA ASN B 175 1.064 21.125 2.762 1.00 0.00 H new ATOM 0 HB2 ASN B 175 -1.447 22.696 1.999 1.00 0.00 H new ATOM 0 HB3 ASN B 175 -1.601 21.195 2.891 1.00 0.00 H new ATOM 0 HD21 ASN B 175 -0.799 24.467 5.027 1.00 0.00 H new ATOM 0 HD22 ASN B 175 -1.611 24.413 3.459 1.00 0.00 H new ATOM 835 N MET B 176 -0.254 20.644 -0.165 1.00 0.00 N ATOM 836 CA MET B 176 -0.570 19.561 -1.146 1.00 0.00 C ATOM 837 C MET B 176 0.709 18.831 -1.560 1.00 0.00 C ATOM 838 O MET B 176 0.683 17.661 -1.895 1.00 0.00 O ATOM 839 CB MET B 176 -1.192 20.275 -2.350 1.00 0.00 C ATOM 840 CG MET B 176 -2.719 20.179 -2.276 1.00 0.00 C ATOM 841 SD MET B 176 -3.404 20.052 -3.947 1.00 0.00 S ATOM 842 CE MET B 176 -4.975 20.885 -3.611 1.00 0.00 C ATOM 0 H MET B 176 -0.291 21.592 -0.540 1.00 0.00 H new ATOM 0 HA MET B 176 -1.243 18.813 -0.726 1.00 0.00 H new ATOM 0 HB2 MET B 176 -0.884 21.321 -2.364 1.00 0.00 H new ATOM 0 HB3 MET B 176 -0.834 19.825 -3.276 1.00 0.00 H new ATOM 0 HG2 MET B 176 -3.010 19.310 -1.686 1.00 0.00 H new ATOM 0 HG3 MET B 176 -3.124 21.057 -1.772 1.00 0.00 H new ATOM 0 HE1 MET B 176 -5.152 21.647 -4.370 1.00 0.00 H new ATOM 0 HE2 MET B 176 -5.785 20.156 -3.632 1.00 0.00 H new ATOM 0 HE3 MET B 176 -4.935 21.354 -2.628 1.00 0.00 H new ATOM 852 N ASP B 177 1.825 19.512 -1.537 1.00 0.00 N ATOM 853 CA ASP B 177 3.112 18.862 -1.927 1.00 0.00 C ATOM 854 C ASP B 177 3.615 17.965 -0.793 1.00 0.00 C ATOM 855 O ASP B 177 4.298 16.985 -1.024 1.00 0.00 O ATOM 856 CB ASP B 177 4.087 20.014 -2.174 1.00 0.00 C ATOM 857 CG ASP B 177 4.056 20.401 -3.654 1.00 0.00 C ATOM 858 OD1 ASP B 177 4.599 19.655 -4.453 1.00 0.00 O ATOM 859 OD2 ASP B 177 3.491 21.436 -3.964 1.00 0.00 O ATOM 0 H ASP B 177 1.901 20.492 -1.265 1.00 0.00 H new ATOM 0 HA ASP B 177 3.002 18.230 -2.808 1.00 0.00 H new ATOM 0 HB2 ASP B 177 3.817 20.871 -1.557 1.00 0.00 H new ATOM 0 HB3 ASP B 177 5.096 19.719 -1.885 1.00 0.00 H new ATOM 864 N ARG B 178 3.278 18.293 0.427 1.00 0.00 N ATOM 865 CA ARG B 178 3.731 17.461 1.583 1.00 0.00 C ATOM 866 C ARG B 178 2.871 16.202 1.687 1.00 0.00 C ATOM 867 O ARG B 178 3.349 15.144 2.053 1.00 0.00 O ATOM 868 CB ARG B 178 3.544 18.346 2.815 1.00 0.00 C ATOM 869 CG ARG B 178 4.252 17.712 4.016 1.00 0.00 C ATOM 870 CD ARG B 178 4.872 18.809 4.885 1.00 0.00 C ATOM 871 NE ARG B 178 3.729 19.394 5.639 1.00 0.00 N ATOM 872 CZ ARG B 178 3.930 19.946 6.804 1.00 0.00 C ATOM 873 NH1 ARG B 178 4.654 19.333 7.701 1.00 0.00 N ATOM 874 NH2 ARG B 178 3.406 21.110 7.074 1.00 0.00 N ATOM 0 H ARG B 178 2.708 19.102 0.674 1.00 0.00 H new ATOM 0 HA ARG B 178 4.766 17.134 1.478 1.00 0.00 H new ATOM 0 HB2 ARG B 178 3.948 19.340 2.625 1.00 0.00 H new ATOM 0 HB3 ARG B 178 2.482 18.469 3.029 1.00 0.00 H new ATOM 0 HG2 ARG B 178 3.543 17.127 4.602 1.00 0.00 H new ATOM 0 HG3 ARG B 178 5.026 17.025 3.674 1.00 0.00 H new ATOM 0 HD2 ARG B 178 5.623 18.400 5.561 1.00 0.00 H new ATOM 0 HD3 ARG B 178 5.369 19.563 4.274 1.00 0.00 H new ATOM 0 HE ARG B 178 2.789 19.363 5.245 1.00 0.00 H new ATOM 0 HH11 ARG B 178 5.063 18.422 7.491 1.00 0.00 H new ATOM 0 HH12 ARG B 178 4.811 19.765 8.612 1.00 0.00 H new ATOM 0 HH21 ARG B 178 2.839 21.589 6.374 1.00 0.00 H new ATOM 0 HH22 ARG B 178 3.563 21.541 7.985 1.00 0.00 H new ATOM 888 N VAL B 179 1.611 16.308 1.357 1.00 0.00 N ATOM 889 CA VAL B 179 0.715 15.114 1.423 1.00 0.00 C ATOM 890 C VAL B 179 1.039 14.168 0.264 1.00 0.00 C ATOM 891 O VAL B 179 0.873 12.968 0.370 1.00 0.00 O ATOM 892 CB VAL B 179 -0.708 15.667 1.302 1.00 0.00 C ATOM 893 CG1 VAL B 179 -1.718 14.516 1.333 1.00 0.00 C ATOM 894 CG2 VAL B 179 -0.985 16.609 2.476 1.00 0.00 C ATOM 0 H VAL B 179 1.163 17.169 1.045 1.00 0.00 H new ATOM 0 HA VAL B 179 0.838 14.546 2.345 1.00 0.00 H new ATOM 0 HB VAL B 179 -0.804 16.207 0.360 1.00 0.00 H new ATOM 0 HG11 VAL B 179 -2.728 14.916 1.247 1.00 0.00 H new ATOM 0 HG12 VAL B 179 -1.523 13.839 0.501 1.00 0.00 H new ATOM 0 HG13 VAL B 179 -1.622 13.973 2.273 1.00 0.00 H new ATOM 0 HG21 VAL B 179 -1.997 17.005 2.394 1.00 0.00 H new ATOM 0 HG22 VAL B 179 -0.885 16.062 3.413 1.00 0.00 H new ATOM 0 HG23 VAL B 179 -0.271 17.432 2.458 1.00 0.00 H new ATOM 904 N ASP B 180 1.508 14.703 -0.835 1.00 0.00 N ATOM 905 CA ASP B 180 1.854 13.838 -2.002 1.00 0.00 C ATOM 906 C ASP B 180 3.079 12.983 -1.672 1.00 0.00 C ATOM 907 O ASP B 180 3.234 11.885 -2.172 1.00 0.00 O ATOM 908 CB ASP B 180 2.165 14.805 -3.147 1.00 0.00 C ATOM 909 CG ASP B 180 1.796 14.154 -4.481 1.00 0.00 C ATOM 910 OD1 ASP B 180 0.681 13.672 -4.594 1.00 0.00 O ATOM 911 OD2 ASP B 180 2.635 14.149 -5.367 1.00 0.00 O ATOM 0 H ASP B 180 1.666 15.701 -0.974 1.00 0.00 H new ATOM 0 HA ASP B 180 1.045 13.155 -2.263 1.00 0.00 H new ATOM 0 HB2 ASP B 180 1.606 15.732 -3.016 1.00 0.00 H new ATOM 0 HB3 ASP B 180 3.223 15.067 -3.139 1.00 0.00 H new ATOM 916 N ARG B 181 3.946 13.480 -0.826 1.00 0.00 N ATOM 917 CA ARG B 181 5.164 12.699 -0.450 1.00 0.00 C ATOM 918 C ARG B 181 4.786 11.575 0.520 1.00 0.00 C ATOM 919 O ARG B 181 5.435 10.547 0.572 1.00 0.00 O ATOM 920 CB ARG B 181 6.095 13.704 0.230 1.00 0.00 C ATOM 921 CG ARG B 181 6.598 14.713 -0.804 1.00 0.00 C ATOM 922 CD ARG B 181 7.195 15.925 -0.087 1.00 0.00 C ATOM 923 NE ARG B 181 8.424 15.411 0.579 1.00 0.00 N ATOM 924 CZ ARG B 181 9.424 16.217 0.814 1.00 0.00 C ATOM 925 NH1 ARG B 181 9.875 16.992 -0.132 1.00 0.00 N ATOM 926 NH2 ARG B 181 9.971 16.247 1.999 1.00 0.00 N ATOM 0 H ARG B 181 3.863 14.393 -0.379 1.00 0.00 H new ATOM 0 HA ARG B 181 5.637 12.233 -1.314 1.00 0.00 H new ATOM 0 HB2 ARG B 181 5.567 14.221 1.031 1.00 0.00 H new ATOM 0 HB3 ARG B 181 6.937 13.184 0.687 1.00 0.00 H new ATOM 0 HG2 ARG B 181 7.349 14.250 -1.444 1.00 0.00 H new ATOM 0 HG3 ARG B 181 5.778 15.027 -1.450 1.00 0.00 H new ATOM 0 HD2 ARG B 181 7.432 16.723 -0.791 1.00 0.00 H new ATOM 0 HD3 ARG B 181 6.495 16.338 0.640 1.00 0.00 H new ATOM 0 HE ARG B 181 8.484 14.430 0.851 1.00 0.00 H new ATOM 0 HH11 ARG B 181 9.447 16.969 -1.057 1.00 0.00 H new ATOM 0 HH12 ARG B 181 10.656 17.621 0.053 1.00 0.00 H new ATOM 0 HH21 ARG B 181 9.617 15.641 2.740 1.00 0.00 H new ATOM 0 HH22 ARG B 181 10.752 16.876 2.184 1.00 0.00 H new ATOM 940 N GLU B 182 3.738 11.763 1.282 1.00 0.00 N ATOM 941 CA GLU B 182 3.310 10.707 2.250 1.00 0.00 C ATOM 942 C GLU B 182 2.621 9.561 1.506 1.00 0.00 C ATOM 943 O GLU B 182 2.741 8.409 1.878 1.00 0.00 O ATOM 944 CB GLU B 182 2.326 11.401 3.195 1.00 0.00 C ATOM 945 CG GLU B 182 2.405 10.754 4.578 1.00 0.00 C ATOM 946 CD GLU B 182 1.885 11.734 5.631 1.00 0.00 C ATOM 947 OE1 GLU B 182 0.677 11.862 5.748 1.00 0.00 O ATOM 948 OE2 GLU B 182 2.704 12.340 6.304 1.00 0.00 O ATOM 0 H GLU B 182 3.160 12.603 1.276 1.00 0.00 H new ATOM 0 HA GLU B 182 4.154 10.277 2.790 1.00 0.00 H new ATOM 0 HB2 GLU B 182 2.560 12.463 3.265 1.00 0.00 H new ATOM 0 HB3 GLU B 182 1.312 11.323 2.803 1.00 0.00 H new ATOM 0 HG2 GLU B 182 1.815 9.837 4.596 1.00 0.00 H new ATOM 0 HG3 GLU B 182 3.435 10.475 4.802 1.00 0.00 H new ATOM 955 N ILE B 183 1.908 9.873 0.453 1.00 0.00 N ATOM 956 CA ILE B 183 1.214 8.803 -0.325 1.00 0.00 C ATOM 957 C ILE B 183 2.243 7.973 -1.099 1.00 0.00 C ATOM 958 O ILE B 183 2.038 6.803 -1.359 1.00 0.00 O ATOM 959 CB ILE B 183 0.273 9.543 -1.284 1.00 0.00 C ATOM 960 CG1 ILE B 183 -0.728 10.373 -0.476 1.00 0.00 C ATOM 961 CG2 ILE B 183 -0.491 8.532 -2.143 1.00 0.00 C ATOM 962 CD1 ILE B 183 -1.559 11.240 -1.425 1.00 0.00 C ATOM 0 H ILE B 183 1.777 10.821 0.099 1.00 0.00 H new ATOM 0 HA ILE B 183 0.665 8.113 0.316 1.00 0.00 H new ATOM 0 HB ILE B 183 0.860 10.197 -1.928 1.00 0.00 H new ATOM 0 HG12 ILE B 183 -1.381 9.716 0.098 1.00 0.00 H new ATOM 0 HG13 ILE B 183 -0.200 11.003 0.240 1.00 0.00 H new ATOM 0 HG21 ILE B 183 -1.158 9.062 -2.822 1.00 0.00 H new ATOM 0 HG22 ILE B 183 0.217 7.937 -2.720 1.00 0.00 H new ATOM 0 HG23 ILE B 183 -1.076 7.876 -1.499 1.00 0.00 H new ATOM 0 HD11 ILE B 183 -2.271 11.830 -0.849 1.00 0.00 H new ATOM 0 HD12 ILE B 183 -0.899 11.907 -1.980 1.00 0.00 H new ATOM 0 HD13 ILE B 183 -2.099 10.600 -2.123 1.00 0.00 H new ATOM 974 N THR B 184 3.350 8.572 -1.460 1.00 0.00 N ATOM 975 CA THR B 184 4.403 7.822 -2.209 1.00 0.00 C ATOM 976 C THR B 184 5.067 6.799 -1.284 1.00 0.00 C ATOM 977 O THR B 184 5.461 5.730 -1.710 1.00 0.00 O ATOM 978 CB THR B 184 5.416 8.878 -2.658 1.00 0.00 C ATOM 979 OG1 THR B 184 4.767 10.137 -2.775 1.00 0.00 O ATOM 980 CG2 THR B 184 6.006 8.479 -4.012 1.00 0.00 C ATOM 0 H THR B 184 3.570 9.549 -1.268 1.00 0.00 H new ATOM 0 HA THR B 184 3.994 7.275 -3.058 1.00 0.00 H new ATOM 0 HB THR B 184 6.217 8.949 -1.922 1.00 0.00 H new ATOM 0 HG1 THR B 184 5.415 10.814 -3.061 1.00 0.00 H new ATOM 0 HG21 THR B 184 6.727 9.232 -4.331 1.00 0.00 H new ATOM 0 HG22 THR B 184 6.505 7.514 -3.921 1.00 0.00 H new ATOM 0 HG23 THR B 184 5.207 8.407 -4.750 1.00 0.00 H new ATOM 988 N MET B 185 5.188 7.122 -0.021 1.00 0.00 N ATOM 989 CA MET B 185 5.822 6.171 0.942 1.00 0.00 C ATOM 990 C MET B 185 4.907 4.964 1.159 1.00 0.00 C ATOM 991 O MET B 185 5.349 3.829 1.142 1.00 0.00 O ATOM 992 CB MET B 185 5.989 6.960 2.242 1.00 0.00 C ATOM 993 CG MET B 185 7.303 6.561 2.916 1.00 0.00 C ATOM 994 SD MET B 185 7.637 7.683 4.296 1.00 0.00 S ATOM 995 CE MET B 185 8.843 8.733 3.446 1.00 0.00 C ATOM 0 H MET B 185 4.875 8.004 0.385 1.00 0.00 H new ATOM 0 HA MET B 185 6.777 5.791 0.579 1.00 0.00 H new ATOM 0 HB2 MET B 185 5.985 8.030 2.034 1.00 0.00 H new ATOM 0 HB3 MET B 185 5.151 6.762 2.910 1.00 0.00 H new ATOM 0 HG2 MET B 185 7.243 5.534 3.275 1.00 0.00 H new ATOM 0 HG3 MET B 185 8.120 6.600 2.196 1.00 0.00 H new ATOM 0 HE1 MET B 185 9.191 9.511 4.125 1.00 0.00 H new ATOM 0 HE2 MET B 185 9.690 8.127 3.124 1.00 0.00 H new ATOM 0 HE3 MET B 185 8.375 9.193 2.576 1.00 0.00 H new ATOM 1005 N VAL B 186 3.636 5.202 1.358 1.00 0.00 N ATOM 1006 CA VAL B 186 2.682 4.070 1.570 1.00 0.00 C ATOM 1007 C VAL B 186 2.501 3.299 0.261 1.00 0.00 C ATOM 1008 O VAL B 186 2.277 2.103 0.259 1.00 0.00 O ATOM 1009 CB VAL B 186 1.363 4.719 2.006 1.00 0.00 C ATOM 1010 CG1 VAL B 186 0.320 3.634 2.284 1.00 0.00 C ATOM 1011 CG2 VAL B 186 1.589 5.539 3.280 1.00 0.00 C ATOM 0 H VAL B 186 3.217 6.131 1.383 1.00 0.00 H new ATOM 0 HA VAL B 186 3.039 3.361 2.317 1.00 0.00 H new ATOM 0 HB VAL B 186 1.006 5.372 1.209 1.00 0.00 H new ATOM 0 HG11 VAL B 186 -0.616 4.100 2.594 1.00 0.00 H new ATOM 0 HG12 VAL B 186 0.153 3.050 1.379 1.00 0.00 H new ATOM 0 HG13 VAL B 186 0.679 2.979 3.078 1.00 0.00 H new ATOM 0 HG21 VAL B 186 0.650 5.999 3.588 1.00 0.00 H new ATOM 0 HG22 VAL B 186 1.950 4.885 4.074 1.00 0.00 H new ATOM 0 HG23 VAL B 186 2.328 6.317 3.086 1.00 0.00 H new ATOM 1021 N GLU B 187 2.606 3.980 -0.851 1.00 0.00 N ATOM 1022 CA GLU B 187 2.451 3.297 -2.171 1.00 0.00 C ATOM 1023 C GLU B 187 3.705 2.477 -2.483 1.00 0.00 C ATOM 1024 O GLU B 187 3.646 1.471 -3.165 1.00 0.00 O ATOM 1025 CB GLU B 187 2.279 4.425 -3.190 1.00 0.00 C ATOM 1026 CG GLU B 187 1.877 3.835 -4.543 1.00 0.00 C ATOM 1027 CD GLU B 187 1.125 4.890 -5.358 1.00 0.00 C ATOM 1028 OE1 GLU B 187 0.114 5.373 -4.876 1.00 0.00 O ATOM 1029 OE2 GLU B 187 1.575 5.198 -6.449 1.00 0.00 O ATOM 0 H GLU B 187 2.793 4.981 -0.902 1.00 0.00 H new ATOM 0 HA GLU B 187 1.605 2.610 -2.185 1.00 0.00 H new ATOM 0 HB2 GLU B 187 1.518 5.126 -2.847 1.00 0.00 H new ATOM 0 HB3 GLU B 187 3.209 4.986 -3.288 1.00 0.00 H new ATOM 0 HG2 GLU B 187 2.763 3.505 -5.085 1.00 0.00 H new ATOM 0 HG3 GLU B 187 1.248 2.957 -4.396 1.00 0.00 H new ATOM 1036 N GLN B 188 4.839 2.901 -1.981 1.00 0.00 N ATOM 1037 CA GLN B 188 6.105 2.149 -2.238 1.00 0.00 C ATOM 1038 C GLN B 188 6.120 0.854 -1.421 1.00 0.00 C ATOM 1039 O GLN B 188 6.723 -0.128 -1.812 1.00 0.00 O ATOM 1040 CB GLN B 188 7.229 3.083 -1.785 1.00 0.00 C ATOM 1041 CG GLN B 188 7.561 4.068 -2.908 1.00 0.00 C ATOM 1042 CD GLN B 188 8.140 3.308 -4.102 1.00 0.00 C ATOM 1043 OE1 GLN B 188 9.243 2.802 -4.039 1.00 0.00 O ATOM 1044 NE2 GLN B 188 7.437 3.205 -5.196 1.00 0.00 N ATOM 0 H GLN B 188 4.942 3.736 -1.404 1.00 0.00 H new ATOM 0 HA GLN B 188 6.212 1.869 -3.286 1.00 0.00 H new ATOM 0 HB2 GLN B 188 6.926 3.625 -0.889 1.00 0.00 H new ATOM 0 HB3 GLN B 188 8.114 2.503 -1.523 1.00 0.00 H new ATOM 0 HG2 GLN B 188 6.663 4.608 -3.209 1.00 0.00 H new ATOM 0 HG3 GLN B 188 8.277 4.810 -2.555 1.00 0.00 H new ATOM 0 HE21 GLN B 188 6.511 3.630 -5.249 1.00 0.00 H new ATOM 0 HE22 GLN B 188 7.813 2.700 -5.998 1.00 0.00 H new ATOM 1053 N GLN B 189 5.460 0.850 -0.291 1.00 0.00 N ATOM 1054 CA GLN B 189 5.431 -0.379 0.559 1.00 0.00 C ATOM 1055 C GLN B 189 4.526 -1.436 -0.079 1.00 0.00 C ATOM 1056 O GLN B 189 4.794 -2.620 -0.005 1.00 0.00 O ATOM 1057 CB GLN B 189 4.858 0.076 1.905 1.00 0.00 C ATOM 1058 CG GLN B 189 5.614 -0.612 3.048 1.00 0.00 C ATOM 1059 CD GLN B 189 6.673 0.339 3.612 1.00 0.00 C ATOM 1060 OE1 GLN B 189 6.879 0.395 4.808 1.00 0.00 O ATOM 1061 NE2 GLN B 189 7.358 1.093 2.796 1.00 0.00 N ATOM 0 H GLN B 189 4.940 1.645 0.080 1.00 0.00 H new ATOM 0 HA GLN B 189 6.419 -0.827 0.671 1.00 0.00 H new ATOM 0 HB2 GLN B 189 4.943 1.159 2.000 1.00 0.00 H new ATOM 0 HB3 GLN B 189 3.797 -0.167 1.960 1.00 0.00 H new ATOM 0 HG2 GLN B 189 4.917 -0.903 3.834 1.00 0.00 H new ATOM 0 HG3 GLN B 189 6.087 -1.525 2.686 1.00 0.00 H new ATOM 0 HE21 GLN B 189 7.185 1.046 1.792 1.00 0.00 H new ATOM 0 HE22 GLN B 189 8.066 1.729 3.162 1.00 0.00 H new ATOM 1070 N ILE B 190 3.458 -1.012 -0.705 1.00 0.00 N ATOM 1071 CA ILE B 190 2.528 -1.987 -1.354 1.00 0.00 C ATOM 1072 C ILE B 190 3.196 -2.599 -2.590 1.00 0.00 C ATOM 1073 O ILE B 190 2.928 -3.727 -2.954 1.00 0.00 O ATOM 1074 CB ILE B 190 1.291 -1.172 -1.748 1.00 0.00 C ATOM 1075 CG1 ILE B 190 0.674 -0.547 -0.491 1.00 0.00 C ATOM 1076 CG2 ILE B 190 0.262 -2.090 -2.416 1.00 0.00 C ATOM 1077 CD1 ILE B 190 -0.498 0.358 -0.881 1.00 0.00 C ATOM 0 H ILE B 190 3.189 -0.032 -0.795 1.00 0.00 H new ATOM 0 HA ILE B 190 2.264 -2.812 -0.692 1.00 0.00 H new ATOM 0 HB ILE B 190 1.581 -0.386 -2.445 1.00 0.00 H new ATOM 0 HG12 ILE B 190 0.331 -1.331 0.184 1.00 0.00 H new ATOM 0 HG13 ILE B 190 1.427 0.030 0.046 1.00 0.00 H new ATOM 0 HG21 ILE B 190 -0.617 -1.509 -2.695 1.00 0.00 H new ATOM 0 HG22 ILE B 190 0.699 -2.538 -3.308 1.00 0.00 H new ATOM 0 HG23 ILE B 190 -0.030 -2.877 -1.720 1.00 0.00 H new ATOM 0 HD11 ILE B 190 -0.932 0.799 0.017 1.00 0.00 H new ATOM 0 HD12 ILE B 190 -0.142 1.151 -1.539 1.00 0.00 H new ATOM 0 HD13 ILE B 190 -1.256 -0.230 -1.399 1.00 0.00 H new ATOM 1089 N SER B 191 4.067 -1.860 -3.228 1.00 0.00 N ATOM 1090 CA SER B 191 4.763 -2.394 -4.437 1.00 0.00 C ATOM 1091 C SER B 191 5.784 -3.453 -4.021 1.00 0.00 C ATOM 1092 O SER B 191 5.936 -4.470 -4.672 1.00 0.00 O ATOM 1093 CB SER B 191 5.463 -1.190 -5.068 1.00 0.00 C ATOM 1094 OG SER B 191 4.645 -0.661 -6.103 1.00 0.00 O ATOM 0 H SER B 191 4.326 -0.910 -2.964 1.00 0.00 H new ATOM 0 HA SER B 191 4.073 -2.867 -5.136 1.00 0.00 H new ATOM 0 HB2 SER B 191 5.652 -0.427 -4.312 1.00 0.00 H new ATOM 0 HB3 SER B 191 6.432 -1.487 -5.470 1.00 0.00 H new ATOM 0 HG SER B 191 5.090 0.112 -6.509 1.00 0.00 H new ATOM 1100 N LYS B 192 6.476 -3.225 -2.933 1.00 0.00 N ATOM 1101 CA LYS B 192 7.482 -4.222 -2.462 1.00 0.00 C ATOM 1102 C LYS B 192 6.761 -5.428 -1.858 1.00 0.00 C ATOM 1103 O LYS B 192 7.239 -6.545 -1.923 1.00 0.00 O ATOM 1104 CB LYS B 192 8.306 -3.496 -1.397 1.00 0.00 C ATOM 1105 CG LYS B 192 9.178 -2.431 -2.066 1.00 0.00 C ATOM 1106 CD LYS B 192 10.482 -2.272 -1.281 1.00 0.00 C ATOM 1107 CE LYS B 192 11.624 -1.946 -2.247 1.00 0.00 C ATOM 1108 NZ LYS B 192 11.677 -0.459 -2.292 1.00 0.00 N ATOM 0 H LYS B 192 6.387 -2.392 -2.352 1.00 0.00 H new ATOM 0 HA LYS B 192 8.114 -4.591 -3.270 1.00 0.00 H new ATOM 0 HB2 LYS B 192 7.646 -3.033 -0.664 1.00 0.00 H new ATOM 0 HB3 LYS B 192 8.931 -4.208 -0.858 1.00 0.00 H new ATOM 0 HG2 LYS B 192 9.393 -2.716 -3.096 1.00 0.00 H new ATOM 0 HG3 LYS B 192 8.645 -1.481 -2.103 1.00 0.00 H new ATOM 0 HD2 LYS B 192 10.379 -1.478 -0.542 1.00 0.00 H new ATOM 0 HD3 LYS B 192 10.704 -3.189 -0.735 1.00 0.00 H new ATOM 0 HE2 LYS B 192 12.568 -2.364 -1.898 1.00 0.00 H new ATOM 0 HE3 LYS B 192 11.436 -2.364 -3.236 1.00 0.00 H new ATOM 0 HZ1 LYS B 192 12.437 -0.158 -2.935 1.00 0.00 H new ATOM 0 HZ2 LYS B 192 10.767 -0.089 -2.634 1.00 0.00 H new ATOM 0 HZ3 LYS B 192 11.864 -0.089 -1.338 1.00 0.00 H new ATOM 1122 N LEU B 193 5.606 -5.208 -1.281 1.00 0.00 N ATOM 1123 CA LEU B 193 4.836 -6.339 -0.683 1.00 0.00 C ATOM 1124 C LEU B 193 4.256 -7.206 -1.802 1.00 0.00 C ATOM 1125 O LEU B 193 4.102 -8.404 -1.655 1.00 0.00 O ATOM 1126 CB LEU B 193 3.715 -5.686 0.141 1.00 0.00 C ATOM 1127 CG LEU B 193 3.879 -6.050 1.621 1.00 0.00 C ATOM 1128 CD1 LEU B 193 3.464 -4.862 2.492 1.00 0.00 C ATOM 1129 CD2 LEU B 193 2.996 -7.257 1.951 1.00 0.00 C ATOM 0 H LEU B 193 5.164 -4.293 -1.199 1.00 0.00 H new ATOM 0 HA LEU B 193 5.456 -6.983 -0.060 1.00 0.00 H new ATOM 0 HB2 LEU B 193 3.744 -4.603 0.018 1.00 0.00 H new ATOM 0 HB3 LEU B 193 2.743 -6.022 -0.220 1.00 0.00 H new ATOM 0 HG LEU B 193 4.922 -6.296 1.819 1.00 0.00 H new ATOM 0 HD11 LEU B 193 3.581 -5.123 3.544 1.00 0.00 H new ATOM 0 HD12 LEU B 193 4.093 -4.003 2.259 1.00 0.00 H new ATOM 0 HD13 LEU B 193 2.421 -4.613 2.294 1.00 0.00 H new ATOM 0 HD21 LEU B 193 3.112 -7.516 3.003 1.00 0.00 H new ATOM 0 HD22 LEU B 193 1.953 -7.010 1.751 1.00 0.00 H new ATOM 0 HD23 LEU B 193 3.293 -8.105 1.334 1.00 0.00 H new ATOM 1141 N LYS B 194 3.944 -6.606 -2.925 1.00 0.00 N ATOM 1142 CA LYS B 194 3.385 -7.392 -4.066 1.00 0.00 C ATOM 1143 C LYS B 194 4.471 -8.303 -4.637 1.00 0.00 C ATOM 1144 O LYS B 194 4.252 -9.478 -4.862 1.00 0.00 O ATOM 1145 CB LYS B 194 2.951 -6.354 -5.103 1.00 0.00 C ATOM 1146 CG LYS B 194 1.664 -6.819 -5.785 1.00 0.00 C ATOM 1147 CD LYS B 194 0.478 -6.597 -4.844 1.00 0.00 C ATOM 1148 CE LYS B 194 0.048 -5.130 -4.901 1.00 0.00 C ATOM 1149 NZ LYS B 194 -1.057 -5.092 -5.900 1.00 0.00 N ATOM 0 H LYS B 194 4.053 -5.607 -3.099 1.00 0.00 H new ATOM 0 HA LYS B 194 2.550 -8.026 -3.766 1.00 0.00 H new ATOM 0 HB2 LYS B 194 2.792 -5.389 -4.622 1.00 0.00 H new ATOM 0 HB3 LYS B 194 3.738 -6.215 -5.844 1.00 0.00 H new ATOM 0 HG2 LYS B 194 1.513 -6.269 -6.714 1.00 0.00 H new ATOM 0 HG3 LYS B 194 1.740 -7.874 -6.048 1.00 0.00 H new ATOM 0 HD2 LYS B 194 -0.353 -7.242 -5.131 1.00 0.00 H new ATOM 0 HD3 LYS B 194 0.754 -6.867 -3.825 1.00 0.00 H new ATOM 0 HE2 LYS B 194 -0.289 -4.779 -3.926 1.00 0.00 H new ATOM 0 HE3 LYS B 194 0.875 -4.487 -5.202 1.00 0.00 H new ATOM 0 HZ1 LYS B 194 -1.406 -4.117 -5.995 1.00 0.00 H new ATOM 0 HZ2 LYS B 194 -0.705 -5.425 -6.820 1.00 0.00 H new ATOM 0 HZ3 LYS B 194 -1.833 -5.708 -5.583 1.00 0.00 H new ATOM 1163 N LYS B 195 5.648 -7.770 -4.855 1.00 0.00 N ATOM 1164 CA LYS B 195 6.762 -8.608 -5.391 1.00 0.00 C ATOM 1165 C LYS B 195 7.180 -9.626 -4.331 1.00 0.00 C ATOM 1166 O LYS B 195 7.595 -10.727 -4.641 1.00 0.00 O ATOM 1167 CB LYS B 195 7.900 -7.629 -5.685 1.00 0.00 C ATOM 1168 CG LYS B 195 8.622 -8.052 -6.966 1.00 0.00 C ATOM 1169 CD LYS B 195 9.627 -9.159 -6.645 1.00 0.00 C ATOM 1170 CE LYS B 195 10.139 -9.777 -7.949 1.00 0.00 C ATOM 1171 NZ LYS B 195 9.090 -10.758 -8.347 1.00 0.00 N ATOM 0 H LYS B 195 5.884 -6.792 -4.685 1.00 0.00 H new ATOM 0 HA LYS B 195 6.480 -9.164 -6.285 1.00 0.00 H new ATOM 0 HB2 LYS B 195 7.505 -6.619 -5.795 1.00 0.00 H new ATOM 0 HB3 LYS B 195 8.601 -7.609 -4.850 1.00 0.00 H new ATOM 0 HG2 LYS B 195 7.900 -8.404 -7.703 1.00 0.00 H new ATOM 0 HG3 LYS B 195 9.135 -7.197 -7.406 1.00 0.00 H new ATOM 0 HD2 LYS B 195 10.460 -8.753 -6.071 1.00 0.00 H new ATOM 0 HD3 LYS B 195 9.157 -9.924 -6.027 1.00 0.00 H new ATOM 0 HE2 LYS B 195 10.281 -9.017 -8.717 1.00 0.00 H new ATOM 0 HE3 LYS B 195 11.102 -10.266 -7.803 1.00 0.00 H new ATOM 0 HZ1 LYS B 195 9.483 -11.720 -8.312 1.00 0.00 H new ATOM 0 HZ2 LYS B 195 8.284 -10.689 -7.693 1.00 0.00 H new ATOM 0 HZ3 LYS B 195 8.770 -10.550 -9.314 1.00 0.00 H new ATOM 1185 N LYS B 196 7.058 -9.264 -3.078 1.00 0.00 N ATOM 1186 CA LYS B 196 7.429 -10.206 -1.980 1.00 0.00 C ATOM 1187 C LYS B 196 6.477 -11.403 -1.993 1.00 0.00 C ATOM 1188 O LYS B 196 6.860 -12.515 -1.683 1.00 0.00 O ATOM 1189 CB LYS B 196 7.269 -9.398 -0.687 1.00 0.00 C ATOM 1190 CG LYS B 196 7.640 -10.265 0.519 1.00 0.00 C ATOM 1191 CD LYS B 196 6.911 -9.748 1.763 1.00 0.00 C ATOM 1192 CE LYS B 196 5.401 -9.944 1.591 1.00 0.00 C ATOM 1193 NZ LYS B 196 4.885 -10.164 2.971 1.00 0.00 N ATOM 0 H LYS B 196 6.716 -8.354 -2.769 1.00 0.00 H new ATOM 0 HA LYS B 196 8.442 -10.596 -2.084 1.00 0.00 H new ATOM 0 HB2 LYS B 196 7.905 -8.514 -0.720 1.00 0.00 H new ATOM 0 HB3 LYS B 196 6.241 -9.048 -0.592 1.00 0.00 H new ATOM 0 HG2 LYS B 196 7.369 -11.304 0.331 1.00 0.00 H new ATOM 0 HG3 LYS B 196 8.718 -10.241 0.680 1.00 0.00 H new ATOM 0 HD2 LYS B 196 7.259 -10.280 2.648 1.00 0.00 H new ATOM 0 HD3 LYS B 196 7.136 -8.693 1.917 1.00 0.00 H new ATOM 0 HE2 LYS B 196 4.939 -9.071 1.131 1.00 0.00 H new ATOM 0 HE3 LYS B 196 5.184 -10.796 0.947 1.00 0.00 H new ATOM 0 HZ1 LYS B 196 3.915 -9.796 3.042 1.00 0.00 H new ATOM 0 HZ2 LYS B 196 4.886 -11.182 3.184 1.00 0.00 H new ATOM 0 HZ3 LYS B 196 5.494 -9.667 3.653 1.00 0.00 H new ATOM 1207 N GLN B 197 5.242 -11.178 -2.361 1.00 0.00 N ATOM 1208 CA GLN B 197 4.255 -12.299 -2.409 1.00 0.00 C ATOM 1209 C GLN B 197 4.670 -13.306 -3.483 1.00 0.00 C ATOM 1210 O GLN B 197 4.406 -14.489 -3.373 1.00 0.00 O ATOM 1211 CB GLN B 197 2.918 -11.648 -2.771 1.00 0.00 C ATOM 1212 CG GLN B 197 1.810 -12.703 -2.737 1.00 0.00 C ATOM 1213 CD GLN B 197 1.592 -13.169 -1.297 1.00 0.00 C ATOM 1214 OE1 GLN B 197 0.745 -12.649 -0.599 1.00 0.00 O ATOM 1215 NE2 GLN B 197 2.327 -14.136 -0.818 1.00 0.00 N ATOM 0 H GLN B 197 4.874 -10.266 -2.631 1.00 0.00 H new ATOM 0 HA GLN B 197 4.194 -12.838 -1.464 1.00 0.00 H new ATOM 0 HB2 GLN B 197 2.691 -10.845 -2.070 1.00 0.00 H new ATOM 0 HB3 GLN B 197 2.977 -11.199 -3.762 1.00 0.00 H new ATOM 0 HG2 GLN B 197 0.886 -12.288 -3.140 1.00 0.00 H new ATOM 0 HG3 GLN B 197 2.081 -13.550 -3.367 1.00 0.00 H new ATOM 0 HE21 GLN B 197 3.039 -14.574 -1.403 1.00 0.00 H new ATOM 0 HE22 GLN B 197 2.189 -14.454 0.141 1.00 0.00 H new ATOM 1224 N GLN B 198 5.325 -12.842 -4.516 1.00 0.00 N ATOM 1225 CA GLN B 198 5.770 -13.765 -5.605 1.00 0.00 C ATOM 1226 C GLN B 198 6.762 -14.784 -5.050 1.00 0.00 C ATOM 1227 O GLN B 198 6.701 -15.958 -5.363 1.00 0.00 O ATOM 1228 CB GLN B 198 6.449 -12.869 -6.644 1.00 0.00 C ATOM 1229 CG GLN B 198 6.335 -13.515 -8.026 1.00 0.00 C ATOM 1230 CD GLN B 198 4.986 -13.152 -8.649 1.00 0.00 C ATOM 1231 OE1 GLN B 198 4.250 -14.018 -9.080 1.00 0.00 O ATOM 1232 NE2 GLN B 198 4.629 -11.900 -8.715 1.00 0.00 N ATOM 0 H GLN B 198 5.572 -11.862 -4.653 1.00 0.00 H new ATOM 0 HA GLN B 198 4.939 -14.324 -6.036 1.00 0.00 H new ATOM 0 HB2 GLN B 198 5.982 -11.884 -6.651 1.00 0.00 H new ATOM 0 HB3 GLN B 198 7.497 -12.723 -6.384 1.00 0.00 H new ATOM 0 HG2 GLN B 198 7.147 -13.173 -8.667 1.00 0.00 H new ATOM 0 HG3 GLN B 198 6.429 -14.598 -7.942 1.00 0.00 H new ATOM 0 HE21 GLN B 198 5.247 -11.174 -8.353 1.00 0.00 H new ATOM 0 HE22 GLN B 198 3.732 -11.647 -9.128 1.00 0.00 H new ATOM 1241 N GLN B 199 7.674 -14.340 -4.225 1.00 0.00 N ATOM 1242 CA GLN B 199 8.680 -15.278 -3.635 1.00 0.00 C ATOM 1243 C GLN B 199 7.970 -16.350 -2.806 1.00 0.00 C ATOM 1244 O GLN B 199 8.268 -17.525 -2.909 1.00 0.00 O ATOM 1245 CB GLN B 199 9.570 -14.411 -2.743 1.00 0.00 C ATOM 1246 CG GLN B 199 10.709 -13.821 -3.577 1.00 0.00 C ATOM 1247 CD GLN B 199 11.109 -12.459 -3.006 1.00 0.00 C ATOM 1248 OE1 GLN B 199 11.665 -12.379 -1.929 1.00 0.00 O ATOM 1249 NE2 GLN B 199 10.845 -11.377 -3.687 1.00 0.00 N ATOM 0 H GLN B 199 7.767 -13.367 -3.933 1.00 0.00 H new ATOM 0 HA GLN B 199 9.260 -15.794 -4.400 1.00 0.00 H new ATOM 0 HB2 GLN B 199 8.982 -13.611 -2.293 1.00 0.00 H new ATOM 0 HB3 GLN B 199 9.975 -15.008 -1.926 1.00 0.00 H new ATOM 0 HG2 GLN B 199 11.565 -14.495 -3.571 1.00 0.00 H new ATOM 0 HG3 GLN B 199 10.395 -13.714 -4.615 1.00 0.00 H new ATOM 0 HE21 GLN B 199 10.378 -11.445 -4.591 1.00 0.00 H new ATOM 0 HE22 GLN B 199 11.106 -10.464 -3.315 1.00 0.00 H new ATOM 1258 N LEU B 200 7.027 -15.951 -1.991 1.00 0.00 N ATOM 1259 CA LEU B 200 6.285 -16.943 -1.156 1.00 0.00 C ATOM 1260 C LEU B 200 5.342 -17.759 -2.042 1.00 0.00 C ATOM 1261 O LEU B 200 5.064 -18.912 -1.770 1.00 0.00 O ATOM 1262 CB LEU B 200 5.490 -16.110 -0.148 1.00 0.00 C ATOM 1263 CG LEU B 200 5.044 -17.003 1.011 1.00 0.00 C ATOM 1264 CD1 LEU B 200 6.246 -17.325 1.901 1.00 0.00 C ATOM 1265 CD2 LEU B 200 3.982 -16.271 1.836 1.00 0.00 C ATOM 0 H LEU B 200 6.739 -14.980 -1.868 1.00 0.00 H new ATOM 0 HA LEU B 200 6.951 -17.646 -0.656 1.00 0.00 H new ATOM 0 HB2 LEU B 200 6.103 -15.290 0.226 1.00 0.00 H new ATOM 0 HB3 LEU B 200 4.622 -15.664 -0.633 1.00 0.00 H new ATOM 0 HG LEU B 200 4.627 -17.929 0.616 1.00 0.00 H new ATOM 0 HD11 LEU B 200 5.927 -17.961 2.727 1.00 0.00 H new ATOM 0 HD12 LEU B 200 7.004 -17.844 1.315 1.00 0.00 H new ATOM 0 HD13 LEU B 200 6.664 -16.399 2.297 1.00 0.00 H new ATOM 0 HD21 LEU B 200 3.662 -16.905 2.663 1.00 0.00 H new ATOM 0 HD22 LEU B 200 4.402 -15.345 2.230 1.00 0.00 H new ATOM 0 HD23 LEU B 200 3.125 -16.040 1.203 1.00 0.00 H new ATOM 1277 N GLU B 201 4.858 -17.169 -3.105 1.00 0.00 N ATOM 1278 CA GLU B 201 3.938 -17.905 -4.023 1.00 0.00 C ATOM 1279 C GLU B 201 4.748 -18.826 -4.936 1.00 0.00 C ATOM 1280 O GLU B 201 4.283 -19.875 -5.342 1.00 0.00 O ATOM 1281 CB GLU B 201 3.233 -16.822 -4.841 1.00 0.00 C ATOM 1282 CG GLU B 201 1.971 -16.366 -4.106 1.00 0.00 C ATOM 1283 CD GLU B 201 0.920 -15.920 -5.124 1.00 0.00 C ATOM 1284 OE1 GLU B 201 1.149 -14.920 -5.784 1.00 0.00 O ATOM 1285 OE2 GLU B 201 -0.096 -16.588 -5.227 1.00 0.00 O ATOM 0 H GLU B 201 5.061 -16.207 -3.377 1.00 0.00 H new ATOM 0 HA GLU B 201 3.225 -18.529 -3.484 1.00 0.00 H new ATOM 0 HB2 GLU B 201 3.902 -15.976 -4.996 1.00 0.00 H new ATOM 0 HB3 GLU B 201 2.973 -17.208 -5.827 1.00 0.00 H new ATOM 0 HG2 GLU B 201 1.579 -17.180 -3.496 1.00 0.00 H new ATOM 0 HG3 GLU B 201 2.208 -15.545 -3.429 1.00 0.00 H new