USER MOD reduce.3.24.130724 H: found=0, std=0, add=673, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 676 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 169 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 172 GLN : amide:sc= 0 X(o=0,f=-0.091) USER MOD Set 2.1: A 111 CYS SG : rot 180:sc= -0.0219 USER MOD Set 2.2: A 186 MET CE :methyl 153:sc= -0.282 (180deg=-1.39!) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 CYS SG : rot 31:sc= 0.179 USER MOD Single : A 99 GLN : amide:sc= -0.28 K(o=-0.28,f=-2.5!) USER MOD Single : A 102 GLN : amide:sc= -0.376 X(o=-0.38,f=0) USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 SER OG : rot 78:sc= -1.07 USER MOD Single : A 122 TYR OH : rot -34:sc= -0.192! USER MOD Single : A 123 THR OG1 : rot 85:sc= 1.25 USER MOD Single : A 125 GLN : amide:sc= -0.256 X(o=-0.26,f=-0.72) USER MOD Single : A 126 SER OG : rot 136:sc= 0.327 USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD Single : A 145 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00407) USER MOD Single : A 149 ASN : amide:sc= -0.276 X(o=-0.28,f=-0.047) USER MOD Single : A 150 GLN : amide:sc= -3.06! X(o=-3.1!,f=-2.8) USER MOD Single : A 151 THR OG1 : rot 180:sc= -0.173 USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 157 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 159 MET CE :methyl -158:sc= -0.484 (180deg=-0.807) USER MOD Single : A 162 HIS : no HD1:sc= -3.14 X(o=-3.1,f=-2.9) USER MOD Single : A 163 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 164 SER OG : rot 180:sc= 0 USER MOD Single : A 180 ASN : amide:sc= 0.0703 X(o=0.07,f=-0.27) USER MOD Single : A 182 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 183 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 185 SER OG : rot 180:sc= 0 USER MOD Single : A 187 TYR OH : rot 17:sc= -0.113 USER MOD ----------------------------------------------------------------- ATOM 142 N GLU A 89 14.501 6.452 -9.253 1.00 0.00 N ATOM 143 CA GLU A 89 14.047 5.743 -8.060 1.00 0.00 C ATOM 144 C GLU A 89 12.583 6.056 -7.762 1.00 0.00 C ATOM 145 O GLU A 89 11.840 5.199 -7.281 1.00 0.00 O ATOM 146 CB GLU A 89 14.917 6.115 -6.860 1.00 0.00 C ATOM 147 CG GLU A 89 14.569 5.346 -5.596 1.00 0.00 C ATOM 148 CD GLU A 89 14.919 6.110 -4.334 1.00 0.00 C ATOM 149 OE1 GLU A 89 14.633 7.325 -4.277 1.00 0.00 O ATOM 150 OE2 GLU A 89 15.479 5.494 -3.403 1.00 0.00 O ATOM 0 HA GLU A 89 14.137 4.673 -8.247 1.00 0.00 H new ATOM 0 HB2 GLU A 89 15.962 5.934 -7.109 1.00 0.00 H new ATOM 0 HB3 GLU A 89 14.816 7.183 -6.665 1.00 0.00 H new ATOM 0 HG2 GLU A 89 13.503 5.119 -5.595 1.00 0.00 H new ATOM 0 HG3 GLU A 89 15.098 4.393 -5.598 1.00 0.00 H new ATOM 157 N ASP A 90 12.175 7.285 -8.053 1.00 0.00 N ATOM 158 CA ASP A 90 10.796 7.696 -7.815 1.00 0.00 C ATOM 159 C ASP A 90 9.862 7.023 -8.815 1.00 0.00 C ATOM 160 O ASP A 90 8.833 6.459 -8.440 1.00 0.00 O ATOM 161 CB ASP A 90 10.667 9.217 -7.918 1.00 0.00 C ATOM 162 CG ASP A 90 9.629 9.775 -6.965 1.00 0.00 C ATOM 163 OD1 ASP A 90 9.780 9.577 -5.741 1.00 0.00 O ATOM 164 OD2 ASP A 90 8.665 10.411 -7.441 1.00 0.00 O ATOM 0 H ASP A 90 12.773 8.009 -8.451 1.00 0.00 H new ATOM 0 HA ASP A 90 10.514 7.388 -6.808 1.00 0.00 H new ATOM 0 HB2 ASP A 90 11.633 9.676 -7.708 1.00 0.00 H new ATOM 0 HB3 ASP A 90 10.401 9.488 -8.940 1.00 0.00 H new ATOM 169 N ILE A 91 10.229 7.086 -10.091 1.00 0.00 N ATOM 170 CA ILE A 91 9.425 6.486 -11.148 1.00 0.00 C ATOM 171 C ILE A 91 9.424 4.963 -11.046 1.00 0.00 C ATOM 172 O ILE A 91 8.373 4.330 -11.141 1.00 0.00 O ATOM 173 CB ILE A 91 9.927 6.904 -12.546 1.00 0.00 C ATOM 174 CG1 ILE A 91 9.833 8.425 -12.706 1.00 0.00 C ATOM 175 CG2 ILE A 91 9.129 6.195 -13.634 1.00 0.00 C ATOM 176 CD1 ILE A 91 10.053 8.905 -14.124 1.00 0.00 C ATOM 0 H ILE A 91 11.078 7.547 -10.417 1.00 0.00 H new ATOM 0 HA ILE A 91 8.407 6.852 -11.016 1.00 0.00 H new ATOM 0 HB ILE A 91 10.972 6.610 -12.647 1.00 0.00 H new ATOM 0 HG12 ILE A 91 8.851 8.756 -12.368 1.00 0.00 H new ATOM 0 HG13 ILE A 91 10.569 8.896 -12.055 1.00 0.00 H new ATOM 0 HG21 ILE A 91 9.497 6.502 -14.613 1.00 0.00 H new ATOM 0 HG22 ILE A 91 9.243 5.117 -13.525 1.00 0.00 H new ATOM 0 HG23 ILE A 91 8.075 6.459 -13.543 1.00 0.00 H new ATOM 0 HD11 ILE A 91 9.971 9.991 -14.157 1.00 0.00 H new ATOM 0 HD12 ILE A 91 11.046 8.606 -14.460 1.00 0.00 H new ATOM 0 HD13 ILE A 91 9.301 8.464 -14.778 1.00 0.00 H new ATOM 188 N THR A 92 10.603 4.377 -10.854 1.00 0.00 N ATOM 189 CA THR A 92 10.714 2.927 -10.744 1.00 0.00 C ATOM 190 C THR A 92 9.812 2.403 -9.626 1.00 0.00 C ATOM 191 O THR A 92 9.009 1.496 -9.845 1.00 0.00 O ATOM 192 CB THR A 92 12.170 2.503 -10.511 1.00 0.00 C ATOM 193 OG1 THR A 92 12.312 1.103 -10.668 1.00 0.00 O ATOM 194 CG2 THR A 92 12.697 2.862 -9.140 1.00 0.00 C ATOM 0 H THR A 92 11.487 4.879 -10.772 1.00 0.00 H new ATOM 0 HA THR A 92 10.384 2.489 -11.686 1.00 0.00 H new ATOM 0 HB THR A 92 12.748 3.052 -11.255 1.00 0.00 H new ATOM 0 HG1 THR A 92 13.247 0.850 -10.518 1.00 0.00 H new ATOM 0 HG21 THR A 92 13.732 2.531 -9.050 1.00 0.00 H new ATOM 0 HG22 THR A 92 12.649 3.942 -9.003 1.00 0.00 H new ATOM 0 HG23 THR A 92 12.091 2.372 -8.378 1.00 0.00 H new ATOM 202 N ARG A 93 9.946 2.975 -8.429 1.00 0.00 N ATOM 203 CA ARG A 93 9.143 2.556 -7.288 1.00 0.00 C ATOM 204 C ARG A 93 7.656 2.630 -7.616 1.00 0.00 C ATOM 205 O ARG A 93 6.905 1.695 -7.341 1.00 0.00 O ATOM 206 CB ARG A 93 9.460 3.433 -6.077 1.00 0.00 C ATOM 207 CG ARG A 93 8.688 3.048 -4.826 1.00 0.00 C ATOM 208 CD ARG A 93 7.431 3.889 -4.668 1.00 0.00 C ATOM 209 NE ARG A 93 6.483 3.287 -3.733 1.00 0.00 N ATOM 210 CZ ARG A 93 5.313 3.832 -3.411 1.00 0.00 C ATOM 211 NH1 ARG A 93 4.943 4.990 -3.944 1.00 0.00 N ATOM 212 NH2 ARG A 93 4.509 3.219 -2.553 1.00 0.00 N ATOM 0 H ARG A 93 10.603 3.729 -8.228 1.00 0.00 H new ATOM 0 HA ARG A 93 9.390 1.520 -7.054 1.00 0.00 H new ATOM 0 HB2 ARG A 93 10.528 3.375 -5.867 1.00 0.00 H new ATOM 0 HB3 ARG A 93 9.240 4.472 -6.324 1.00 0.00 H new ATOM 0 HG2 ARG A 93 8.418 1.993 -4.874 1.00 0.00 H new ATOM 0 HG3 ARG A 93 9.325 3.175 -3.950 1.00 0.00 H new ATOM 0 HD2 ARG A 93 7.703 4.885 -4.318 1.00 0.00 H new ATOM 0 HD3 ARG A 93 6.953 4.012 -5.640 1.00 0.00 H new ATOM 0 HE ARG A 93 6.733 2.397 -3.302 1.00 0.00 H new ATOM 0 HH11 ARG A 93 5.557 5.467 -4.604 1.00 0.00 H new ATOM 0 HH12 ARG A 93 4.045 5.403 -3.693 1.00 0.00 H new ATOM 0 HH21 ARG A 93 4.788 2.329 -2.140 1.00 0.00 H new ATOM 0 HH22 ARG A 93 3.612 3.637 -2.306 1.00 0.00 H new ATOM 226 N TYR A 94 7.237 3.742 -8.214 1.00 0.00 N ATOM 227 CA TYR A 94 5.838 3.925 -8.589 1.00 0.00 C ATOM 228 C TYR A 94 5.350 2.750 -9.431 1.00 0.00 C ATOM 229 O TYR A 94 4.375 2.082 -9.083 1.00 0.00 O ATOM 230 CB TYR A 94 5.669 5.232 -9.366 1.00 0.00 C ATOM 231 CG TYR A 94 4.248 5.497 -9.809 1.00 0.00 C ATOM 232 CD1 TYR A 94 3.174 5.168 -8.992 1.00 0.00 C ATOM 233 CD2 TYR A 94 3.981 6.075 -11.044 1.00 0.00 C ATOM 234 CE1 TYR A 94 1.874 5.407 -9.392 1.00 0.00 C ATOM 235 CE2 TYR A 94 2.682 6.317 -11.452 1.00 0.00 C ATOM 236 CZ TYR A 94 1.633 5.981 -10.622 1.00 0.00 C ATOM 237 OH TYR A 94 0.339 6.221 -11.024 1.00 0.00 O ATOM 0 H TYR A 94 7.844 4.527 -8.449 1.00 0.00 H new ATOM 0 HA TYR A 94 5.240 3.972 -7.679 1.00 0.00 H new ATOM 0 HB2 TYR A 94 6.006 6.061 -8.743 1.00 0.00 H new ATOM 0 HB3 TYR A 94 6.315 5.209 -10.243 1.00 0.00 H new ATOM 0 HD1 TYR A 94 3.359 4.718 -8.028 1.00 0.00 H new ATOM 0 HD2 TYR A 94 4.801 6.339 -11.696 1.00 0.00 H new ATOM 0 HE1 TYR A 94 1.050 5.146 -8.744 1.00 0.00 H new ATOM 0 HE2 TYR A 94 2.490 6.767 -12.415 1.00 0.00 H new ATOM 0 HH TYR A 94 0.344 6.630 -11.914 1.00 0.00 H new ATOM 247 N TYR A 95 6.042 2.501 -10.538 1.00 0.00 N ATOM 248 CA TYR A 95 5.690 1.405 -11.430 1.00 0.00 C ATOM 249 C TYR A 95 5.850 0.061 -10.727 1.00 0.00 C ATOM 250 O TYR A 95 5.157 -0.904 -11.049 1.00 0.00 O ATOM 251 CB TYR A 95 6.559 1.444 -12.689 1.00 0.00 C ATOM 252 CG TYR A 95 6.177 2.543 -13.655 1.00 0.00 C ATOM 253 CD1 TYR A 95 4.845 2.791 -13.963 1.00 0.00 C ATOM 254 CD2 TYR A 95 7.148 3.333 -14.258 1.00 0.00 C ATOM 255 CE1 TYR A 95 4.492 3.795 -14.845 1.00 0.00 C ATOM 256 CE2 TYR A 95 6.802 4.338 -15.141 1.00 0.00 C ATOM 257 CZ TYR A 95 5.474 4.565 -15.432 1.00 0.00 C ATOM 258 OH TYR A 95 5.126 5.565 -16.311 1.00 0.00 O ATOM 0 H TYR A 95 6.851 3.045 -10.838 1.00 0.00 H new ATOM 0 HA TYR A 95 4.645 1.523 -11.717 1.00 0.00 H new ATOM 0 HB2 TYR A 95 7.601 1.574 -12.397 1.00 0.00 H new ATOM 0 HB3 TYR A 95 6.489 0.483 -13.199 1.00 0.00 H new ATOM 0 HD1 TYR A 95 4.073 2.190 -13.506 1.00 0.00 H new ATOM 0 HD2 TYR A 95 8.190 3.159 -14.033 1.00 0.00 H new ATOM 0 HE1 TYR A 95 3.452 3.976 -15.073 1.00 0.00 H new ATOM 0 HE2 TYR A 95 7.569 4.943 -15.601 1.00 0.00 H new ATOM 0 HH TYR A 95 5.936 6.013 -16.634 1.00 0.00 H new ATOM 268 N LEU A 96 6.761 0.006 -9.759 1.00 0.00 N ATOM 269 CA LEU A 96 7.003 -1.219 -9.007 1.00 0.00 C ATOM 270 C LEU A 96 5.784 -1.581 -8.168 1.00 0.00 C ATOM 271 O LEU A 96 5.247 -2.684 -8.275 1.00 0.00 O ATOM 272 CB LEU A 96 8.228 -1.055 -8.104 1.00 0.00 C ATOM 273 CG LEU A 96 9.136 -2.281 -8.015 1.00 0.00 C ATOM 274 CD1 LEU A 96 9.623 -2.686 -9.398 1.00 0.00 C ATOM 275 CD2 LEU A 96 10.313 -2.003 -7.093 1.00 0.00 C ATOM 0 H LEU A 96 7.343 0.795 -9.478 1.00 0.00 H new ATOM 0 HA LEU A 96 7.191 -2.025 -9.716 1.00 0.00 H new ATOM 0 HB2 LEU A 96 8.816 -0.212 -8.466 1.00 0.00 H new ATOM 0 HB3 LEU A 96 7.889 -0.800 -7.100 1.00 0.00 H new ATOM 0 HG LEU A 96 8.561 -3.108 -7.599 1.00 0.00 H new ATOM 0 HD11 LEU A 96 10.268 -3.561 -9.315 1.00 0.00 H new ATOM 0 HD12 LEU A 96 8.767 -2.925 -10.030 1.00 0.00 H new ATOM 0 HD13 LEU A 96 10.183 -1.863 -9.842 1.00 0.00 H new ATOM 0 HD21 LEU A 96 10.950 -2.886 -7.040 1.00 0.00 H new ATOM 0 HD22 LEU A 96 10.889 -1.163 -7.481 1.00 0.00 H new ATOM 0 HD23 LEU A 96 9.945 -1.761 -6.096 1.00 0.00 H new ATOM 287 N CYS A 97 5.349 -0.641 -7.334 1.00 0.00 N ATOM 288 CA CYS A 97 4.188 -0.855 -6.477 1.00 0.00 C ATOM 289 C CYS A 97 2.972 -1.248 -7.308 1.00 0.00 C ATOM 290 O CYS A 97 2.198 -2.123 -6.919 1.00 0.00 O ATOM 291 CB CYS A 97 3.884 0.408 -5.670 1.00 0.00 C ATOM 292 SG CYS A 97 3.190 0.087 -4.031 1.00 0.00 S ATOM 0 H CYS A 97 5.783 0.276 -7.234 1.00 0.00 H new ATOM 0 HA CYS A 97 4.416 -1.669 -5.788 1.00 0.00 H new ATOM 0 HB2 CYS A 97 4.802 0.984 -5.558 1.00 0.00 H new ATOM 0 HB3 CYS A 97 3.186 1.027 -6.234 1.00 0.00 H new ATOM 0 HG CYS A 97 3.660 -1.035 -3.573 1.00 0.00 H new ATOM 298 N LEU A 98 2.814 -0.599 -8.458 1.00 0.00 N ATOM 299 CA LEU A 98 1.695 -0.887 -9.348 1.00 0.00 C ATOM 300 C LEU A 98 1.717 -2.347 -9.788 1.00 0.00 C ATOM 301 O LEU A 98 0.684 -3.017 -9.806 1.00 0.00 O ATOM 302 CB LEU A 98 1.742 0.028 -10.573 1.00 0.00 C ATOM 303 CG LEU A 98 1.358 1.485 -10.310 1.00 0.00 C ATOM 304 CD1 LEU A 98 1.576 2.328 -11.556 1.00 0.00 C ATOM 305 CD2 LEU A 98 -0.089 1.579 -9.848 1.00 0.00 C ATOM 0 H LEU A 98 3.445 0.128 -8.794 1.00 0.00 H new ATOM 0 HA LEU A 98 0.770 -0.703 -8.802 1.00 0.00 H new ATOM 0 HB2 LEU A 98 2.750 0.003 -10.987 1.00 0.00 H new ATOM 0 HB3 LEU A 98 1.075 -0.376 -11.334 1.00 0.00 H new ATOM 0 HG LEU A 98 1.999 1.872 -9.518 1.00 0.00 H new ATOM 0 HD11 LEU A 98 1.297 3.361 -11.350 1.00 0.00 H new ATOM 0 HD12 LEU A 98 2.626 2.286 -11.844 1.00 0.00 H new ATOM 0 HD13 LEU A 98 0.961 1.942 -12.369 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -0.346 2.623 -9.665 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -0.744 1.174 -10.619 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -0.215 1.008 -8.928 1.00 0.00 H new ATOM 317 N GLN A 99 2.903 -2.836 -10.139 1.00 0.00 N ATOM 318 CA GLN A 99 3.062 -4.218 -10.576 1.00 0.00 C ATOM 319 C GLN A 99 2.805 -5.185 -9.425 1.00 0.00 C ATOM 320 O GLN A 99 2.070 -6.161 -9.573 1.00 0.00 O ATOM 321 CB GLN A 99 4.468 -4.439 -11.138 1.00 0.00 C ATOM 322 CG GLN A 99 4.813 -3.514 -12.294 1.00 0.00 C ATOM 323 CD GLN A 99 4.757 -4.214 -13.638 1.00 0.00 C ATOM 324 OE1 GLN A 99 4.825 -5.441 -13.715 1.00 0.00 O ATOM 325 NE2 GLN A 99 4.633 -3.435 -14.706 1.00 0.00 N ATOM 0 H GLN A 99 3.768 -2.295 -10.129 1.00 0.00 H new ATOM 0 HA GLN A 99 2.330 -4.411 -11.360 1.00 0.00 H new ATOM 0 HB2 GLN A 99 5.196 -4.296 -10.339 1.00 0.00 H new ATOM 0 HB3 GLN A 99 4.559 -5.473 -11.471 1.00 0.00 H new ATOM 0 HG2 GLN A 99 4.122 -2.671 -12.299 1.00 0.00 H new ATOM 0 HG3 GLN A 99 5.812 -3.106 -12.142 1.00 0.00 H new ATOM 0 HE21 GLN A 99 4.580 -2.422 -14.595 1.00 0.00 H new ATOM 0 HE22 GLN A 99 4.590 -3.849 -15.637 1.00 0.00 H new ATOM 334 N LEU A 100 3.413 -4.905 -8.276 1.00 0.00 N ATOM 335 CA LEU A 100 3.248 -5.748 -7.098 1.00 0.00 C ATOM 336 C LEU A 100 1.782 -5.807 -6.678 1.00 0.00 C ATOM 337 O LEU A 100 1.250 -6.879 -6.390 1.00 0.00 O ATOM 338 CB LEU A 100 4.103 -5.218 -5.943 1.00 0.00 C ATOM 339 CG LEU A 100 5.416 -5.968 -5.709 1.00 0.00 C ATOM 340 CD1 LEU A 100 6.376 -5.119 -4.889 1.00 0.00 C ATOM 341 CD2 LEU A 100 5.155 -7.298 -5.018 1.00 0.00 C ATOM 0 H LEU A 100 4.024 -4.101 -8.136 1.00 0.00 H new ATOM 0 HA LEU A 100 3.577 -6.756 -7.350 1.00 0.00 H new ATOM 0 HB2 LEU A 100 4.331 -4.169 -6.132 1.00 0.00 H new ATOM 0 HB3 LEU A 100 3.513 -5.256 -5.027 1.00 0.00 H new ATOM 0 HG LEU A 100 5.875 -6.168 -6.677 1.00 0.00 H new ATOM 0 HD11 LEU A 100 7.304 -5.668 -4.732 1.00 0.00 H new ATOM 0 HD12 LEU A 100 6.588 -4.192 -5.422 1.00 0.00 H new ATOM 0 HD13 LEU A 100 5.924 -4.888 -3.924 1.00 0.00 H new ATOM 0 HD21 LEU A 100 6.100 -7.817 -4.860 1.00 0.00 H new ATOM 0 HD22 LEU A 100 4.673 -7.120 -4.057 1.00 0.00 H new ATOM 0 HD23 LEU A 100 4.504 -7.911 -5.642 1.00 0.00 H new ATOM 353 N ARG A 101 1.137 -4.646 -6.646 1.00 0.00 N ATOM 354 CA ARG A 101 -0.267 -4.557 -6.262 1.00 0.00 C ATOM 355 C ARG A 101 -1.161 -5.251 -7.285 1.00 0.00 C ATOM 356 O ARG A 101 -2.235 -5.749 -6.947 1.00 0.00 O ATOM 357 CB ARG A 101 -0.684 -3.093 -6.114 1.00 0.00 C ATOM 358 CG ARG A 101 -2.024 -2.910 -5.420 1.00 0.00 C ATOM 359 CD ARG A 101 -2.422 -1.444 -5.354 1.00 0.00 C ATOM 360 NE ARG A 101 -2.431 -0.819 -6.675 1.00 0.00 N ATOM 361 CZ ARG A 101 -2.655 0.477 -6.880 1.00 0.00 C ATOM 362 NH1 ARG A 101 -2.882 1.289 -5.854 1.00 0.00 N ATOM 363 NH2 ARG A 101 -2.651 0.964 -8.113 1.00 0.00 N ATOM 0 H ARG A 101 1.566 -3.751 -6.882 1.00 0.00 H new ATOM 0 HA ARG A 101 -0.386 -5.062 -5.304 1.00 0.00 H new ATOM 0 HB2 ARG A 101 0.083 -2.560 -5.552 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -0.730 -2.635 -7.102 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -2.791 -3.473 -5.953 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -1.971 -3.320 -4.411 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -3.411 -1.357 -4.905 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -1.729 -0.909 -4.705 1.00 0.00 H new ATOM 0 HE ARG A 101 -2.255 -1.410 -7.487 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -2.885 0.920 -4.903 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -3.053 2.281 -6.017 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -2.476 0.346 -8.905 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -2.823 1.957 -8.270 1.00 0.00 H new ATOM 377 N GLN A 102 -0.713 -5.280 -8.537 1.00 0.00 N ATOM 378 CA GLN A 102 -1.475 -5.915 -9.606 1.00 0.00 C ATOM 379 C GLN A 102 -1.466 -7.433 -9.457 1.00 0.00 C ATOM 380 O GLN A 102 -2.483 -8.094 -9.670 1.00 0.00 O ATOM 381 CB GLN A 102 -0.903 -5.522 -10.970 1.00 0.00 C ATOM 382 CG GLN A 102 -1.529 -4.266 -11.553 1.00 0.00 C ATOM 383 CD GLN A 102 -1.088 -4.004 -12.980 1.00 0.00 C ATOM 384 OE1 GLN A 102 -1.891 -4.062 -13.911 1.00 0.00 O ATOM 385 NE2 GLN A 102 0.195 -3.712 -13.159 1.00 0.00 N ATOM 0 H GLN A 102 0.173 -4.872 -8.835 1.00 0.00 H new ATOM 0 HA GLN A 102 -2.506 -5.569 -9.537 1.00 0.00 H new ATOM 0 HB2 GLN A 102 0.172 -5.371 -10.874 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -1.048 -6.347 -11.667 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -2.615 -4.358 -11.523 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -1.264 -3.410 -10.932 1.00 0.00 H new ATOM 0 HE21 GLN A 102 0.826 -3.675 -12.358 1.00 0.00 H new ATOM 0 HE22 GLN A 102 0.549 -3.525 -14.097 1.00 0.00 H new ATOM 394 N ASP A 103 -0.310 -7.980 -9.095 1.00 0.00 N ATOM 395 CA ASP A 103 -0.166 -9.421 -8.921 1.00 0.00 C ATOM 396 C ASP A 103 -0.908 -9.901 -7.678 1.00 0.00 C ATOM 397 O ASP A 103 -1.568 -10.940 -7.699 1.00 0.00 O ATOM 398 CB ASP A 103 1.313 -9.798 -8.822 1.00 0.00 C ATOM 399 CG ASP A 103 2.007 -9.777 -10.170 1.00 0.00 C ATOM 400 OD1 ASP A 103 1.884 -8.761 -10.886 1.00 0.00 O ATOM 401 OD2 ASP A 103 2.674 -10.777 -10.510 1.00 0.00 O ATOM 0 H ASP A 103 0.541 -7.447 -8.916 1.00 0.00 H new ATOM 0 HA ASP A 103 -0.603 -9.910 -9.792 1.00 0.00 H new ATOM 0 HB2 ASP A 103 1.817 -9.107 -8.146 1.00 0.00 H new ATOM 0 HB3 ASP A 103 1.403 -10.793 -8.386 1.00 0.00 H new ATOM 406 N ILE A 104 -0.792 -9.140 -6.594 1.00 0.00 N ATOM 407 CA ILE A 104 -1.449 -9.491 -5.341 1.00 0.00 C ATOM 408 C ILE A 104 -2.967 -9.509 -5.496 1.00 0.00 C ATOM 409 O ILE A 104 -3.622 -10.496 -5.162 1.00 0.00 O ATOM 410 CB ILE A 104 -1.068 -8.512 -4.212 1.00 0.00 C ATOM 411 CG1 ILE A 104 0.454 -8.412 -4.086 1.00 0.00 C ATOM 412 CG2 ILE A 104 -1.685 -8.952 -2.892 1.00 0.00 C ATOM 413 CD1 ILE A 104 0.936 -7.048 -3.645 1.00 0.00 C ATOM 0 H ILE A 104 -0.249 -8.277 -6.559 1.00 0.00 H new ATOM 0 HA ILE A 104 -1.105 -10.491 -5.076 1.00 0.00 H new ATOM 0 HB ILE A 104 -1.461 -7.526 -4.462 1.00 0.00 H new ATOM 0 HG12 ILE A 104 0.801 -9.159 -3.372 1.00 0.00 H new ATOM 0 HG13 ILE A 104 0.907 -8.655 -5.047 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -1.405 -8.249 -2.107 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -2.771 -8.976 -2.988 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -1.322 -9.947 -2.634 1.00 0.00 H new ATOM 0 HD11 ILE A 104 2.024 -7.051 -3.577 1.00 0.00 H new ATOM 0 HD12 ILE A 104 0.620 -6.298 -4.370 1.00 0.00 H new ATOM 0 HD13 ILE A 104 0.512 -6.810 -2.669 1.00 0.00 H new ATOM 425 N VAL A 105 -3.522 -8.411 -6.000 1.00 0.00 N ATOM 426 CA VAL A 105 -4.964 -8.302 -6.193 1.00 0.00 C ATOM 427 C VAL A 105 -5.484 -9.386 -7.131 1.00 0.00 C ATOM 428 O VAL A 105 -6.613 -9.854 -6.987 1.00 0.00 O ATOM 429 CB VAL A 105 -5.352 -6.923 -6.757 1.00 0.00 C ATOM 430 CG1 VAL A 105 -5.031 -5.826 -5.754 1.00 0.00 C ATOM 431 CG2 VAL A 105 -4.646 -6.670 -8.081 1.00 0.00 C ATOM 0 H VAL A 105 -2.995 -7.584 -6.282 1.00 0.00 H new ATOM 0 HA VAL A 105 -5.421 -8.429 -5.212 1.00 0.00 H new ATOM 0 HB VAL A 105 -6.427 -6.914 -6.938 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -5.312 -4.859 -6.170 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -5.588 -6.000 -4.833 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -3.963 -5.831 -5.538 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -4.932 -5.691 -8.465 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -3.567 -6.699 -7.929 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -4.932 -7.439 -8.799 1.00 0.00 H new ATOM 441 N ALA A 106 -4.657 -9.781 -8.093 1.00 0.00 N ATOM 442 CA ALA A 106 -5.040 -10.810 -9.053 1.00 0.00 C ATOM 443 C ALA A 106 -4.895 -12.212 -8.461 1.00 0.00 C ATOM 444 O ALA A 106 -5.218 -13.204 -9.115 1.00 0.00 O ATOM 445 CB ALA A 106 -4.207 -10.684 -10.319 1.00 0.00 C ATOM 0 H ALA A 106 -3.719 -9.405 -8.229 1.00 0.00 H new ATOM 0 HA ALA A 106 -6.091 -10.661 -9.300 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -4.503 -11.458 -11.028 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -4.369 -9.703 -10.765 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -3.152 -10.801 -10.073 1.00 0.00 H new ATOM 451 N GLY A 107 -4.408 -12.291 -7.225 1.00 0.00 N ATOM 452 CA GLY A 107 -4.233 -13.579 -6.581 1.00 0.00 C ATOM 453 C GLY A 107 -3.140 -14.405 -7.231 1.00 0.00 C ATOM 454 O GLY A 107 -3.240 -15.629 -7.309 1.00 0.00 O ATOM 0 H GLY A 107 -4.132 -11.487 -6.660 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -3.993 -13.427 -5.529 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -5.172 -14.131 -6.617 1.00 0.00 H new ATOM 458 N ARG A 108 -2.095 -13.731 -7.701 1.00 0.00 N ATOM 459 CA ARG A 108 -0.979 -14.409 -8.350 1.00 0.00 C ATOM 460 C ARG A 108 0.107 -14.787 -7.341 1.00 0.00 C ATOM 461 O ARG A 108 1.159 -15.304 -7.718 1.00 0.00 O ATOM 462 CB ARG A 108 -0.387 -13.520 -9.447 1.00 0.00 C ATOM 463 CG ARG A 108 -0.319 -14.197 -10.806 1.00 0.00 C ATOM 464 CD ARG A 108 -1.708 -14.480 -11.358 1.00 0.00 C ATOM 465 NE ARG A 108 -1.800 -15.813 -11.949 1.00 0.00 N ATOM 466 CZ ARG A 108 -2.781 -16.196 -12.763 1.00 0.00 C ATOM 467 NH1 ARG A 108 -3.754 -15.353 -13.085 1.00 0.00 N ATOM 468 NH2 ARG A 108 -2.790 -17.427 -13.257 1.00 0.00 N ATOM 0 H ARG A 108 -1.998 -12.717 -7.645 1.00 0.00 H new ATOM 0 HA ARG A 108 -1.360 -15.327 -8.796 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -0.986 -12.613 -9.531 1.00 0.00 H new ATOM 0 HB3 ARG A 108 0.616 -13.213 -9.152 1.00 0.00 H new ATOM 0 HG2 ARG A 108 0.228 -13.562 -11.503 1.00 0.00 H new ATOM 0 HG3 ARG A 108 0.237 -15.131 -10.721 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -2.442 -14.387 -10.558 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -1.959 -13.732 -12.110 1.00 0.00 H new ATOM 0 HE ARG A 108 -1.070 -16.489 -11.725 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -3.753 -14.405 -12.708 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -4.503 -15.653 -13.709 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -2.045 -18.080 -13.013 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -3.542 -17.721 -13.881 1.00 0.00 H new ATOM 482 N LEU A 109 -0.151 -14.531 -6.060 1.00 0.00 N ATOM 483 CA LEU A 109 0.808 -14.850 -5.010 1.00 0.00 C ATOM 484 C LEU A 109 0.106 -14.974 -3.658 1.00 0.00 C ATOM 485 O LEU A 109 -0.442 -13.998 -3.147 1.00 0.00 O ATOM 486 CB LEU A 109 1.892 -13.773 -4.936 1.00 0.00 C ATOM 487 CG LEU A 109 3.271 -14.272 -4.500 1.00 0.00 C ATOM 488 CD1 LEU A 109 4.368 -13.560 -5.277 1.00 0.00 C ATOM 489 CD2 LEU A 109 3.460 -14.073 -3.003 1.00 0.00 C ATOM 0 H LEU A 109 -1.015 -14.104 -5.727 1.00 0.00 H new ATOM 0 HA LEU A 109 1.272 -15.806 -5.251 1.00 0.00 H new ATOM 0 HB2 LEU A 109 1.985 -13.304 -5.916 1.00 0.00 H new ATOM 0 HB3 LEU A 109 1.566 -12.998 -4.242 1.00 0.00 H new ATOM 0 HG LEU A 109 3.336 -15.338 -4.717 1.00 0.00 H new ATOM 0 HD11 LEU A 109 5.341 -13.928 -4.953 1.00 0.00 H new ATOM 0 HD12 LEU A 109 4.243 -13.753 -6.342 1.00 0.00 H new ATOM 0 HD13 LEU A 109 4.307 -12.487 -5.093 1.00 0.00 H new ATOM 0 HD21 LEU A 109 4.446 -14.433 -2.710 1.00 0.00 H new ATOM 0 HD22 LEU A 109 3.375 -13.013 -2.763 1.00 0.00 H new ATOM 0 HD23 LEU A 109 2.695 -14.630 -2.462 1.00 0.00 H new ATOM 501 N PRO A 110 0.109 -16.179 -3.058 1.00 0.00 N ATOM 502 CA PRO A 110 -0.536 -16.414 -1.762 1.00 0.00 C ATOM 503 C PRO A 110 -0.120 -15.392 -0.708 1.00 0.00 C ATOM 504 O PRO A 110 1.068 -15.201 -0.449 1.00 0.00 O ATOM 505 CB PRO A 110 -0.051 -17.811 -1.372 1.00 0.00 C ATOM 506 CG PRO A 110 0.243 -18.483 -2.668 1.00 0.00 C ATOM 507 CD PRO A 110 0.736 -17.403 -3.593 1.00 0.00 C ATOM 0 HA PRO A 110 -1.620 -16.326 -1.827 1.00 0.00 H new ATOM 0 HB2 PRO A 110 0.837 -17.761 -0.741 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -0.812 -18.352 -0.809 1.00 0.00 H new ATOM 0 HG2 PRO A 110 0.995 -19.262 -2.542 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -0.649 -18.963 -3.070 1.00 0.00 H new ATOM 0 HD2 PRO A 110 1.824 -17.333 -3.585 1.00 0.00 H new ATOM 0 HD3 PRO A 110 0.436 -17.590 -4.624 1.00 0.00 H new ATOM 515 N CYS A 111 -1.107 -14.741 -0.102 1.00 0.00 N ATOM 516 CA CYS A 111 -0.848 -13.741 0.928 1.00 0.00 C ATOM 517 C CYS A 111 -1.859 -13.862 2.064 1.00 0.00 C ATOM 518 O CYS A 111 -3.054 -14.040 1.828 1.00 0.00 O ATOM 519 CB CYS A 111 -0.895 -12.333 0.328 1.00 0.00 C ATOM 520 SG CYS A 111 0.717 -11.520 0.228 1.00 0.00 S ATOM 0 H CYS A 111 -2.095 -14.888 -0.307 1.00 0.00 H new ATOM 0 HA CYS A 111 0.149 -13.918 1.332 1.00 0.00 H new ATOM 0 HB2 CYS A 111 -1.324 -12.390 -0.672 1.00 0.00 H new ATOM 0 HB3 CYS A 111 -1.565 -11.716 0.927 1.00 0.00 H new ATOM 0 HG CYS A 111 0.575 -10.338 -0.294 1.00 0.00 H new ATOM 526 N SER A 112 -1.371 -13.768 3.296 1.00 0.00 N ATOM 527 CA SER A 112 -2.233 -13.871 4.469 1.00 0.00 C ATOM 528 C SER A 112 -3.125 -12.641 4.603 1.00 0.00 C ATOM 529 O SER A 112 -2.836 -11.586 4.037 1.00 0.00 O ATOM 530 CB SER A 112 -1.389 -14.043 5.733 1.00 0.00 C ATOM 531 OG SER A 112 -1.980 -14.978 6.618 1.00 0.00 O ATOM 0 H SER A 112 -0.384 -13.621 3.509 1.00 0.00 H new ATOM 0 HA SER A 112 -2.871 -14.746 4.343 1.00 0.00 H new ATOM 0 HB2 SER A 112 -0.387 -14.377 5.462 1.00 0.00 H new ATOM 0 HB3 SER A 112 -1.280 -13.082 6.235 1.00 0.00 H new ATOM 0 HG SER A 112 -1.420 -15.071 7.417 1.00 0.00 H new ATOM 537 N PHE A 113 -4.209 -12.785 5.358 1.00 0.00 N ATOM 538 CA PHE A 113 -5.147 -11.688 5.573 1.00 0.00 C ATOM 539 C PHE A 113 -4.439 -10.478 6.173 1.00 0.00 C ATOM 540 O PHE A 113 -4.614 -9.351 5.710 1.00 0.00 O ATOM 541 CB PHE A 113 -6.286 -12.142 6.492 1.00 0.00 C ATOM 542 CG PHE A 113 -7.228 -11.038 6.884 1.00 0.00 C ATOM 543 CD1 PHE A 113 -8.318 -10.723 6.088 1.00 0.00 C ATOM 544 CD2 PHE A 113 -7.023 -10.317 8.049 1.00 0.00 C ATOM 545 CE1 PHE A 113 -9.186 -9.709 6.447 1.00 0.00 C ATOM 546 CE2 PHE A 113 -7.887 -9.302 8.413 1.00 0.00 C ATOM 547 CZ PHE A 113 -8.970 -8.998 7.612 1.00 0.00 C ATOM 0 H PHE A 113 -4.460 -13.652 5.832 1.00 0.00 H new ATOM 0 HA PHE A 113 -5.562 -11.398 4.608 1.00 0.00 H new ATOM 0 HB2 PHE A 113 -6.851 -12.929 5.992 1.00 0.00 H new ATOM 0 HB3 PHE A 113 -5.859 -12.580 7.394 1.00 0.00 H new ATOM 0 HD1 PHE A 113 -8.491 -11.276 5.177 1.00 0.00 H new ATOM 0 HD2 PHE A 113 -6.178 -10.551 8.680 1.00 0.00 H new ATOM 0 HE1 PHE A 113 -10.032 -9.473 5.818 1.00 0.00 H new ATOM 0 HE2 PHE A 113 -7.715 -8.747 9.323 1.00 0.00 H new ATOM 0 HZ PHE A 113 -9.647 -8.206 7.896 1.00 0.00 H new ATOM 557 N ALA A 114 -3.652 -10.716 7.218 1.00 0.00 N ATOM 558 CA ALA A 114 -2.935 -9.641 7.891 1.00 0.00 C ATOM 559 C ALA A 114 -2.052 -8.863 6.923 1.00 0.00 C ATOM 560 O ALA A 114 -1.979 -7.637 6.994 1.00 0.00 O ATOM 561 CB ALA A 114 -2.097 -10.197 9.030 1.00 0.00 C ATOM 0 H ALA A 114 -3.496 -11.642 7.616 1.00 0.00 H new ATOM 0 HA ALA A 114 -3.677 -8.952 8.295 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -1.567 -9.382 9.523 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -2.746 -10.696 9.750 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -1.376 -10.912 8.635 1.00 0.00 H new ATOM 567 N THR A 115 -1.384 -9.569 6.015 1.00 0.00 N ATOM 568 CA THR A 115 -0.517 -8.919 5.041 1.00 0.00 C ATOM 569 C THR A 115 -1.348 -8.164 4.012 1.00 0.00 C ATOM 570 O THR A 115 -0.989 -7.062 3.597 1.00 0.00 O ATOM 571 CB THR A 115 0.367 -9.958 4.345 1.00 0.00 C ATOM 572 OG1 THR A 115 1.229 -10.586 5.277 1.00 0.00 O ATOM 573 CG2 THR A 115 1.229 -9.377 3.244 1.00 0.00 C ATOM 0 H THR A 115 -1.427 -10.585 5.934 1.00 0.00 H new ATOM 0 HA THR A 115 0.121 -8.207 5.564 1.00 0.00 H new ATOM 0 HB THR A 115 -0.326 -10.672 3.900 1.00 0.00 H new ATOM 0 HG1 THR A 115 1.785 -11.248 4.814 1.00 0.00 H new ATOM 0 HG21 THR A 115 1.829 -10.169 2.795 1.00 0.00 H new ATOM 0 HG22 THR A 115 0.592 -8.928 2.482 1.00 0.00 H new ATOM 0 HG23 THR A 115 1.888 -8.615 3.661 1.00 0.00 H new ATOM 581 N LEU A 116 -2.465 -8.760 3.609 1.00 0.00 N ATOM 582 CA LEU A 116 -3.351 -8.137 2.636 1.00 0.00 C ATOM 583 C LEU A 116 -3.848 -6.796 3.161 1.00 0.00 C ATOM 584 O LEU A 116 -3.836 -5.794 2.446 1.00 0.00 O ATOM 585 CB LEU A 116 -4.539 -9.052 2.329 1.00 0.00 C ATOM 586 CG LEU A 116 -4.224 -10.253 1.435 1.00 0.00 C ATOM 587 CD1 LEU A 116 -5.503 -10.983 1.053 1.00 0.00 C ATOM 588 CD2 LEU A 116 -3.470 -9.811 0.189 1.00 0.00 C ATOM 0 H LEU A 116 -2.777 -9.673 3.941 1.00 0.00 H new ATOM 0 HA LEU A 116 -2.791 -7.972 1.715 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -4.948 -9.418 3.271 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -5.319 -8.459 1.852 1.00 0.00 H new ATOM 0 HG LEU A 116 -3.589 -10.940 1.995 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -5.260 -11.834 0.417 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -6.004 -11.335 1.955 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -6.162 -10.303 0.513 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -3.255 -10.680 -0.434 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -4.079 -9.103 -0.373 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -2.535 -9.333 0.480 1.00 0.00 H new ATOM 600 N ALA A 117 -4.287 -6.788 4.416 1.00 0.00 N ATOM 601 CA ALA A 117 -4.791 -5.576 5.045 1.00 0.00 C ATOM 602 C ALA A 117 -3.662 -4.594 5.347 1.00 0.00 C ATOM 603 O ALA A 117 -3.844 -3.380 5.252 1.00 0.00 O ATOM 604 CB ALA A 117 -5.538 -5.935 6.321 1.00 0.00 C ATOM 0 H ALA A 117 -4.303 -7.611 5.018 1.00 0.00 H new ATOM 0 HA ALA A 117 -5.475 -5.087 4.351 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -5.914 -5.026 6.790 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -6.374 -6.592 6.081 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -4.862 -6.444 7.007 1.00 0.00 H new ATOM 610 N LEU A 118 -2.495 -5.122 5.708 1.00 0.00 N ATOM 611 CA LEU A 118 -1.343 -4.281 6.018 1.00 0.00 C ATOM 612 C LEU A 118 -0.845 -3.564 4.766 1.00 0.00 C ATOM 613 O LEU A 118 -0.682 -2.343 4.759 1.00 0.00 O ATOM 614 CB LEU A 118 -0.218 -5.125 6.621 1.00 0.00 C ATOM 615 CG LEU A 118 1.085 -4.370 6.895 1.00 0.00 C ATOM 616 CD1 LEU A 118 1.762 -4.909 8.146 1.00 0.00 C ATOM 617 CD2 LEU A 118 2.017 -4.468 5.697 1.00 0.00 C ATOM 0 H LEU A 118 -2.323 -6.124 5.793 1.00 0.00 H new ATOM 0 HA LEU A 118 -1.653 -3.531 6.746 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -0.572 -5.559 7.556 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -0.005 -5.954 5.946 1.00 0.00 H new ATOM 0 HG LEU A 118 0.847 -3.319 7.061 1.00 0.00 H new ATOM 0 HD11 LEU A 118 2.687 -4.360 8.325 1.00 0.00 H new ATOM 0 HD12 LEU A 118 1.097 -4.787 9.001 1.00 0.00 H new ATOM 0 HD13 LEU A 118 1.988 -5.967 8.010 1.00 0.00 H new ATOM 0 HD21 LEU A 118 2.939 -3.926 5.908 1.00 0.00 H new ATOM 0 HD22 LEU A 118 2.248 -5.515 5.501 1.00 0.00 H new ATOM 0 HD23 LEU A 118 1.533 -4.033 4.823 1.00 0.00 H new ATOM 629 N LEU A 119 -0.614 -4.332 3.707 1.00 0.00 N ATOM 630 CA LEU A 119 -0.143 -3.772 2.446 1.00 0.00 C ATOM 631 C LEU A 119 -1.180 -2.814 1.871 1.00 0.00 C ATOM 632 O LEU A 119 -0.838 -1.803 1.255 1.00 0.00 O ATOM 633 CB LEU A 119 0.148 -4.890 1.443 1.00 0.00 C ATOM 634 CG LEU A 119 1.216 -5.892 1.883 1.00 0.00 C ATOM 635 CD1 LEU A 119 1.244 -7.089 0.945 1.00 0.00 C ATOM 636 CD2 LEU A 119 2.581 -5.224 1.937 1.00 0.00 C ATOM 0 H LEU A 119 -0.745 -5.343 3.697 1.00 0.00 H new ATOM 0 HA LEU A 119 0.778 -3.221 2.636 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -0.778 -5.431 1.247 1.00 0.00 H new ATOM 0 HB3 LEU A 119 0.460 -4.440 0.501 1.00 0.00 H new ATOM 0 HG LEU A 119 0.966 -6.246 2.883 1.00 0.00 H new ATOM 0 HD11 LEU A 119 2.010 -7.791 1.274 1.00 0.00 H new ATOM 0 HD12 LEU A 119 0.272 -7.582 0.955 1.00 0.00 H new ATOM 0 HD13 LEU A 119 1.470 -6.753 -0.067 1.00 0.00 H new ATOM 0 HD21 LEU A 119 3.330 -5.951 2.252 1.00 0.00 H new ATOM 0 HD22 LEU A 119 2.839 -4.842 0.949 1.00 0.00 H new ATOM 0 HD23 LEU A 119 2.554 -4.399 2.649 1.00 0.00 H new ATOM 648 N GLY A 120 -2.449 -3.137 2.092 1.00 0.00 N ATOM 649 CA GLY A 120 -3.522 -2.295 1.605 1.00 0.00 C ATOM 650 C GLY A 120 -3.619 -0.994 2.375 1.00 0.00 C ATOM 651 O GLY A 120 -3.627 0.086 1.787 1.00 0.00 O ATOM 0 H GLY A 120 -2.753 -3.968 2.600 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -3.362 -2.080 0.549 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -4.467 -2.832 1.681 1.00 0.00 H new ATOM 655 N SER A 121 -3.691 -1.101 3.699 1.00 0.00 N ATOM 656 CA SER A 121 -3.789 0.072 4.561 1.00 0.00 C ATOM 657 C SER A 121 -2.658 1.057 4.284 1.00 0.00 C ATOM 658 O SER A 121 -2.846 2.272 4.373 1.00 0.00 O ATOM 659 CB SER A 121 -3.763 -0.349 6.032 1.00 0.00 C ATOM 660 OG SER A 121 -3.913 0.772 6.886 1.00 0.00 O ATOM 0 H SER A 121 -3.683 -1.990 4.199 1.00 0.00 H new ATOM 0 HA SER A 121 -4.735 0.568 4.345 1.00 0.00 H new ATOM 0 HB2 SER A 121 -4.562 -1.065 6.223 1.00 0.00 H new ATOM 0 HB3 SER A 121 -2.823 -0.855 6.252 1.00 0.00 H new ATOM 0 HG SER A 121 -4.856 1.037 6.916 1.00 0.00 H new ATOM 666 N TYR A 122 -1.485 0.533 3.940 1.00 0.00 N ATOM 667 CA TYR A 122 -0.335 1.378 3.647 1.00 0.00 C ATOM 668 C TYR A 122 -0.522 2.096 2.316 1.00 0.00 C ATOM 669 O TYR A 122 -0.301 3.303 2.215 1.00 0.00 O ATOM 670 CB TYR A 122 0.946 0.541 3.616 1.00 0.00 C ATOM 671 CG TYR A 122 1.504 0.239 4.989 1.00 0.00 C ATOM 672 CD1 TYR A 122 1.677 1.249 5.927 1.00 0.00 C ATOM 673 CD2 TYR A 122 1.855 -1.057 5.347 1.00 0.00 C ATOM 674 CE1 TYR A 122 2.186 0.976 7.183 1.00 0.00 C ATOM 675 CE2 TYR A 122 2.364 -1.337 6.601 1.00 0.00 C ATOM 676 CZ TYR A 122 2.528 -0.317 7.515 1.00 0.00 C ATOM 677 OH TYR A 122 3.033 -0.592 8.765 1.00 0.00 O ATOM 0 H TYR A 122 -1.308 -0.468 3.858 1.00 0.00 H new ATOM 0 HA TYR A 122 -0.249 2.125 4.436 1.00 0.00 H new ATOM 0 HB2 TYR A 122 0.745 -0.398 3.100 1.00 0.00 H new ATOM 0 HB3 TYR A 122 1.701 1.069 3.034 1.00 0.00 H new ATOM 0 HD1 TYR A 122 1.410 2.264 5.671 1.00 0.00 H new ATOM 0 HD2 TYR A 122 1.728 -1.858 4.634 1.00 0.00 H new ATOM 0 HE1 TYR A 122 2.315 1.773 7.901 1.00 0.00 H new ATOM 0 HE2 TYR A 122 2.632 -2.350 6.864 1.00 0.00 H new ATOM 0 HH TYR A 122 3.574 0.165 9.073 1.00 0.00 H new ATOM 687 N THR A 123 -0.936 1.348 1.297 1.00 0.00 N ATOM 688 CA THR A 123 -1.159 1.920 -0.025 1.00 0.00 C ATOM 689 C THR A 123 -2.218 3.015 0.035 1.00 0.00 C ATOM 690 O THR A 123 -2.107 4.037 -0.641 1.00 0.00 O ATOM 691 CB THR A 123 -1.583 0.833 -1.013 1.00 0.00 C ATOM 692 OG1 THR A 123 -0.735 -0.298 -0.908 1.00 0.00 O ATOM 693 CG2 THR A 123 -1.559 1.291 -2.455 1.00 0.00 C ATOM 0 H THR A 123 -1.123 0.347 1.362 1.00 0.00 H new ATOM 0 HA THR A 123 -0.223 2.360 -0.368 1.00 0.00 H new ATOM 0 HB THR A 123 -2.610 0.584 -0.745 1.00 0.00 H new ATOM 0 HG1 THR A 123 -1.058 -0.884 -0.192 1.00 0.00 H new ATOM 0 HG21 THR A 123 -1.871 0.471 -3.102 1.00 0.00 H new ATOM 0 HG22 THR A 123 -2.241 2.132 -2.581 1.00 0.00 H new ATOM 0 HG23 THR A 123 -0.548 1.600 -2.722 1.00 0.00 H new ATOM 701 N ILE A 124 -3.241 2.799 0.857 1.00 0.00 N ATOM 702 CA ILE A 124 -4.313 3.774 1.013 1.00 0.00 C ATOM 703 C ILE A 124 -3.767 5.074 1.595 1.00 0.00 C ATOM 704 O ILE A 124 -4.021 6.156 1.069 1.00 0.00 O ATOM 705 CB ILE A 124 -5.440 3.231 1.920 1.00 0.00 C ATOM 706 CG1 ILE A 124 -6.051 1.968 1.306 1.00 0.00 C ATOM 707 CG2 ILE A 124 -6.518 4.285 2.144 1.00 0.00 C ATOM 708 CD1 ILE A 124 -6.844 2.229 0.043 1.00 0.00 C ATOM 0 H ILE A 124 -3.349 1.958 1.424 1.00 0.00 H new ATOM 0 HA ILE A 124 -4.731 3.967 0.025 1.00 0.00 H new ATOM 0 HB ILE A 124 -5.006 2.980 2.888 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -5.253 1.260 1.084 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -6.701 1.495 2.042 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -7.299 3.876 2.786 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -6.077 5.160 2.621 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -6.950 4.573 1.186 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -7.246 1.289 -0.335 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -7.664 2.912 0.263 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -6.193 2.674 -0.710 1.00 0.00 H new ATOM 720 N GLN A 125 -3.010 4.958 2.683 1.00 0.00 N ATOM 721 CA GLN A 125 -2.422 6.123 3.335 1.00 0.00 C ATOM 722 C GLN A 125 -1.557 6.911 2.355 1.00 0.00 C ATOM 723 O GLN A 125 -1.540 8.141 2.377 1.00 0.00 O ATOM 724 CB GLN A 125 -1.584 5.685 4.539 1.00 0.00 C ATOM 725 CG GLN A 125 -0.895 6.835 5.258 1.00 0.00 C ATOM 726 CD GLN A 125 -1.568 7.189 6.570 1.00 0.00 C ATOM 727 OE1 GLN A 125 -1.936 6.309 7.349 1.00 0.00 O ATOM 728 NE2 GLN A 125 -1.731 8.482 6.821 1.00 0.00 N ATOM 0 H GLN A 125 -2.790 4.069 3.131 1.00 0.00 H new ATOM 0 HA GLN A 125 -3.230 6.769 3.679 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -2.227 5.160 5.246 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -0.829 4.973 4.205 1.00 0.00 H new ATOM 0 HG2 GLN A 125 0.145 6.569 5.447 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -0.887 7.711 4.610 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -1.410 9.177 6.147 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -2.177 8.781 7.688 1.00 0.00 H new ATOM 737 N SER A 126 -0.840 6.193 1.499 1.00 0.00 N ATOM 738 CA SER A 126 0.028 6.822 0.509 1.00 0.00 C ATOM 739 C SER A 126 -0.775 7.339 -0.683 1.00 0.00 C ATOM 740 O SER A 126 -0.330 8.236 -1.400 1.00 0.00 O ATOM 741 CB SER A 126 1.089 5.829 0.030 1.00 0.00 C ATOM 742 OG SER A 126 1.905 6.401 -0.978 1.00 0.00 O ATOM 0 H SER A 126 -0.842 5.173 1.470 1.00 0.00 H new ATOM 0 HA SER A 126 0.518 7.672 0.985 1.00 0.00 H new ATOM 0 HB2 SER A 126 1.709 5.520 0.872 1.00 0.00 H new ATOM 0 HB3 SER A 126 0.604 4.932 -0.356 1.00 0.00 H new ATOM 0 HG SER A 126 2.844 6.184 -0.801 1.00 0.00 H new ATOM 748 N GLU A 127 -1.951 6.757 -0.900 1.00 0.00 N ATOM 749 CA GLU A 127 -2.801 7.150 -2.017 1.00 0.00 C ATOM 750 C GLU A 127 -3.606 8.395 -1.683 1.00 0.00 C ATOM 751 O GLU A 127 -3.761 9.291 -2.513 1.00 0.00 O ATOM 752 CB GLU A 127 -3.754 6.010 -2.387 1.00 0.00 C ATOM 753 CG GLU A 127 -3.441 5.367 -3.728 1.00 0.00 C ATOM 754 CD GLU A 127 -3.940 3.938 -3.819 1.00 0.00 C ATOM 755 OE1 GLU A 127 -4.149 3.313 -2.758 1.00 0.00 O ATOM 756 OE2 GLU A 127 -4.123 3.444 -4.952 1.00 0.00 O ATOM 0 H GLU A 127 -2.336 6.013 -0.318 1.00 0.00 H new ATOM 0 HA GLU A 127 -2.153 7.372 -2.865 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -3.714 5.247 -1.609 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -4.775 6.392 -2.406 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -3.894 5.958 -4.525 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -2.364 5.383 -3.892 1.00 0.00 H new ATOM 763 N LEU A 128 -4.145 8.427 -0.475 1.00 0.00 N ATOM 764 CA LEU A 128 -4.971 9.536 -0.034 1.00 0.00 C ATOM 765 C LEU A 128 -4.297 10.361 1.062 1.00 0.00 C ATOM 766 O LEU A 128 -4.872 11.331 1.556 1.00 0.00 O ATOM 767 CB LEU A 128 -6.291 8.975 0.474 1.00 0.00 C ATOM 768 CG LEU A 128 -6.970 7.989 -0.481 1.00 0.00 C ATOM 769 CD1 LEU A 128 -6.954 6.586 0.099 1.00 0.00 C ATOM 770 CD2 LEU A 128 -8.393 8.421 -0.785 1.00 0.00 C ATOM 0 H LEU A 128 -4.023 7.691 0.221 1.00 0.00 H new ATOM 0 HA LEU A 128 -5.132 10.206 -0.878 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -6.117 8.477 1.428 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -6.973 9.803 0.667 1.00 0.00 H new ATOM 0 HG LEU A 128 -6.409 7.984 -1.415 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -7.441 5.900 -0.594 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -5.923 6.270 0.258 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -7.486 6.579 1.050 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -8.853 7.704 -1.465 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -8.966 8.462 0.141 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -8.383 9.407 -1.250 1.00 0.00 H new ATOM 782 N GLY A 129 -3.079 9.982 1.439 1.00 0.00 N ATOM 783 CA GLY A 129 -2.368 10.716 2.471 1.00 0.00 C ATOM 784 C GLY A 129 -2.825 10.345 3.868 1.00 0.00 C ATOM 785 O GLY A 129 -2.439 9.303 4.397 1.00 0.00 O ATOM 0 H GLY A 129 -2.574 9.185 1.051 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -1.299 10.523 2.379 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -2.513 11.785 2.317 1.00 0.00 H new ATOM 956 N VAL A 141 -12.632 2.725 0.551 1.00 0.00 N ATOM 957 CA VAL A 141 -11.673 1.682 0.206 1.00 0.00 C ATOM 958 C VAL A 141 -12.195 0.814 -0.938 1.00 0.00 C ATOM 959 O VAL A 141 -11.429 0.112 -1.598 1.00 0.00 O ATOM 960 CB VAL A 141 -11.359 0.782 1.416 1.00 0.00 C ATOM 961 CG1 VAL A 141 -10.162 -0.108 1.123 1.00 0.00 C ATOM 962 CG2 VAL A 141 -11.113 1.623 2.660 1.00 0.00 C ATOM 0 HA VAL A 141 -10.758 2.185 -0.108 1.00 0.00 H new ATOM 0 HB VAL A 141 -12.222 0.143 1.602 1.00 0.00 H new ATOM 0 HG11 VAL A 141 -9.955 -0.737 1.989 1.00 0.00 H new ATOM 0 HG12 VAL A 141 -10.380 -0.738 0.261 1.00 0.00 H new ATOM 0 HG13 VAL A 141 -9.291 0.512 0.909 1.00 0.00 H new ATOM 0 HG21 VAL A 141 -10.893 0.969 3.504 1.00 0.00 H new ATOM 0 HG22 VAL A 141 -10.268 2.289 2.487 1.00 0.00 H new ATOM 0 HG23 VAL A 141 -12.002 2.214 2.881 1.00 0.00 H new ATOM 972 N SER A 142 -13.504 0.874 -1.169 1.00 0.00 N ATOM 973 CA SER A 142 -14.144 0.105 -2.232 1.00 0.00 C ATOM 974 C SER A 142 -13.623 0.508 -3.612 1.00 0.00 C ATOM 975 O SER A 142 -13.845 -0.200 -4.595 1.00 0.00 O ATOM 976 CB SER A 142 -15.661 0.289 -2.176 1.00 0.00 C ATOM 977 OG SER A 142 -16.050 1.509 -2.783 1.00 0.00 O ATOM 0 H SER A 142 -14.147 1.453 -0.629 1.00 0.00 H new ATOM 0 HA SER A 142 -13.898 -0.945 -2.073 1.00 0.00 H new ATOM 0 HB2 SER A 142 -16.150 -0.544 -2.681 1.00 0.00 H new ATOM 0 HB3 SER A 142 -15.994 0.273 -1.138 1.00 0.00 H new ATOM 0 HG SER A 142 -17.024 1.602 -2.736 1.00 0.00 H new ATOM 983 N ASP A 143 -12.927 1.640 -3.685 1.00 0.00 N ATOM 984 CA ASP A 143 -12.379 2.117 -4.949 1.00 0.00 C ATOM 985 C ASP A 143 -10.967 1.577 -5.170 1.00 0.00 C ATOM 986 O ASP A 143 -10.518 1.435 -6.307 1.00 0.00 O ATOM 987 CB ASP A 143 -12.365 3.648 -4.978 1.00 0.00 C ATOM 988 CG ASP A 143 -13.459 4.218 -5.860 1.00 0.00 C ATOM 989 OD1 ASP A 143 -14.525 3.577 -5.973 1.00 0.00 O ATOM 990 OD2 ASP A 143 -13.249 5.305 -6.438 1.00 0.00 O ATOM 0 H ASP A 143 -12.730 2.242 -2.885 1.00 0.00 H new ATOM 0 HA ASP A 143 -13.017 1.752 -5.754 1.00 0.00 H new ATOM 0 HB2 ASP A 143 -12.484 4.029 -3.964 1.00 0.00 H new ATOM 0 HB3 ASP A 143 -11.395 3.993 -5.337 1.00 0.00 H new ATOM 995 N PHE A 144 -10.272 1.279 -4.076 1.00 0.00 N ATOM 996 CA PHE A 144 -8.911 0.757 -4.153 1.00 0.00 C ATOM 997 C PHE A 144 -8.907 -0.768 -4.116 1.00 0.00 C ATOM 998 O PHE A 144 -9.431 -1.378 -3.184 1.00 0.00 O ATOM 999 CB PHE A 144 -8.066 1.310 -3.004 1.00 0.00 C ATOM 1000 CG PHE A 144 -7.984 2.810 -2.989 1.00 0.00 C ATOM 1001 CD1 PHE A 144 -8.947 3.562 -2.337 1.00 0.00 C ATOM 1002 CD2 PHE A 144 -6.944 3.466 -3.627 1.00 0.00 C ATOM 1003 CE1 PHE A 144 -8.875 4.942 -2.321 1.00 0.00 C ATOM 1004 CE2 PHE A 144 -6.866 4.846 -3.615 1.00 0.00 C ATOM 1005 CZ PHE A 144 -7.833 5.585 -2.961 1.00 0.00 C ATOM 0 H PHE A 144 -10.628 1.390 -3.127 1.00 0.00 H new ATOM 0 HA PHE A 144 -8.479 1.078 -5.101 1.00 0.00 H new ATOM 0 HB2 PHE A 144 -8.485 0.967 -2.058 1.00 0.00 H new ATOM 0 HB3 PHE A 144 -7.059 0.900 -3.074 1.00 0.00 H new ATOM 0 HD1 PHE A 144 -9.764 3.064 -1.835 1.00 0.00 H new ATOM 0 HD2 PHE A 144 -6.186 2.893 -4.140 1.00 0.00 H new ATOM 0 HE1 PHE A 144 -9.632 5.517 -1.809 1.00 0.00 H new ATOM 0 HE2 PHE A 144 -6.050 5.346 -4.116 1.00 0.00 H new ATOM 0 HZ PHE A 144 -7.774 6.663 -2.950 1.00 0.00 H new ATOM 1015 N LYS A 145 -8.313 -1.376 -5.138 1.00 0.00 N ATOM 1016 CA LYS A 145 -8.240 -2.831 -5.227 1.00 0.00 C ATOM 1017 C LYS A 145 -7.144 -3.382 -4.319 1.00 0.00 C ATOM 1018 O LYS A 145 -5.983 -3.474 -4.718 1.00 0.00 O ATOM 1019 CB LYS A 145 -7.983 -3.260 -6.673 1.00 0.00 C ATOM 1020 CG LYS A 145 -6.744 -2.624 -7.285 1.00 0.00 C ATOM 1021 CD LYS A 145 -7.106 -1.643 -8.389 1.00 0.00 C ATOM 1022 CE LYS A 145 -5.907 -0.808 -8.809 1.00 0.00 C ATOM 1023 NZ LYS A 145 -5.971 0.573 -8.257 1.00 0.00 N ATOM 0 H LYS A 145 -7.875 -0.884 -5.917 1.00 0.00 H new ATOM 0 HA LYS A 145 -9.196 -3.237 -4.896 1.00 0.00 H new ATOM 0 HB2 LYS A 145 -7.880 -4.345 -6.709 1.00 0.00 H new ATOM 0 HB3 LYS A 145 -8.851 -3.002 -7.280 1.00 0.00 H new ATOM 0 HG2 LYS A 145 -6.179 -2.107 -6.509 1.00 0.00 H new ATOM 0 HG3 LYS A 145 -6.096 -3.402 -7.687 1.00 0.00 H new ATOM 0 HD2 LYS A 145 -7.490 -2.189 -9.251 1.00 0.00 H new ATOM 0 HD3 LYS A 145 -7.905 -0.986 -8.046 1.00 0.00 H new ATOM 0 HE2 LYS A 145 -4.991 -1.292 -8.470 1.00 0.00 H new ATOM 0 HE3 LYS A 145 -5.860 -0.762 -9.897 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 -5.153 1.120 -8.594 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 -6.849 1.033 -8.573 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 -5.956 0.533 -7.218 1.00 0.00 H new ATOM 1037 N LEU A 146 -7.521 -3.746 -3.097 1.00 0.00 N ATOM 1038 CA LEU A 146 -6.569 -4.289 -2.134 1.00 0.00 C ATOM 1039 C LEU A 146 -6.418 -5.798 -2.300 1.00 0.00 C ATOM 1040 O LEU A 146 -5.396 -6.373 -1.926 1.00 0.00 O ATOM 1041 CB LEU A 146 -7.016 -3.969 -0.707 1.00 0.00 C ATOM 1042 CG LEU A 146 -7.526 -2.544 -0.489 1.00 0.00 C ATOM 1043 CD1 LEU A 146 -8.394 -2.476 0.758 1.00 0.00 C ATOM 1044 CD2 LEU A 146 -6.360 -1.571 -0.388 1.00 0.00 C ATOM 0 H LEU A 146 -8.478 -3.675 -2.751 1.00 0.00 H new ATOM 0 HA LEU A 146 -5.602 -3.823 -2.322 1.00 0.00 H new ATOM 0 HB2 LEU A 146 -7.804 -4.667 -0.425 1.00 0.00 H new ATOM 0 HB3 LEU A 146 -6.178 -4.145 -0.033 1.00 0.00 H new ATOM 0 HG LEU A 146 -8.136 -2.258 -1.346 1.00 0.00 H new ATOM 0 HD11 LEU A 146 -8.749 -1.455 0.899 1.00 0.00 H new ATOM 0 HD12 LEU A 146 -9.247 -3.144 0.644 1.00 0.00 H new ATOM 0 HD13 LEU A 146 -7.809 -2.780 1.626 1.00 0.00 H new ATOM 0 HD21 LEU A 146 -6.741 -0.562 -0.233 1.00 0.00 H new ATOM 0 HD22 LEU A 146 -5.724 -1.852 0.451 1.00 0.00 H new ATOM 0 HD23 LEU A 146 -5.779 -1.602 -1.310 1.00 0.00 H new ATOM 1056 N ALA A 147 -7.440 -6.436 -2.862 1.00 0.00 N ATOM 1057 CA ALA A 147 -7.414 -7.878 -3.074 1.00 0.00 C ATOM 1058 C ALA A 147 -8.572 -8.325 -3.963 1.00 0.00 C ATOM 1059 O ALA A 147 -9.521 -7.573 -4.185 1.00 0.00 O ATOM 1060 CB ALA A 147 -7.458 -8.609 -1.740 1.00 0.00 C ATOM 0 H ALA A 147 -8.295 -5.978 -3.178 1.00 0.00 H new ATOM 0 HA ALA A 147 -6.483 -8.128 -3.583 1.00 0.00 H new ATOM 0 HB1 ALA A 147 -7.438 -9.685 -1.914 1.00 0.00 H new ATOM 0 HB2 ALA A 147 -6.595 -8.322 -1.139 1.00 0.00 H new ATOM 0 HB3 ALA A 147 -8.373 -8.344 -1.210 1.00 0.00 H new ATOM 1066 N PRO A 148 -8.507 -9.561 -4.487 1.00 0.00 N ATOM 1067 CA PRO A 148 -9.554 -10.106 -5.356 1.00 0.00 C ATOM 1068 C PRO A 148 -10.829 -10.439 -4.589 1.00 0.00 C ATOM 1069 O PRO A 148 -11.930 -10.365 -5.133 1.00 0.00 O ATOM 1070 CB PRO A 148 -8.921 -11.379 -5.917 1.00 0.00 C ATOM 1071 CG PRO A 148 -7.933 -11.795 -4.883 1.00 0.00 C ATOM 1072 CD PRO A 148 -7.409 -10.523 -4.273 1.00 0.00 C ATOM 0 HA PRO A 148 -9.861 -9.393 -6.121 1.00 0.00 H new ATOM 0 HB2 PRO A 148 -9.670 -12.153 -6.084 1.00 0.00 H new ATOM 0 HB3 PRO A 148 -8.437 -11.192 -6.875 1.00 0.00 H new ATOM 0 HG2 PRO A 148 -8.401 -12.426 -4.127 1.00 0.00 H new ATOM 0 HG3 PRO A 148 -7.125 -12.376 -5.327 1.00 0.00 H new ATOM 0 HD2 PRO A 148 -7.186 -10.648 -3.213 1.00 0.00 H new ATOM 0 HD3 PRO A 148 -6.488 -10.196 -4.756 1.00 0.00 H new ATOM 1080 N ASN A 149 -10.672 -10.807 -3.321 1.00 0.00 N ATOM 1081 CA ASN A 149 -11.812 -11.153 -2.480 1.00 0.00 C ATOM 1082 C ASN A 149 -11.865 -10.262 -1.242 1.00 0.00 C ATOM 1083 O ASN A 149 -11.731 -10.739 -0.114 1.00 0.00 O ATOM 1084 CB ASN A 149 -11.739 -12.624 -2.065 1.00 0.00 C ATOM 1085 CG ASN A 149 -13.101 -13.201 -1.735 1.00 0.00 C ATOM 1086 OD1 ASN A 149 -13.307 -13.761 -0.658 1.00 0.00 O ATOM 1087 ND2 ASN A 149 -14.042 -13.066 -2.663 1.00 0.00 N ATOM 0 H ASN A 149 -9.767 -10.873 -2.854 1.00 0.00 H new ATOM 0 HA ASN A 149 -12.722 -10.992 -3.059 1.00 0.00 H new ATOM 0 HB2 ASN A 149 -11.288 -13.204 -2.870 1.00 0.00 H new ATOM 0 HB3 ASN A 149 -11.086 -12.722 -1.197 1.00 0.00 H new ATOM 0 HD21 ASN A 149 -14.979 -13.434 -2.497 1.00 0.00 H new ATOM 0 HD22 ASN A 149 -13.828 -12.595 -3.542 1.00 0.00 H new ATOM 1094 N GLN A 150 -12.060 -8.966 -1.460 1.00 0.00 N ATOM 1095 CA GLN A 150 -12.130 -8.010 -0.362 1.00 0.00 C ATOM 1096 C GLN A 150 -13.403 -8.209 0.453 1.00 0.00 C ATOM 1097 O GLN A 150 -14.512 -8.060 -0.061 1.00 0.00 O ATOM 1098 CB GLN A 150 -12.074 -6.578 -0.897 1.00 0.00 C ATOM 1099 CG GLN A 150 -11.724 -5.547 0.164 1.00 0.00 C ATOM 1100 CD GLN A 150 -11.343 -4.206 -0.431 1.00 0.00 C ATOM 1101 OE1 GLN A 150 -12.062 -3.219 -0.277 1.00 0.00 O ATOM 1102 NE2 GLN A 150 -10.206 -4.164 -1.115 1.00 0.00 N ATOM 0 H GLN A 150 -12.172 -8.554 -2.386 1.00 0.00 H new ATOM 0 HA GLN A 150 -11.272 -8.181 0.288 1.00 0.00 H new ATOM 0 HB2 GLN A 150 -11.337 -6.527 -1.699 1.00 0.00 H new ATOM 0 HB3 GLN A 150 -13.040 -6.324 -1.334 1.00 0.00 H new ATOM 0 HG2 GLN A 150 -12.575 -5.415 0.832 1.00 0.00 H new ATOM 0 HG3 GLN A 150 -10.898 -5.920 0.769 1.00 0.00 H new ATOM 0 HE21 GLN A 150 -9.641 -5.007 -1.217 1.00 0.00 H new ATOM 0 HE22 GLN A 150 -9.897 -3.289 -1.538 1.00 0.00 H new ATOM 1111 N THR A 151 -13.235 -8.546 1.727 1.00 0.00 N ATOM 1112 CA THR A 151 -14.370 -8.766 2.616 1.00 0.00 C ATOM 1113 C THR A 151 -14.423 -7.699 3.704 1.00 0.00 C ATOM 1114 O THR A 151 -13.443 -6.992 3.939 1.00 0.00 O ATOM 1115 CB THR A 151 -14.288 -10.155 3.250 1.00 0.00 C ATOM 1116 OG1 THR A 151 -15.374 -10.368 4.134 1.00 0.00 O ATOM 1117 CG2 THR A 151 -13.011 -10.383 4.028 1.00 0.00 C ATOM 0 H THR A 151 -12.324 -8.673 2.167 1.00 0.00 H new ATOM 0 HA THR A 151 -15.282 -8.700 2.023 1.00 0.00 H new ATOM 0 HB THR A 151 -14.316 -10.855 2.415 1.00 0.00 H new ATOM 0 HG1 THR A 151 -15.304 -11.263 4.528 1.00 0.00 H new ATOM 0 HG21 THR A 151 -13.017 -11.387 4.451 1.00 0.00 H new ATOM 0 HG22 THR A 151 -12.155 -10.275 3.362 1.00 0.00 H new ATOM 0 HG23 THR A 151 -12.939 -9.651 4.832 1.00 0.00 H new ATOM 1125 N LYS A 152 -15.575 -7.584 4.362 1.00 0.00 N ATOM 1126 CA LYS A 152 -15.761 -6.598 5.425 1.00 0.00 C ATOM 1127 C LYS A 152 -14.569 -6.578 6.378 1.00 0.00 C ATOM 1128 O LYS A 152 -14.092 -5.513 6.767 1.00 0.00 O ATOM 1129 CB LYS A 152 -17.047 -6.894 6.201 1.00 0.00 C ATOM 1130 CG LYS A 152 -17.908 -5.663 6.440 1.00 0.00 C ATOM 1131 CD LYS A 152 -19.255 -5.774 5.740 1.00 0.00 C ATOM 1132 CE LYS A 152 -20.376 -6.059 6.726 1.00 0.00 C ATOM 1133 NZ LYS A 152 -21.677 -5.503 6.264 1.00 0.00 N ATOM 0 H LYS A 152 -16.395 -8.162 4.177 1.00 0.00 H new ATOM 0 HA LYS A 152 -15.839 -5.615 4.960 1.00 0.00 H new ATOM 0 HB2 LYS A 152 -17.630 -7.635 5.654 1.00 0.00 H new ATOM 0 HB3 LYS A 152 -16.788 -7.339 7.162 1.00 0.00 H new ATOM 0 HG2 LYS A 152 -18.064 -5.530 7.511 1.00 0.00 H new ATOM 0 HG3 LYS A 152 -17.384 -4.777 6.082 1.00 0.00 H new ATOM 0 HD2 LYS A 152 -19.466 -4.847 5.206 1.00 0.00 H new ATOM 0 HD3 LYS A 152 -19.214 -6.569 4.995 1.00 0.00 H new ATOM 0 HE2 LYS A 152 -20.471 -7.136 6.866 1.00 0.00 H new ATOM 0 HE3 LYS A 152 -20.123 -5.632 7.696 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 -22.415 -5.719 6.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 -21.595 -4.472 6.154 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 -21.932 -5.929 5.350 1.00 0.00 H new ATOM 1147 N GLU A 153 -14.092 -7.762 6.750 1.00 0.00 N ATOM 1148 CA GLU A 153 -12.955 -7.876 7.656 1.00 0.00 C ATOM 1149 C GLU A 153 -11.743 -7.134 7.102 1.00 0.00 C ATOM 1150 O GLU A 153 -11.167 -6.276 7.772 1.00 0.00 O ATOM 1151 CB GLU A 153 -12.607 -9.348 7.889 1.00 0.00 C ATOM 1152 CG GLU A 153 -13.182 -9.912 9.178 1.00 0.00 C ATOM 1153 CD GLU A 153 -14.698 -9.947 9.173 1.00 0.00 C ATOM 1154 OE1 GLU A 153 -15.313 -8.937 8.771 1.00 0.00 O ATOM 1155 OE2 GLU A 153 -15.270 -10.983 9.572 1.00 0.00 O ATOM 0 H GLU A 153 -14.475 -8.655 6.438 1.00 0.00 H new ATOM 0 HA GLU A 153 -13.232 -7.422 8.607 1.00 0.00 H new ATOM 0 HB2 GLU A 153 -12.974 -9.937 7.049 1.00 0.00 H new ATOM 0 HB3 GLU A 153 -11.523 -9.458 7.906 1.00 0.00 H new ATOM 0 HG2 GLU A 153 -12.799 -10.921 9.331 1.00 0.00 H new ATOM 0 HG3 GLU A 153 -12.839 -9.310 10.019 1.00 0.00 H new ATOM 1162 N LEU A 154 -11.363 -7.466 5.872 1.00 0.00 N ATOM 1163 CA LEU A 154 -10.223 -6.827 5.226 1.00 0.00 C ATOM 1164 C LEU A 154 -10.467 -5.329 5.070 1.00 0.00 C ATOM 1165 O LEU A 154 -9.566 -4.518 5.277 1.00 0.00 O ATOM 1166 CB LEU A 154 -9.965 -7.465 3.859 1.00 0.00 C ATOM 1167 CG LEU A 154 -8.866 -6.804 3.027 1.00 0.00 C ATOM 1168 CD1 LEU A 154 -7.558 -6.762 3.804 1.00 0.00 C ATOM 1169 CD2 LEU A 154 -8.682 -7.541 1.708 1.00 0.00 C ATOM 0 H LEU A 154 -11.828 -8.174 5.303 1.00 0.00 H new ATOM 0 HA LEU A 154 -9.344 -6.971 5.854 1.00 0.00 H new ATOM 0 HB2 LEU A 154 -9.704 -8.513 4.009 1.00 0.00 H new ATOM 0 HB3 LEU A 154 -10.892 -7.446 3.287 1.00 0.00 H new ATOM 0 HG LEU A 154 -9.167 -5.779 2.810 1.00 0.00 H new ATOM 0 HD11 LEU A 154 -6.788 -6.288 3.195 1.00 0.00 H new ATOM 0 HD12 LEU A 154 -7.698 -6.190 4.721 1.00 0.00 H new ATOM 0 HD13 LEU A 154 -7.250 -7.778 4.053 1.00 0.00 H new ATOM 0 HD21 LEU A 154 -7.896 -7.058 1.128 1.00 0.00 H new ATOM 0 HD22 LEU A 154 -8.403 -8.576 1.905 1.00 0.00 H new ATOM 0 HD23 LEU A 154 -9.615 -7.518 1.145 1.00 0.00 H new ATOM 1181 N GLU A 155 -11.694 -4.974 4.707 1.00 0.00 N ATOM 1182 CA GLU A 155 -12.063 -3.575 4.526 1.00 0.00 C ATOM 1183 C GLU A 155 -11.861 -2.791 5.820 1.00 0.00 C ATOM 1184 O GLU A 155 -11.177 -1.768 5.838 1.00 0.00 O ATOM 1185 CB GLU A 155 -13.520 -3.463 4.070 1.00 0.00 C ATOM 1186 CG GLU A 155 -13.687 -3.471 2.559 1.00 0.00 C ATOM 1187 CD GLU A 155 -14.363 -2.217 2.039 1.00 0.00 C ATOM 1188 OE1 GLU A 155 -15.379 -1.801 2.633 1.00 0.00 O ATOM 1189 OE2 GLU A 155 -13.876 -1.652 1.037 1.00 0.00 O ATOM 0 H GLU A 155 -12.450 -5.636 4.532 1.00 0.00 H new ATOM 0 HA GLU A 155 -11.417 -3.150 3.758 1.00 0.00 H new ATOM 0 HB2 GLU A 155 -14.089 -4.290 4.494 1.00 0.00 H new ATOM 0 HB3 GLU A 155 -13.947 -2.543 4.470 1.00 0.00 H new ATOM 0 HG2 GLU A 155 -12.708 -3.573 2.090 1.00 0.00 H new ATOM 0 HG3 GLU A 155 -14.273 -4.343 2.267 1.00 0.00 H new ATOM 1196 N GLU A 156 -12.463 -3.279 6.900 1.00 0.00 N ATOM 1197 CA GLU A 156 -12.354 -2.627 8.201 1.00 0.00 C ATOM 1198 C GLU A 156 -10.893 -2.455 8.608 1.00 0.00 C ATOM 1199 O GLU A 156 -10.478 -1.375 9.023 1.00 0.00 O ATOM 1200 CB GLU A 156 -13.099 -3.436 9.264 1.00 0.00 C ATOM 1201 CG GLU A 156 -14.612 -3.374 9.127 1.00 0.00 C ATOM 1202 CD GLU A 156 -15.290 -2.826 10.369 1.00 0.00 C ATOM 1203 OE1 GLU A 156 -14.803 -1.813 10.913 1.00 0.00 O ATOM 1204 OE2 GLU A 156 -16.307 -3.411 10.796 1.00 0.00 O ATOM 0 H GLU A 156 -13.032 -4.125 6.900 1.00 0.00 H new ATOM 0 HA GLU A 156 -12.807 -1.639 8.121 1.00 0.00 H new ATOM 0 HB2 GLU A 156 -12.780 -4.477 9.207 1.00 0.00 H new ATOM 0 HB3 GLU A 156 -12.817 -3.070 10.251 1.00 0.00 H new ATOM 0 HG2 GLU A 156 -14.870 -2.750 8.272 1.00 0.00 H new ATOM 0 HG3 GLU A 156 -14.995 -4.373 8.920 1.00 0.00 H new ATOM 1211 N LYS A 157 -10.124 -3.534 8.506 1.00 0.00 N ATOM 1212 CA LYS A 157 -8.715 -3.508 8.885 1.00 0.00 C ATOM 1213 C LYS A 157 -7.944 -2.446 8.103 1.00 0.00 C ATOM 1214 O LYS A 157 -7.015 -1.833 8.630 1.00 0.00 O ATOM 1215 CB LYS A 157 -8.082 -4.882 8.656 1.00 0.00 C ATOM 1216 CG LYS A 157 -6.927 -5.184 9.597 1.00 0.00 C ATOM 1217 CD LYS A 157 -7.420 -5.742 10.923 1.00 0.00 C ATOM 1218 CE LYS A 157 -6.533 -6.874 11.416 1.00 0.00 C ATOM 1219 NZ LYS A 157 -7.325 -7.970 12.038 1.00 0.00 N ATOM 0 H LYS A 157 -10.452 -4.437 8.164 1.00 0.00 H new ATOM 0 HA LYS A 157 -8.661 -3.254 9.944 1.00 0.00 H new ATOM 0 HB2 LYS A 157 -8.847 -5.650 8.775 1.00 0.00 H new ATOM 0 HB3 LYS A 157 -7.727 -4.942 7.627 1.00 0.00 H new ATOM 0 HG2 LYS A 157 -6.252 -5.900 9.128 1.00 0.00 H new ATOM 0 HG3 LYS A 157 -6.353 -4.274 9.775 1.00 0.00 H new ATOM 0 HD2 LYS A 157 -7.443 -4.946 11.668 1.00 0.00 H new ATOM 0 HD3 LYS A 157 -8.442 -6.103 10.810 1.00 0.00 H new ATOM 0 HE2 LYS A 157 -5.955 -7.272 10.582 1.00 0.00 H new ATOM 0 HE3 LYS A 157 -5.819 -6.486 12.142 1.00 0.00 H new ATOM 0 HZ1 LYS A 157 -6.683 -8.722 12.361 1.00 0.00 H new ATOM 0 HZ2 LYS A 157 -7.857 -7.596 12.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 157 -7.989 -8.359 11.338 1.00 0.00 H new ATOM 1233 N VAL A 158 -8.331 -2.228 6.851 1.00 0.00 N ATOM 1234 CA VAL A 158 -7.667 -1.232 6.016 1.00 0.00 C ATOM 1235 C VAL A 158 -7.917 0.180 6.542 1.00 0.00 C ATOM 1236 O VAL A 158 -6.982 0.958 6.733 1.00 0.00 O ATOM 1237 CB VAL A 158 -8.140 -1.318 4.549 1.00 0.00 C ATOM 1238 CG1 VAL A 158 -7.394 -0.313 3.680 1.00 0.00 C ATOM 1239 CG2 VAL A 158 -7.963 -2.732 4.012 1.00 0.00 C ATOM 0 H VAL A 158 -9.096 -2.724 6.394 1.00 0.00 H new ATOM 0 HA VAL A 158 -6.599 -1.447 6.055 1.00 0.00 H new ATOM 0 HB VAL A 158 -9.201 -1.070 4.517 1.00 0.00 H new ATOM 0 HG11 VAL A 158 -7.744 -0.392 2.651 1.00 0.00 H new ATOM 0 HG12 VAL A 158 -7.579 0.696 4.050 1.00 0.00 H new ATOM 0 HG13 VAL A 158 -6.325 -0.523 3.717 1.00 0.00 H new ATOM 0 HG21 VAL A 158 -8.302 -2.773 2.977 1.00 0.00 H new ATOM 0 HG22 VAL A 158 -6.910 -3.011 4.061 1.00 0.00 H new ATOM 0 HG23 VAL A 158 -8.550 -3.426 4.614 1.00 0.00 H new ATOM 1249 N MET A 159 -9.186 0.502 6.774 1.00 0.00 N ATOM 1250 CA MET A 159 -9.563 1.819 7.277 1.00 0.00 C ATOM 1251 C MET A 159 -9.069 2.023 8.706 1.00 0.00 C ATOM 1252 O MET A 159 -8.557 3.089 9.050 1.00 0.00 O ATOM 1253 CB MET A 159 -11.082 1.991 7.221 1.00 0.00 C ATOM 1254 CG MET A 159 -11.679 1.681 5.858 1.00 0.00 C ATOM 1255 SD MET A 159 -13.482 1.710 5.867 1.00 0.00 S ATOM 1256 CE MET A 159 -13.850 -0.020 5.587 1.00 0.00 C ATOM 0 H MET A 159 -9.971 -0.131 6.622 1.00 0.00 H new ATOM 0 HA MET A 159 -9.093 2.570 6.642 1.00 0.00 H new ATOM 0 HB2 MET A 159 -11.541 1.341 7.966 1.00 0.00 H new ATOM 0 HB3 MET A 159 -11.334 3.016 7.494 1.00 0.00 H new ATOM 0 HG2 MET A 159 -11.311 2.405 5.131 1.00 0.00 H new ATOM 0 HG3 MET A 159 -11.337 0.699 5.530 1.00 0.00 H new ATOM 0 HE1 MET A 159 -14.858 -0.117 5.184 1.00 0.00 H new ATOM 0 HE2 MET A 159 -13.134 -0.434 4.877 1.00 0.00 H new ATOM 0 HE3 MET A 159 -13.783 -0.563 6.529 1.00 0.00 H new ATOM 1266 N GLU A 160 -9.226 0.996 9.533 1.00 0.00 N ATOM 1267 CA GLU A 160 -8.798 1.060 10.925 1.00 0.00 C ATOM 1268 C GLU A 160 -7.300 1.329 11.021 1.00 0.00 C ATOM 1269 O GLU A 160 -6.869 2.263 11.696 1.00 0.00 O ATOM 1270 CB GLU A 160 -9.141 -0.244 11.648 1.00 0.00 C ATOM 1271 CG GLU A 160 -9.183 -0.107 13.161 1.00 0.00 C ATOM 1272 CD GLU A 160 -10.414 -0.750 13.771 1.00 0.00 C ATOM 1273 OE1 GLU A 160 -10.372 -1.967 14.048 1.00 0.00 O ATOM 1274 OE2 GLU A 160 -11.418 -0.036 13.972 1.00 0.00 O ATOM 0 H GLU A 160 -9.647 0.107 9.263 1.00 0.00 H new ATOM 0 HA GLU A 160 -9.329 1.883 11.404 1.00 0.00 H new ATOM 0 HB2 GLU A 160 -10.109 -0.601 11.297 1.00 0.00 H new ATOM 0 HB3 GLU A 160 -8.405 -1.003 11.380 1.00 0.00 H new ATOM 0 HG2 GLU A 160 -8.290 -0.563 13.588 1.00 0.00 H new ATOM 0 HG3 GLU A 160 -9.160 0.950 13.427 1.00 0.00 H new ATOM 1281 N LEU A 161 -6.511 0.504 10.339 1.00 0.00 N ATOM 1282 CA LEU A 161 -5.060 0.655 10.346 1.00 0.00 C ATOM 1283 C LEU A 161 -4.658 2.047 9.872 1.00 0.00 C ATOM 1284 O LEU A 161 -3.742 2.660 10.419 1.00 0.00 O ATOM 1285 CB LEU A 161 -4.411 -0.408 9.458 1.00 0.00 C ATOM 1286 CG LEU A 161 -4.439 -1.830 10.023 1.00 0.00 C ATOM 1287 CD1 LEU A 161 -4.265 -2.850 8.909 1.00 0.00 C ATOM 1288 CD2 LEU A 161 -3.360 -2.003 11.081 1.00 0.00 C ATOM 0 H LEU A 161 -6.852 -0.275 9.775 1.00 0.00 H new ATOM 0 HA LEU A 161 -4.710 0.524 11.370 1.00 0.00 H new ATOM 0 HB2 LEU A 161 -4.914 -0.408 8.491 1.00 0.00 H new ATOM 0 HB3 LEU A 161 -3.374 -0.125 9.278 1.00 0.00 H new ATOM 0 HG LEU A 161 -5.409 -1.997 10.491 1.00 0.00 H new ATOM 0 HD11 LEU A 161 -4.287 -3.855 9.329 1.00 0.00 H new ATOM 0 HD12 LEU A 161 -5.074 -2.741 8.186 1.00 0.00 H new ATOM 0 HD13 LEU A 161 -3.309 -2.686 8.412 1.00 0.00 H new ATOM 0 HD21 LEU A 161 -3.394 -3.020 11.472 1.00 0.00 H new ATOM 0 HD22 LEU A 161 -2.382 -1.817 10.637 1.00 0.00 H new ATOM 0 HD23 LEU A 161 -3.530 -1.296 11.893 1.00 0.00 H new ATOM 1300 N HIS A 162 -5.353 2.542 8.852 1.00 0.00 N ATOM 1301 CA HIS A 162 -5.072 3.865 8.303 1.00 0.00 C ATOM 1302 C HIS A 162 -5.167 4.936 9.386 1.00 0.00 C ATOM 1303 O HIS A 162 -4.218 5.687 9.616 1.00 0.00 O ATOM 1304 CB HIS A 162 -6.046 4.184 7.168 1.00 0.00 C ATOM 1305 CG HIS A 162 -5.762 5.483 6.480 1.00 0.00 C ATOM 1306 ND1 HIS A 162 -5.717 5.614 5.108 1.00 0.00 N ATOM 1307 CD2 HIS A 162 -5.508 6.716 6.981 1.00 0.00 C ATOM 1308 CE1 HIS A 162 -5.448 6.869 4.795 1.00 0.00 C ATOM 1309 NE2 HIS A 162 -5.317 7.557 5.913 1.00 0.00 N ATOM 0 H HIS A 162 -6.115 2.047 8.389 1.00 0.00 H new ATOM 0 HA HIS A 162 -4.055 3.860 7.911 1.00 0.00 H new ATOM 0 HB2 HIS A 162 -6.011 3.379 6.434 1.00 0.00 H new ATOM 0 HB3 HIS A 162 -7.060 4.208 7.567 1.00 0.00 H new ATOM 0 HD2 HIS A 162 -5.464 6.987 8.026 1.00 0.00 H new ATOM 0 HE1 HIS A 162 -5.352 7.264 3.795 1.00 0.00 H new ATOM 0 HE2 HIS A 162 -5.108 8.553 5.974 1.00 0.00 H new ATOM 1318 N LYS A 163 -6.318 5.001 10.048 1.00 0.00 N ATOM 1319 CA LYS A 163 -6.539 5.980 11.106 1.00 0.00 C ATOM 1320 C LYS A 163 -5.684 5.666 12.330 1.00 0.00 C ATOM 1321 O LYS A 163 -5.304 6.565 13.081 1.00 0.00 O ATOM 1322 CB LYS A 163 -8.017 6.008 11.501 1.00 0.00 C ATOM 1323 CG LYS A 163 -8.916 6.645 10.454 1.00 0.00 C ATOM 1324 CD LYS A 163 -10.385 6.409 10.765 1.00 0.00 C ATOM 1325 CE LYS A 163 -11.019 7.625 11.423 1.00 0.00 C ATOM 1326 NZ LYS A 163 -11.148 7.456 12.896 1.00 0.00 N ATOM 0 H LYS A 163 -7.113 4.387 9.870 1.00 0.00 H new ATOM 0 HA LYS A 163 -6.249 6.959 10.724 1.00 0.00 H new ATOM 0 HB2 LYS A 163 -8.354 4.988 11.685 1.00 0.00 H new ATOM 0 HB3 LYS A 163 -8.123 6.553 12.439 1.00 0.00 H new ATOM 0 HG2 LYS A 163 -8.720 7.716 10.408 1.00 0.00 H new ATOM 0 HG3 LYS A 163 -8.680 6.235 9.472 1.00 0.00 H new ATOM 0 HD2 LYS A 163 -10.919 6.172 9.845 1.00 0.00 H new ATOM 0 HD3 LYS A 163 -10.484 5.545 11.422 1.00 0.00 H new ATOM 0 HE2 LYS A 163 -10.416 8.508 11.210 1.00 0.00 H new ATOM 0 HE3 LYS A 163 -12.004 7.800 10.990 1.00 0.00 H new ATOM 0 HZ1 LYS A 163 -11.584 8.306 13.306 1.00 0.00 H new ATOM 0 HZ2 LYS A 163 -11.744 6.628 13.100 1.00 0.00 H new ATOM 0 HZ3 LYS A 163 -10.206 7.315 13.313 1.00 0.00 H new ATOM 1340 N SER A 164 -5.389 4.385 12.528 1.00 0.00 N ATOM 1341 CA SER A 164 -4.583 3.952 13.664 1.00 0.00 C ATOM 1342 C SER A 164 -3.160 4.496 13.572 1.00 0.00 C ATOM 1343 O SER A 164 -2.478 4.646 14.586 1.00 0.00 O ATOM 1344 CB SER A 164 -4.551 2.425 13.740 1.00 0.00 C ATOM 1345 OG SER A 164 -4.232 1.985 15.048 1.00 0.00 O ATOM 0 H SER A 164 -5.696 3.629 11.916 1.00 0.00 H new ATOM 0 HA SER A 164 -5.043 4.348 14.570 1.00 0.00 H new ATOM 0 HB2 SER A 164 -5.520 2.023 13.444 1.00 0.00 H new ATOM 0 HB3 SER A 164 -3.816 2.038 13.034 1.00 0.00 H new ATOM 0 HG SER A 164 -4.220 1.005 15.070 1.00 0.00 H new ATOM 1424 N THR A 169 4.575 9.846 7.658 1.00 0.00 N ATOM 1425 CA THR A 169 4.923 10.549 6.428 1.00 0.00 C ATOM 1426 C THR A 169 4.779 9.627 5.222 1.00 0.00 C ATOM 1427 O THR A 169 4.734 8.405 5.367 1.00 0.00 O ATOM 1428 CB THR A 169 6.354 11.083 6.508 1.00 0.00 C ATOM 1429 OG1 THR A 169 7.291 10.033 6.347 1.00 0.00 O ATOM 1430 CG2 THR A 169 6.662 11.776 7.818 1.00 0.00 C ATOM 0 HA THR A 169 4.237 11.388 6.309 1.00 0.00 H new ATOM 0 HB THR A 169 6.435 11.812 5.702 1.00 0.00 H new ATOM 0 HG1 THR A 169 8.200 10.395 6.400 1.00 0.00 H new ATOM 0 HG21 THR A 169 7.693 12.131 7.809 1.00 0.00 H new ATOM 0 HG22 THR A 169 5.988 12.623 7.949 1.00 0.00 H new ATOM 0 HG23 THR A 169 6.527 11.074 8.641 1.00 0.00 H new ATOM 1438 N PRO A 170 4.710 10.200 4.009 1.00 0.00 N ATOM 1439 CA PRO A 170 4.576 9.418 2.778 1.00 0.00 C ATOM 1440 C PRO A 170 5.661 8.357 2.662 1.00 0.00 C ATOM 1441 O PRO A 170 5.376 7.178 2.453 1.00 0.00 O ATOM 1442 CB PRO A 170 4.732 10.461 1.669 1.00 0.00 C ATOM 1443 CG PRO A 170 4.345 11.752 2.303 1.00 0.00 C ATOM 1444 CD PRO A 170 4.763 11.649 3.743 1.00 0.00 C ATOM 0 HA PRO A 170 3.631 8.877 2.737 1.00 0.00 H new ATOM 0 HB2 PRO A 170 5.757 10.494 1.298 1.00 0.00 H new ATOM 0 HB3 PRO A 170 4.092 10.231 0.817 1.00 0.00 H new ATOM 0 HG2 PRO A 170 4.839 12.591 1.813 1.00 0.00 H new ATOM 0 HG3 PRO A 170 3.271 11.921 2.220 1.00 0.00 H new ATOM 0 HD2 PRO A 170 5.764 12.051 3.901 1.00 0.00 H new ATOM 0 HD3 PRO A 170 4.090 12.203 4.398 1.00 0.00 H new ATOM 1452 N ALA A 171 6.908 8.791 2.800 1.00 0.00 N ATOM 1453 CA ALA A 171 8.052 7.888 2.712 1.00 0.00 C ATOM 1454 C ALA A 171 7.884 6.687 3.638 1.00 0.00 C ATOM 1455 O ALA A 171 8.227 5.561 3.278 1.00 0.00 O ATOM 1456 CB ALA A 171 9.336 8.633 3.042 1.00 0.00 C ATOM 0 H ALA A 171 7.154 9.765 2.974 1.00 0.00 H new ATOM 0 HA ALA A 171 8.109 7.516 1.689 1.00 0.00 H new ATOM 0 HB1 ALA A 171 10.182 7.949 2.973 1.00 0.00 H new ATOM 0 HB2 ALA A 171 9.473 9.452 2.336 1.00 0.00 H new ATOM 0 HB3 ALA A 171 9.275 9.033 4.054 1.00 0.00 H new ATOM 1462 N GLN A 172 7.353 6.933 4.832 1.00 0.00 N ATOM 1463 CA GLN A 172 7.139 5.869 5.807 1.00 0.00 C ATOM 1464 C GLN A 172 6.244 4.778 5.227 1.00 0.00 C ATOM 1465 O GLN A 172 6.508 3.588 5.396 1.00 0.00 O ATOM 1466 CB GLN A 172 6.517 6.436 7.085 1.00 0.00 C ATOM 1467 CG GLN A 172 7.456 6.411 8.281 1.00 0.00 C ATOM 1468 CD GLN A 172 7.943 7.793 8.671 1.00 0.00 C ATOM 1469 OE1 GLN A 172 7.209 8.573 9.278 1.00 0.00 O ATOM 1470 NE2 GLN A 172 9.186 8.103 8.322 1.00 0.00 N ATOM 0 H GLN A 172 7.063 7.859 5.147 1.00 0.00 H new ATOM 0 HA GLN A 172 8.106 5.429 6.051 1.00 0.00 H new ATOM 0 HB2 GLN A 172 6.203 7.463 6.902 1.00 0.00 H new ATOM 0 HB3 GLN A 172 5.619 5.866 7.326 1.00 0.00 H new ATOM 0 HG2 GLN A 172 6.945 5.957 9.130 1.00 0.00 H new ATOM 0 HG3 GLN A 172 8.314 5.779 8.051 1.00 0.00 H new ATOM 0 HE21 GLN A 172 9.759 7.425 7.819 1.00 0.00 H new ATOM 0 HE22 GLN A 172 9.568 9.019 8.556 1.00 0.00 H new ATOM 1479 N ALA A 173 5.187 5.194 4.537 1.00 0.00 N ATOM 1480 CA ALA A 173 4.255 4.256 3.926 1.00 0.00 C ATOM 1481 C ALA A 173 4.914 3.513 2.770 1.00 0.00 C ATOM 1482 O ALA A 173 4.815 2.290 2.665 1.00 0.00 O ATOM 1483 CB ALA A 173 3.010 4.988 3.448 1.00 0.00 C ATOM 0 H ALA A 173 4.955 6.176 4.387 1.00 0.00 H new ATOM 0 HA ALA A 173 3.963 3.522 4.678 1.00 0.00 H new ATOM 0 HB1 ALA A 173 2.321 4.276 2.993 1.00 0.00 H new ATOM 0 HB2 ALA A 173 2.524 5.472 4.296 1.00 0.00 H new ATOM 0 HB3 ALA A 173 3.291 5.742 2.712 1.00 0.00 H new ATOM 1489 N ASP A 174 5.594 4.263 1.907 1.00 0.00 N ATOM 1490 CA ASP A 174 6.280 3.681 0.759 1.00 0.00 C ATOM 1491 C ASP A 174 7.288 2.627 1.210 1.00 0.00 C ATOM 1492 O ASP A 174 7.394 1.551 0.618 1.00 0.00 O ATOM 1493 CB ASP A 174 6.993 4.774 -0.039 1.00 0.00 C ATOM 1494 CG ASP A 174 6.080 5.938 -0.370 1.00 0.00 C ATOM 1495 OD1 ASP A 174 4.860 5.713 -0.513 1.00 0.00 O ATOM 1496 OD2 ASP A 174 6.585 7.074 -0.487 1.00 0.00 O ATOM 0 H ASP A 174 5.684 5.276 1.982 1.00 0.00 H new ATOM 0 HA ASP A 174 5.536 3.201 0.123 1.00 0.00 H new ATOM 0 HB2 ASP A 174 7.848 5.137 0.531 1.00 0.00 H new ATOM 0 HB3 ASP A 174 7.384 4.349 -0.963 1.00 0.00 H new ATOM 1501 N LEU A 175 8.016 2.949 2.273 1.00 0.00 N ATOM 1502 CA LEU A 175 9.015 2.045 2.830 1.00 0.00 C ATOM 1503 C LEU A 175 8.357 0.867 3.547 1.00 0.00 C ATOM 1504 O LEU A 175 8.935 -0.215 3.642 1.00 0.00 O ATOM 1505 CB LEU A 175 9.926 2.804 3.799 1.00 0.00 C ATOM 1506 CG LEU A 175 11.212 2.077 4.195 1.00 0.00 C ATOM 1507 CD1 LEU A 175 11.928 1.540 2.964 1.00 0.00 C ATOM 1508 CD2 LEU A 175 12.125 3.006 4.981 1.00 0.00 C ATOM 0 H LEU A 175 7.932 3.836 2.769 1.00 0.00 H new ATOM 0 HA LEU A 175 9.611 1.651 2.007 1.00 0.00 H new ATOM 0 HB2 LEU A 175 10.193 3.759 3.347 1.00 0.00 H new ATOM 0 HB3 LEU A 175 9.361 3.026 4.704 1.00 0.00 H new ATOM 0 HG LEU A 175 10.947 1.232 4.830 1.00 0.00 H new ATOM 0 HD11 LEU A 175 12.840 1.027 3.269 1.00 0.00 H new ATOM 0 HD12 LEU A 175 11.276 0.841 2.440 1.00 0.00 H new ATOM 0 HD13 LEU A 175 12.181 2.367 2.301 1.00 0.00 H new ATOM 0 HD21 LEU A 175 13.036 2.474 5.256 1.00 0.00 H new ATOM 0 HD22 LEU A 175 12.380 3.870 4.368 1.00 0.00 H new ATOM 0 HD23 LEU A 175 11.614 3.340 5.884 1.00 0.00 H new ATOM 1520 N GLU A 176 7.153 1.091 4.063 1.00 0.00 N ATOM 1521 CA GLU A 176 6.421 0.057 4.788 1.00 0.00 C ATOM 1522 C GLU A 176 6.052 -1.119 3.885 1.00 0.00 C ATOM 1523 O GLU A 176 6.366 -2.271 4.192 1.00 0.00 O ATOM 1524 CB GLU A 176 5.155 0.647 5.411 1.00 0.00 C ATOM 1525 CG GLU A 176 5.378 1.239 6.794 1.00 0.00 C ATOM 1526 CD GLU A 176 5.519 0.178 7.867 1.00 0.00 C ATOM 1527 OE1 GLU A 176 5.813 -0.985 7.517 1.00 0.00 O ATOM 1528 OE2 GLU A 176 5.336 0.509 9.057 1.00 0.00 O ATOM 0 H GLU A 176 6.662 1.982 3.993 1.00 0.00 H new ATOM 0 HA GLU A 176 7.077 -0.318 5.574 1.00 0.00 H new ATOM 0 HB2 GLU A 176 4.762 1.421 4.752 1.00 0.00 H new ATOM 0 HB3 GLU A 176 4.395 -0.132 5.476 1.00 0.00 H new ATOM 0 HG2 GLU A 176 6.275 1.858 6.780 1.00 0.00 H new ATOM 0 HG3 GLU A 176 4.543 1.894 7.044 1.00 0.00 H new ATOM 1535 N PHE A 177 5.385 -0.829 2.772 1.00 0.00 N ATOM 1536 CA PHE A 177 4.980 -1.876 1.841 1.00 0.00 C ATOM 1537 C PHE A 177 6.189 -2.455 1.114 1.00 0.00 C ATOM 1538 O PHE A 177 6.299 -3.669 0.952 1.00 0.00 O ATOM 1539 CB PHE A 177 3.960 -1.335 0.833 1.00 0.00 C ATOM 1540 CG PHE A 177 3.675 -2.272 -0.307 1.00 0.00 C ATOM 1541 CD1 PHE A 177 4.540 -2.349 -1.387 1.00 0.00 C ATOM 1542 CD2 PHE A 177 2.545 -3.073 -0.298 1.00 0.00 C ATOM 1543 CE1 PHE A 177 4.283 -3.209 -2.437 1.00 0.00 C ATOM 1544 CE2 PHE A 177 2.283 -3.935 -1.346 1.00 0.00 C ATOM 1545 CZ PHE A 177 3.153 -4.002 -2.417 1.00 0.00 C ATOM 0 H PHE A 177 5.115 0.115 2.494 1.00 0.00 H new ATOM 0 HA PHE A 177 4.511 -2.676 2.415 1.00 0.00 H new ATOM 0 HB2 PHE A 177 3.028 -1.119 1.355 1.00 0.00 H new ATOM 0 HB3 PHE A 177 4.327 -0.390 0.431 1.00 0.00 H new ATOM 0 HD1 PHE A 177 5.425 -1.730 -1.408 1.00 0.00 H new ATOM 0 HD2 PHE A 177 1.862 -3.023 0.537 1.00 0.00 H new ATOM 0 HE1 PHE A 177 4.965 -3.261 -3.273 1.00 0.00 H new ATOM 0 HE2 PHE A 177 1.399 -4.555 -1.328 1.00 0.00 H new ATOM 0 HZ PHE A 177 2.949 -4.674 -3.238 1.00 0.00 H new ATOM 1555 N LEU A 178 7.096 -1.586 0.679 1.00 0.00 N ATOM 1556 CA LEU A 178 8.291 -2.034 -0.025 1.00 0.00 C ATOM 1557 C LEU A 178 9.115 -2.967 0.856 1.00 0.00 C ATOM 1558 O LEU A 178 9.618 -3.990 0.394 1.00 0.00 O ATOM 1559 CB LEU A 178 9.135 -0.835 -0.462 1.00 0.00 C ATOM 1560 CG LEU A 178 8.568 -0.039 -1.640 1.00 0.00 C ATOM 1561 CD1 LEU A 178 9.561 1.018 -2.097 1.00 0.00 C ATOM 1562 CD2 LEU A 178 8.209 -0.968 -2.791 1.00 0.00 C ATOM 0 H LEU A 178 7.027 -0.576 0.800 1.00 0.00 H new ATOM 0 HA LEU A 178 7.979 -2.583 -0.913 1.00 0.00 H new ATOM 0 HB2 LEU A 178 9.252 -0.163 0.388 1.00 0.00 H new ATOM 0 HB3 LEU A 178 10.131 -1.189 -0.728 1.00 0.00 H new ATOM 0 HG LEU A 178 7.659 0.463 -1.309 1.00 0.00 H new ATOM 0 HD11 LEU A 178 9.141 1.574 -2.935 1.00 0.00 H new ATOM 0 HD12 LEU A 178 9.768 1.703 -1.275 1.00 0.00 H new ATOM 0 HD13 LEU A 178 10.487 0.536 -2.409 1.00 0.00 H new ATOM 0 HD21 LEU A 178 7.808 -0.383 -3.619 1.00 0.00 H new ATOM 0 HD22 LEU A 178 9.101 -1.500 -3.121 1.00 0.00 H new ATOM 0 HD23 LEU A 178 7.461 -1.687 -2.458 1.00 0.00 H new ATOM 1574 N GLU A 179 9.242 -2.610 2.130 1.00 0.00 N ATOM 1575 CA GLU A 179 9.998 -3.418 3.081 1.00 0.00 C ATOM 1576 C GLU A 179 9.289 -4.737 3.356 1.00 0.00 C ATOM 1577 O GLU A 179 9.929 -5.763 3.588 1.00 0.00 O ATOM 1578 CB GLU A 179 10.196 -2.655 4.391 1.00 0.00 C ATOM 1579 CG GLU A 179 11.220 -1.539 4.294 1.00 0.00 C ATOM 1580 CD GLU A 179 12.568 -1.932 4.867 1.00 0.00 C ATOM 1581 OE1 GLU A 179 13.185 -2.879 4.336 1.00 0.00 O ATOM 1582 OE2 GLU A 179 13.006 -1.291 5.845 1.00 0.00 O ATOM 0 H GLU A 179 8.831 -1.766 2.528 1.00 0.00 H new ATOM 0 HA GLU A 179 10.972 -3.631 2.641 1.00 0.00 H new ATOM 0 HB2 GLU A 179 9.241 -2.234 4.705 1.00 0.00 H new ATOM 0 HB3 GLU A 179 10.506 -3.355 5.167 1.00 0.00 H new ATOM 0 HG2 GLU A 179 11.343 -1.254 3.249 1.00 0.00 H new ATOM 0 HG3 GLU A 179 10.847 -0.662 4.822 1.00 0.00 H new ATOM 1589 N ASN A 180 7.964 -4.702 3.317 1.00 0.00 N ATOM 1590 CA ASN A 180 7.168 -5.899 3.553 1.00 0.00 C ATOM 1591 C ASN A 180 7.271 -6.852 2.365 1.00 0.00 C ATOM 1592 O ASN A 180 7.540 -8.041 2.531 1.00 0.00 O ATOM 1593 CB ASN A 180 5.709 -5.514 3.795 1.00 0.00 C ATOM 1594 CG ASN A 180 5.320 -5.613 5.257 1.00 0.00 C ATOM 1595 OD1 ASN A 180 4.588 -6.519 5.657 1.00 0.00 O ATOM 1596 ND2 ASN A 180 5.808 -4.679 6.064 1.00 0.00 N ATOM 0 H ASN A 180 7.419 -3.861 3.125 1.00 0.00 H new ATOM 0 HA ASN A 180 7.553 -6.407 4.437 1.00 0.00 H new ATOM 0 HB2 ASN A 180 5.542 -4.495 3.446 1.00 0.00 H new ATOM 0 HB3 ASN A 180 5.062 -6.163 3.205 1.00 0.00 H new ATOM 0 HD21 ASN A 180 5.580 -4.694 7.058 1.00 0.00 H new ATOM 0 HD22 ASN A 180 6.411 -3.946 5.690 1.00 0.00 H new ATOM 1603 N ALA A 181 7.059 -6.316 1.169 1.00 0.00 N ATOM 1604 CA ALA A 181 7.130 -7.111 -0.051 1.00 0.00 C ATOM 1605 C ALA A 181 8.529 -7.682 -0.251 1.00 0.00 C ATOM 1606 O ALA A 181 8.690 -8.816 -0.700 1.00 0.00 O ATOM 1607 CB ALA A 181 6.722 -6.272 -1.253 1.00 0.00 C ATOM 0 H ALA A 181 6.836 -5.332 1.018 1.00 0.00 H new ATOM 0 HA ALA A 181 6.435 -7.945 0.046 1.00 0.00 H new ATOM 0 HB1 ALA A 181 6.780 -6.879 -2.157 1.00 0.00 H new ATOM 0 HB2 ALA A 181 5.700 -5.917 -1.119 1.00 0.00 H new ATOM 0 HB3 ALA A 181 7.393 -5.418 -1.346 1.00 0.00 H new ATOM 1613 N LYS A 182 9.540 -6.888 0.090 1.00 0.00 N ATOM 1614 CA LYS A 182 10.927 -7.318 -0.049 1.00 0.00 C ATOM 1615 C LYS A 182 11.255 -8.415 0.958 1.00 0.00 C ATOM 1616 O LYS A 182 12.023 -9.331 0.665 1.00 0.00 O ATOM 1617 CB LYS A 182 11.877 -6.134 0.140 1.00 0.00 C ATOM 1618 CG LYS A 182 13.155 -6.244 -0.675 1.00 0.00 C ATOM 1619 CD LYS A 182 14.320 -5.555 0.018 1.00 0.00 C ATOM 1620 CE LYS A 182 15.207 -4.825 -0.977 1.00 0.00 C ATOM 1621 NZ LYS A 182 16.602 -4.682 -0.476 1.00 0.00 N ATOM 0 H LYS A 182 9.425 -5.946 0.464 1.00 0.00 H new ATOM 0 HA LYS A 182 11.058 -7.718 -1.055 1.00 0.00 H new ATOM 0 HB2 LYS A 182 11.359 -5.215 -0.135 1.00 0.00 H new ATOM 0 HB3 LYS A 182 12.135 -6.051 1.196 1.00 0.00 H new ATOM 0 HG2 LYS A 182 13.396 -7.295 -0.835 1.00 0.00 H new ATOM 0 HG3 LYS A 182 13.000 -5.799 -1.658 1.00 0.00 H new ATOM 0 HD2 LYS A 182 13.940 -4.848 0.755 1.00 0.00 H new ATOM 0 HD3 LYS A 182 14.911 -6.294 0.560 1.00 0.00 H new ATOM 0 HE2 LYS A 182 15.215 -5.367 -1.923 1.00 0.00 H new ATOM 0 HE3 LYS A 182 14.791 -3.838 -1.179 1.00 0.00 H new ATOM 0 HZ1 LYS A 182 17.175 -4.179 -1.183 1.00 0.00 H new ATOM 0 HZ2 LYS A 182 16.598 -4.143 0.413 1.00 0.00 H new ATOM 0 HZ3 LYS A 182 17.009 -5.624 -0.308 1.00 0.00 H new ATOM 1635 N LYS A 183 10.660 -8.321 2.144 1.00 0.00 N ATOM 1636 CA LYS A 183 10.882 -9.312 3.191 1.00 0.00 C ATOM 1637 C LYS A 183 10.375 -10.685 2.759 1.00 0.00 C ATOM 1638 O LYS A 183 10.747 -11.705 3.339 1.00 0.00 O ATOM 1639 CB LYS A 183 10.175 -8.886 4.480 1.00 0.00 C ATOM 1640 CG LYS A 183 11.036 -9.035 5.724 1.00 0.00 C ATOM 1641 CD LYS A 183 11.500 -7.685 6.249 1.00 0.00 C ATOM 1642 CE LYS A 183 10.652 -7.222 7.423 1.00 0.00 C ATOM 1643 NZ LYS A 183 10.480 -5.743 7.436 1.00 0.00 N ATOM 0 H LYS A 183 10.021 -7.569 2.403 1.00 0.00 H new ATOM 0 HA LYS A 183 11.955 -9.378 3.371 1.00 0.00 H new ATOM 0 HB2 LYS A 183 9.863 -7.846 4.387 1.00 0.00 H new ATOM 0 HB3 LYS A 183 9.270 -9.481 4.602 1.00 0.00 H new ATOM 0 HG2 LYS A 183 10.470 -9.552 6.499 1.00 0.00 H new ATOM 0 HG3 LYS A 183 11.903 -9.655 5.495 1.00 0.00 H new ATOM 0 HD2 LYS A 183 12.543 -7.752 6.557 1.00 0.00 H new ATOM 0 HD3 LYS A 183 11.451 -6.946 5.449 1.00 0.00 H new ATOM 0 HE2 LYS A 183 9.674 -7.701 7.375 1.00 0.00 H new ATOM 0 HE3 LYS A 183 11.118 -7.541 8.355 1.00 0.00 H new ATOM 0 HZ1 LYS A 183 9.896 -5.469 8.252 1.00 0.00 H new ATOM 0 HZ2 LYS A 183 11.411 -5.286 7.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 183 10.012 -5.440 6.558 1.00 0.00 H new ATOM 1657 N LEU A 184 9.517 -10.702 1.745 1.00 0.00 N ATOM 1658 CA LEU A 184 8.951 -11.945 1.243 1.00 0.00 C ATOM 1659 C LEU A 184 9.587 -12.357 -0.083 1.00 0.00 C ATOM 1660 O LEU A 184 9.477 -13.510 -0.500 1.00 0.00 O ATOM 1661 CB LEU A 184 7.446 -11.795 1.082 1.00 0.00 C ATOM 1662 CG LEU A 184 6.683 -11.778 2.404 1.00 0.00 C ATOM 1663 CD1 LEU A 184 6.138 -10.391 2.693 1.00 0.00 C ATOM 1664 CD2 LEU A 184 5.570 -12.807 2.388 1.00 0.00 C ATOM 0 H LEU A 184 9.199 -9.866 1.255 1.00 0.00 H new ATOM 0 HA LEU A 184 9.163 -12.731 1.967 1.00 0.00 H new ATOM 0 HB2 LEU A 184 7.238 -10.872 0.542 1.00 0.00 H new ATOM 0 HB3 LEU A 184 7.072 -12.615 0.468 1.00 0.00 H new ATOM 0 HG LEU A 184 7.375 -12.039 3.204 1.00 0.00 H new ATOM 0 HD11 LEU A 184 5.598 -10.402 3.640 1.00 0.00 H new ATOM 0 HD12 LEU A 184 6.963 -9.681 2.754 1.00 0.00 H new ATOM 0 HD13 LEU A 184 5.461 -10.092 1.893 1.00 0.00 H new ATOM 0 HD21 LEU A 184 5.037 -12.781 3.338 1.00 0.00 H new ATOM 0 HD22 LEU A 184 4.878 -12.581 1.577 1.00 0.00 H new ATOM 0 HD23 LEU A 184 5.994 -13.800 2.237 1.00 0.00 H new ATOM 1676 N SER A 185 10.251 -11.410 -0.741 1.00 0.00 N ATOM 1677 CA SER A 185 10.903 -11.680 -2.018 1.00 0.00 C ATOM 1678 C SER A 185 9.875 -12.031 -3.089 1.00 0.00 C ATOM 1679 O SER A 185 10.106 -12.908 -3.922 1.00 0.00 O ATOM 1680 CB SER A 185 11.916 -12.818 -1.870 1.00 0.00 C ATOM 1681 OG SER A 185 13.125 -12.515 -2.545 1.00 0.00 O ATOM 0 H SER A 185 10.351 -10.450 -0.411 1.00 0.00 H new ATOM 0 HA SER A 185 11.429 -10.777 -2.327 1.00 0.00 H new ATOM 0 HB2 SER A 185 12.120 -12.993 -0.814 1.00 0.00 H new ATOM 0 HB3 SER A 185 11.493 -13.740 -2.270 1.00 0.00 H new ATOM 0 HG SER A 185 13.756 -13.256 -2.434 1.00 0.00 H new ATOM 1687 N MET A 186 8.740 -11.341 -3.062 1.00 0.00 N ATOM 1688 CA MET A 186 7.678 -11.579 -4.032 1.00 0.00 C ATOM 1689 C MET A 186 7.782 -10.617 -5.214 1.00 0.00 C ATOM 1690 O MET A 186 6.821 -10.436 -5.962 1.00 0.00 O ATOM 1691 CB MET A 186 6.308 -11.438 -3.364 1.00 0.00 C ATOM 1692 CG MET A 186 6.013 -10.030 -2.872 1.00 0.00 C ATOM 1693 SD MET A 186 4.770 -9.998 -1.566 1.00 0.00 S ATOM 1694 CE MET A 186 3.267 -10.170 -2.525 1.00 0.00 C ATOM 0 H MET A 186 8.532 -10.613 -2.379 1.00 0.00 H new ATOM 0 HA MET A 186 7.791 -12.596 -4.409 1.00 0.00 H new ATOM 0 HB2 MET A 186 5.535 -11.736 -4.073 1.00 0.00 H new ATOM 0 HB3 MET A 186 6.251 -12.128 -2.522 1.00 0.00 H new ATOM 0 HG2 MET A 186 6.934 -9.578 -2.503 1.00 0.00 H new ATOM 0 HG3 MET A 186 5.671 -9.421 -3.709 1.00 0.00 H new ATOM 0 HE1 MET A 186 2.495 -10.635 -1.912 1.00 0.00 H new ATOM 0 HE2 MET A 186 2.928 -9.186 -2.850 1.00 0.00 H new ATOM 0 HE3 MET A 186 3.462 -10.793 -3.398 1.00 0.00 H new ATOM 1704 N TYR A 187 8.951 -10.003 -5.379 1.00 0.00 N ATOM 1705 CA TYR A 187 9.170 -9.063 -6.473 1.00 0.00 C ATOM 1706 C TYR A 187 9.237 -9.792 -7.811 1.00 0.00 C ATOM 1707 O TYR A 187 10.059 -10.723 -7.936 1.00 0.00 O ATOM 1708 CB TYR A 187 10.460 -8.274 -6.244 1.00 0.00 C ATOM 1709 CG TYR A 187 10.286 -7.084 -5.328 1.00 0.00 C ATOM 1710 CD1 TYR A 187 9.838 -7.247 -4.024 1.00 0.00 C ATOM 1711 CD2 TYR A 187 10.568 -5.797 -5.769 1.00 0.00 C ATOM 1712 CE1 TYR A 187 9.676 -6.162 -3.184 1.00 0.00 C ATOM 1713 CE2 TYR A 187 10.409 -4.707 -4.935 1.00 0.00 C ATOM 1714 CZ TYR A 187 9.963 -4.895 -3.644 1.00 0.00 C ATOM 1715 OH TYR A 187 9.805 -3.812 -2.811 1.00 0.00 O ATOM 1716 OXT TYR A 187 8.466 -9.425 -8.722 1.00 0.00 O ATOM 0 H TYR A 187 9.758 -10.139 -4.771 1.00 0.00 H new ATOM 0 HA TYR A 187 8.328 -8.371 -6.498 1.00 0.00 H new ATOM 0 HB2 TYR A 187 11.213 -8.940 -5.822 1.00 0.00 H new ATOM 0 HB3 TYR A 187 10.841 -7.930 -7.205 1.00 0.00 H new ATOM 0 HD1 TYR A 187 9.612 -8.239 -3.660 1.00 0.00 H new ATOM 0 HD2 TYR A 187 10.917 -5.646 -6.780 1.00 0.00 H new ATOM 0 HE1 TYR A 187 9.326 -6.306 -2.172 1.00 0.00 H new ATOM 0 HE2 TYR A 187 10.633 -3.713 -5.293 1.00 0.00 H new ATOM 0 HH TYR A 187 9.758 -4.118 -1.881 1.00 0.00 H new