USER MOD reduce.3.24.130724 H: found=0, std=0, add=668, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 669 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 21 CYS SG : rot -100:sc= 0.968 USER MOD Set 1.2: A 51 TYR OH : rot 33:sc= 1.45 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 TYR OH : rot -70:sc= -0.111 USER MOD Single : A 29 HIS : no HD1:sc= -0.226 X(o=-0.23,f=-0.42) USER MOD Single : A 30 SER OG : rot 180:sc= 0.0172 USER MOD Single : A 35 GLN : amide:sc= 0.0259 K(o=0.026,f=-1.4) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 39 ASN : amide:sc= -1.09 K(o=-1.1,f=-3.9!) USER MOD Single : A 41 GLN : amide:sc= -0.0178 K(o=-0.018,f=-0.89) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 HIS : no HD1:sc= -0.417 X(o=-0.42,f=-0.062) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 ASN : amide:sc= -0.25 K(o=-0.25,f=-2.6!) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 ASN : amide:sc= -0.14 K(o=-0.14,f=-1.2) USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 HIS :FLIP no HD1:sc= -0.207 F(o=-0.89,f=-0.21) USER MOD Single : A 108 ASN : amide:sc= -0.248 K(o=-0.25,f=-1.9!) USER MOD Single : A 109 HIS :FLIP no HD1:sc= -1.23 F(o=-3.4!,f=-1.2) USER MOD Single : A 111 GLN :FLIP amide:sc= -2.59! C(o=-3.4!,f=-2.6!) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 TYR OH : rot 180:sc= 0 USER MOD Single : A 117 MET CE :methyl -108:sc= -0.929 (180deg=-2.39!) USER MOD Single : A 120 THR OG1 : rot 180:sc= -0.179 USER MOD Single : A 121 THR OG1 : rot 180:sc= -0.0109 USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 140 N VAL A 13 -59.299 -3.857 6.449 1.00 0.00 N ATOM 141 CA VAL A 13 -59.191 -2.435 6.727 1.00 0.00 C ATOM 142 C VAL A 13 -59.737 -2.151 8.128 1.00 0.00 C ATOM 143 O VAL A 13 -60.693 -2.788 8.566 1.00 0.00 O ATOM 144 CB VAL A 13 -59.902 -1.633 5.635 1.00 0.00 C ATOM 145 CG1 VAL A 13 -60.222 -0.216 6.115 1.00 0.00 C ATOM 146 CG2 VAL A 13 -59.073 -1.602 4.349 1.00 0.00 C ATOM 0 HA VAL A 13 -58.147 -2.122 6.715 1.00 0.00 H new ATOM 0 HB VAL A 13 -60.845 -2.133 5.414 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -60.727 0.332 5.320 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -60.870 -0.266 6.990 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -59.297 0.297 6.378 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -59.601 -1.026 3.589 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -58.107 -1.138 4.550 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -58.919 -2.620 3.991 1.00 0.00 H new ATOM 156 N GLU A 14 -59.105 -1.194 8.791 1.00 0.00 N ATOM 157 CA GLU A 14 -59.515 -0.817 10.133 1.00 0.00 C ATOM 158 C GLU A 14 -59.865 0.671 10.184 1.00 0.00 C ATOM 159 O GLU A 14 -59.148 1.500 9.626 1.00 0.00 O ATOM 160 CB GLU A 14 -58.428 -1.160 11.155 1.00 0.00 C ATOM 161 CG GLU A 14 -58.093 -2.652 11.119 1.00 0.00 C ATOM 162 CD GLU A 14 -56.602 -2.873 10.855 1.00 0.00 C ATOM 163 OE1 GLU A 14 -55.814 -2.004 11.286 1.00 0.00 O ATOM 164 OE2 GLU A 14 -56.283 -3.906 10.227 1.00 0.00 O ATOM 0 H GLU A 14 -58.312 -0.668 8.424 1.00 0.00 H new ATOM 0 HA GLU A 14 -60.406 -1.388 10.393 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -57.531 -0.577 10.947 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -58.763 -0.883 12.155 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -58.371 -3.114 12.067 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -58.680 -3.142 10.342 1.00 0.00 H new ATOM 171 N ILE A 15 -60.967 0.964 10.858 1.00 0.00 N ATOM 172 CA ILE A 15 -61.421 2.338 10.989 1.00 0.00 C ATOM 173 C ILE A 15 -60.673 3.011 12.141 1.00 0.00 C ATOM 174 O ILE A 15 -60.157 2.335 13.030 1.00 0.00 O ATOM 175 CB ILE A 15 -62.944 2.388 11.133 1.00 0.00 C ATOM 176 CG1 ILE A 15 -63.617 1.393 10.186 1.00 0.00 C ATOM 177 CG2 ILE A 15 -63.467 3.812 10.933 1.00 0.00 C ATOM 178 CD1 ILE A 15 -63.250 1.686 8.730 1.00 0.00 C ATOM 0 H ILE A 15 -61.559 0.273 11.319 1.00 0.00 H new ATOM 0 HA ILE A 15 -61.190 2.902 10.086 1.00 0.00 H new ATOM 0 HB ILE A 15 -63.201 2.090 12.149 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -63.314 0.378 10.444 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -64.699 1.443 10.309 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -64.552 3.820 11.040 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -63.024 4.471 11.680 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -63.199 4.161 9.936 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -63.742 0.964 8.078 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -63.576 2.692 8.468 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -62.170 1.611 8.605 1.00 0.00 H new ATOM 190 N GLY A 16 -60.636 4.334 12.088 1.00 0.00 N ATOM 191 CA GLY A 16 -59.958 5.106 13.116 1.00 0.00 C ATOM 192 C GLY A 16 -58.486 5.320 12.760 1.00 0.00 C ATOM 193 O GLY A 16 -57.893 6.331 13.136 1.00 0.00 O ATOM 0 H GLY A 16 -61.065 4.891 11.349 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -60.451 6.071 13.236 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -60.033 4.589 14.073 1.00 0.00 H new ATOM 197 N GLU A 17 -57.938 4.354 12.039 1.00 0.00 N ATOM 198 CA GLU A 17 -56.546 4.424 11.627 1.00 0.00 C ATOM 199 C GLU A 17 -56.423 5.163 10.293 1.00 0.00 C ATOM 200 O GLU A 17 -57.411 5.335 9.582 1.00 0.00 O ATOM 201 CB GLU A 17 -55.929 3.027 11.539 1.00 0.00 C ATOM 202 CG GLU A 17 -55.473 2.540 12.916 1.00 0.00 C ATOM 203 CD GLU A 17 -56.228 1.275 13.328 1.00 0.00 C ATOM 204 OE1 GLU A 17 -57.470 1.283 13.186 1.00 0.00 O ATOM 205 OE2 GLU A 17 -55.546 0.327 13.775 1.00 0.00 O ATOM 0 H GLU A 17 -58.433 3.518 11.729 1.00 0.00 H new ATOM 0 HA GLU A 17 -55.992 4.983 12.382 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -56.657 2.329 11.126 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -55.080 3.043 10.856 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -54.402 2.339 12.898 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -55.638 3.323 13.656 1.00 0.00 H new ATOM 212 N THR A 18 -55.202 5.581 9.995 1.00 0.00 N ATOM 213 CA THR A 18 -54.937 6.297 8.759 1.00 0.00 C ATOM 214 C THR A 18 -54.194 5.398 7.769 1.00 0.00 C ATOM 215 O THR A 18 -53.310 4.637 8.160 1.00 0.00 O ATOM 216 CB THR A 18 -54.174 7.577 9.108 1.00 0.00 C ATOM 217 OG1 THR A 18 -55.094 8.326 9.897 1.00 0.00 O ATOM 218 CG2 THR A 18 -53.924 8.462 7.886 1.00 0.00 C ATOM 0 H THR A 18 -54.385 5.438 10.588 1.00 0.00 H new ATOM 0 HA THR A 18 -55.864 6.579 8.260 1.00 0.00 H new ATOM 0 HB THR A 18 -53.221 7.316 9.568 1.00 0.00 H new ATOM 0 HG1 THR A 18 -54.680 9.172 10.168 1.00 0.00 H new ATOM 0 HG21 THR A 18 -53.380 9.356 8.190 1.00 0.00 H new ATOM 0 HG22 THR A 18 -53.336 7.911 7.152 1.00 0.00 H new ATOM 0 HG23 THR A 18 -54.878 8.750 7.444 1.00 0.00 H new ATOM 226 N TYR A 19 -54.581 5.514 6.508 1.00 0.00 N ATOM 227 CA TYR A 19 -53.962 4.721 5.459 1.00 0.00 C ATOM 228 C TYR A 19 -53.560 5.599 4.272 1.00 0.00 C ATOM 229 O TYR A 19 -54.087 6.697 4.101 1.00 0.00 O ATOM 230 CB TYR A 19 -55.028 3.723 5.002 1.00 0.00 C ATOM 231 CG TYR A 19 -55.421 2.700 6.069 1.00 0.00 C ATOM 232 CD1 TYR A 19 -56.025 3.119 7.237 1.00 0.00 C ATOM 233 CD2 TYR A 19 -55.171 1.358 5.864 1.00 0.00 C ATOM 234 CE1 TYR A 19 -56.395 2.156 8.242 1.00 0.00 C ATOM 235 CE2 TYR A 19 -55.541 0.395 6.869 1.00 0.00 C ATOM 236 CZ TYR A 19 -56.135 0.842 8.008 1.00 0.00 C ATOM 237 OH TYR A 19 -56.484 -0.068 8.957 1.00 0.00 O ATOM 0 H TYR A 19 -55.316 6.145 6.188 1.00 0.00 H new ATOM 0 HA TYR A 19 -53.061 4.231 5.829 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -55.918 4.273 4.695 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -54.662 3.193 4.123 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -56.220 4.169 7.397 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -54.698 1.030 4.950 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -56.868 2.470 9.161 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -55.351 -0.658 6.722 1.00 0.00 H new ATOM 0 HH TYR A 19 -55.900 0.033 9.738 1.00 0.00 H new ATOM 247 N LEU A 20 -52.630 5.082 3.483 1.00 0.00 N ATOM 248 CA LEU A 20 -52.151 5.805 2.317 1.00 0.00 C ATOM 249 C LEU A 20 -53.095 5.549 1.141 1.00 0.00 C ATOM 250 O LEU A 20 -53.169 4.432 0.631 1.00 0.00 O ATOM 251 CB LEU A 20 -50.693 5.445 2.025 1.00 0.00 C ATOM 252 CG LEU A 20 -49.709 5.641 3.180 1.00 0.00 C ATOM 253 CD1 LEU A 20 -49.676 7.103 3.630 1.00 0.00 C ATOM 254 CD2 LEU A 20 -50.028 4.693 4.338 1.00 0.00 C ATOM 0 H LEU A 20 -52.195 4.171 3.628 1.00 0.00 H new ATOM 0 HA LEU A 20 -52.158 6.879 2.505 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -50.653 4.401 1.713 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -50.354 6.044 1.180 1.00 0.00 H new ATOM 0 HG LEU A 20 -48.710 5.391 2.824 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -48.969 7.215 4.452 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -49.366 7.733 2.796 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -50.669 7.404 3.963 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -49.314 4.852 5.146 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -51.037 4.889 4.701 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -49.961 3.661 3.993 1.00 0.00 H new ATOM 266 N CYS A 21 -53.793 6.603 0.744 1.00 0.00 N ATOM 267 CA CYS A 21 -54.730 6.507 -0.363 1.00 0.00 C ATOM 268 C CYS A 21 -54.019 6.972 -1.636 1.00 0.00 C ATOM 269 O CYS A 21 -53.614 8.129 -1.737 1.00 0.00 O ATOM 270 CB CYS A 21 -56.005 7.308 -0.097 1.00 0.00 C ATOM 271 SG CYS A 21 -57.000 7.429 -1.628 1.00 0.00 S ATOM 0 H CYS A 21 -53.729 7.528 1.169 1.00 0.00 H new ATOM 0 HA CYS A 21 -55.049 5.472 -0.483 1.00 0.00 H new ATOM 0 HB2 CYS A 21 -56.589 6.828 0.689 1.00 0.00 H new ATOM 0 HB3 CYS A 21 -55.750 8.306 0.260 1.00 0.00 H new ATOM 0 HG CYS A 21 -56.806 8.589 -2.181 1.00 0.00 H new ATOM 277 N ARG A 22 -53.888 6.046 -2.575 1.00 0.00 N ATOM 278 CA ARG A 22 -53.233 6.347 -3.836 1.00 0.00 C ATOM 279 C ARG A 22 -53.967 7.478 -4.559 1.00 0.00 C ATOM 280 O ARG A 22 -55.115 7.315 -4.970 1.00 0.00 O ATOM 281 CB ARG A 22 -53.190 5.115 -4.742 1.00 0.00 C ATOM 282 CG ARG A 22 -51.912 5.097 -5.583 1.00 0.00 C ATOM 283 CD ARG A 22 -51.368 3.674 -5.722 1.00 0.00 C ATOM 284 NE ARG A 22 -50.980 3.415 -7.127 1.00 0.00 N ATOM 285 CZ ARG A 22 -51.847 3.113 -8.102 1.00 0.00 C ATOM 286 NH1 ARG A 22 -53.157 3.029 -7.832 1.00 0.00 N ATOM 287 NH2 ARG A 22 -51.405 2.894 -9.348 1.00 0.00 N ATOM 0 H ARG A 22 -54.224 5.087 -2.487 1.00 0.00 H new ATOM 0 HA ARG A 22 -52.212 6.656 -3.614 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -53.243 4.211 -4.135 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -54.061 5.111 -5.397 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -52.116 5.510 -6.571 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -51.159 5.735 -5.120 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -50.507 3.540 -5.068 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -52.124 2.955 -5.406 1.00 0.00 H new ATOM 0 HE ARG A 22 -49.990 3.470 -7.368 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -53.494 3.195 -6.884 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -53.817 2.799 -8.575 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -50.408 2.957 -9.554 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -52.066 2.664 -10.090 1.00 0.00 H new ATOM 376 N TRP A 28 -48.550 8.632 -3.111 1.00 0.00 N ATOM 377 CA TRP A 28 -49.451 8.185 -2.063 1.00 0.00 C ATOM 378 C TRP A 28 -49.713 9.367 -1.129 1.00 0.00 C ATOM 379 O TRP A 28 -48.837 10.204 -0.920 1.00 0.00 O ATOM 380 CB TRP A 28 -48.885 6.963 -1.337 1.00 0.00 C ATOM 381 CG TRP A 28 -48.831 5.698 -2.197 1.00 0.00 C ATOM 382 CD1 TRP A 28 -48.030 5.444 -3.241 1.00 0.00 C ATOM 383 CD2 TRP A 28 -49.646 4.518 -2.042 1.00 0.00 C ATOM 384 NE1 TRP A 28 -48.269 4.191 -3.768 1.00 0.00 N ATOM 385 CE2 TRP A 28 -49.283 3.610 -3.016 1.00 0.00 C ATOM 386 CE3 TRP A 28 -50.657 4.226 -1.109 1.00 0.00 C ATOM 387 CZ2 TRP A 28 -49.880 2.351 -3.151 1.00 0.00 C ATOM 388 CZ3 TRP A 28 -51.244 2.964 -1.258 1.00 0.00 C ATOM 389 CH2 TRP A 28 -50.890 2.039 -2.233 1.00 0.00 C ATOM 0 HA TRP A 28 -50.401 7.858 -2.485 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -47.879 7.195 -0.986 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -49.492 6.764 -0.454 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -47.291 6.133 -3.622 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -47.790 3.769 -4.563 1.00 0.00 H new ATOM 0 HE3 TRP A 28 -50.957 4.921 -0.338 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -49.578 1.658 -3.922 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 -52.027 2.690 -0.567 1.00 0.00 H new ATOM 0 HH2 TRP A 28 -51.392 1.084 -2.282 1.00 0.00 H new ATOM 400 N HIS A 29 -50.924 9.398 -0.591 1.00 0.00 N ATOM 401 CA HIS A 29 -51.312 10.464 0.317 1.00 0.00 C ATOM 402 C HIS A 29 -52.083 9.876 1.500 1.00 0.00 C ATOM 403 O HIS A 29 -52.992 9.068 1.313 1.00 0.00 O ATOM 404 CB HIS A 29 -52.099 11.548 -0.423 1.00 0.00 C ATOM 405 CG HIS A 29 -51.232 12.594 -1.082 1.00 0.00 C ATOM 406 ND1 HIS A 29 -50.097 13.113 -0.483 1.00 0.00 N ATOM 407 CD2 HIS A 29 -51.345 13.212 -2.292 1.00 0.00 C ATOM 408 CE1 HIS A 29 -49.559 14.002 -1.305 1.00 0.00 C ATOM 409 NE2 HIS A 29 -50.335 14.063 -2.426 1.00 0.00 N ATOM 0 H HIS A 29 -51.649 8.702 -0.767 1.00 0.00 H new ATOM 0 HA HIS A 29 -50.421 10.950 0.714 1.00 0.00 H new ATOM 0 HB2 HIS A 29 -52.722 11.076 -1.183 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -52.771 12.039 0.281 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -52.125 13.038 -3.019 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -48.664 14.577 -1.120 1.00 0.00 H new ATOM 0 HE2 HIS A 29 -50.167 14.663 -3.233 1.00 0.00 H new ATOM 417 N SER A 30 -51.692 10.303 2.692 1.00 0.00 N ATOM 418 CA SER A 30 -52.335 9.828 3.905 1.00 0.00 C ATOM 419 C SER A 30 -53.814 10.221 3.902 1.00 0.00 C ATOM 420 O SER A 30 -54.199 11.197 3.259 1.00 0.00 O ATOM 421 CB SER A 30 -51.641 10.384 5.150 1.00 0.00 C ATOM 422 OG SER A 30 -51.267 11.749 4.988 1.00 0.00 O ATOM 0 H SER A 30 -50.938 10.973 2.843 1.00 0.00 H new ATOM 0 HA SER A 30 -52.254 8.741 3.932 1.00 0.00 H new ATOM 0 HB2 SER A 30 -52.306 10.290 6.008 1.00 0.00 H new ATOM 0 HB3 SER A 30 -50.754 9.788 5.367 1.00 0.00 H new ATOM 0 HG SER A 30 -50.829 12.067 5.805 1.00 0.00 H new ATOM 428 N ALA A 31 -54.602 9.442 4.627 1.00 0.00 N ATOM 429 CA ALA A 31 -56.030 9.696 4.716 1.00 0.00 C ATOM 430 C ALA A 31 -56.630 8.829 5.824 1.00 0.00 C ATOM 431 O ALA A 31 -56.476 7.609 5.815 1.00 0.00 O ATOM 432 CB ALA A 31 -56.681 9.436 3.356 1.00 0.00 C ATOM 0 H ALA A 31 -54.279 8.634 5.159 1.00 0.00 H new ATOM 0 HA ALA A 31 -56.219 10.738 4.974 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -57.752 9.627 3.423 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -56.241 10.097 2.610 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -56.515 8.399 3.065 1.00 0.00 H new ATOM 438 N GLU A 32 -57.303 9.493 6.753 1.00 0.00 N ATOM 439 CA GLU A 32 -57.927 8.798 7.866 1.00 0.00 C ATOM 440 C GLU A 32 -59.206 8.098 7.404 1.00 0.00 C ATOM 441 O GLU A 32 -60.030 8.695 6.712 1.00 0.00 O ATOM 442 CB GLU A 32 -58.214 9.760 9.021 1.00 0.00 C ATOM 443 CG GLU A 32 -59.323 10.747 8.649 1.00 0.00 C ATOM 444 CD GLU A 32 -59.797 11.526 9.878 1.00 0.00 C ATOM 445 OE1 GLU A 32 -59.977 10.874 10.929 1.00 0.00 O ATOM 446 OE2 GLU A 32 -59.970 12.756 9.738 1.00 0.00 O ATOM 0 H GLU A 32 -57.430 10.505 6.757 1.00 0.00 H new ATOM 0 HA GLU A 32 -57.234 8.041 8.232 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -58.507 9.195 9.906 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -57.307 10.307 9.278 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -58.958 11.441 7.892 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -60.162 10.208 8.209 1.00 0.00 H new ATOM 453 N VAL A 33 -59.333 6.842 7.806 1.00 0.00 N ATOM 454 CA VAL A 33 -60.499 6.054 7.442 1.00 0.00 C ATOM 455 C VAL A 33 -61.643 6.367 8.409 1.00 0.00 C ATOM 456 O VAL A 33 -61.629 5.924 9.556 1.00 0.00 O ATOM 457 CB VAL A 33 -60.136 4.568 7.406 1.00 0.00 C ATOM 458 CG1 VAL A 33 -61.378 3.706 7.174 1.00 0.00 C ATOM 459 CG2 VAL A 33 -59.068 4.290 6.346 1.00 0.00 C ATOM 0 H VAL A 33 -58.648 6.350 8.380 1.00 0.00 H new ATOM 0 HA VAL A 33 -60.839 6.316 6.440 1.00 0.00 H new ATOM 0 HB VAL A 33 -59.720 4.301 8.377 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -61.092 2.654 7.153 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -62.092 3.872 7.981 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -61.836 3.977 6.223 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -58.828 3.227 6.341 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -59.444 4.582 5.365 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -58.170 4.863 6.575 1.00 0.00 H new ATOM 469 N ILE A 34 -62.606 7.128 7.909 1.00 0.00 N ATOM 470 CA ILE A 34 -63.755 7.505 8.715 1.00 0.00 C ATOM 471 C ILE A 34 -64.577 6.256 9.038 1.00 0.00 C ATOM 472 O ILE A 34 -64.784 5.929 10.206 1.00 0.00 O ATOM 473 CB ILE A 34 -64.558 8.606 8.020 1.00 0.00 C ATOM 474 CG1 ILE A 34 -63.645 9.751 7.574 1.00 0.00 C ATOM 475 CG2 ILE A 34 -65.700 9.098 8.912 1.00 0.00 C ATOM 476 CD1 ILE A 34 -63.619 10.870 8.618 1.00 0.00 C ATOM 0 H ILE A 34 -62.614 7.493 6.957 1.00 0.00 H new ATOM 0 HA ILE A 34 -63.431 7.929 9.665 1.00 0.00 H new ATOM 0 HB ILE A 34 -65.010 8.185 7.122 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -62.635 9.374 7.414 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -63.992 10.147 6.620 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -66.255 9.880 8.394 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -66.369 8.268 9.138 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -65.291 9.497 9.840 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -62.963 11.671 8.277 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -64.627 11.261 8.758 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -63.248 10.476 9.564 1.00 0.00 H new ATOM 488 N GLN A 35 -65.024 5.591 7.983 1.00 0.00 N ATOM 489 CA GLN A 35 -65.820 4.385 8.140 1.00 0.00 C ATOM 490 C GLN A 35 -65.739 3.527 6.876 1.00 0.00 C ATOM 491 O GLN A 35 -64.947 3.811 5.978 1.00 0.00 O ATOM 492 CB GLN A 35 -67.272 4.726 8.479 1.00 0.00 C ATOM 493 CG GLN A 35 -67.542 4.548 9.975 1.00 0.00 C ATOM 494 CD GLN A 35 -67.959 3.110 10.290 1.00 0.00 C ATOM 495 OE1 GLN A 35 -67.326 2.150 9.884 1.00 0.00 O ATOM 496 NE2 GLN A 35 -69.058 3.016 11.033 1.00 0.00 N ATOM 0 H GLN A 35 -64.850 5.864 7.016 1.00 0.00 H new ATOM 0 HA GLN A 35 -65.413 3.811 8.972 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -67.486 5.754 8.187 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -67.943 4.086 7.906 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -66.647 4.803 10.543 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -68.327 5.235 10.291 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -69.540 3.861 11.340 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -69.419 2.099 11.296 1.00 0.00 H new ATOM 505 N SER A 36 -66.569 2.495 6.845 1.00 0.00 N ATOM 506 CA SER A 36 -66.602 1.594 5.706 1.00 0.00 C ATOM 507 C SER A 36 -68.048 1.359 5.266 1.00 0.00 C ATOM 508 O SER A 36 -68.981 1.612 6.027 1.00 0.00 O ATOM 509 CB SER A 36 -65.924 0.263 6.036 1.00 0.00 C ATOM 510 OG SER A 36 -66.491 -0.353 7.189 1.00 0.00 O ATOM 0 H SER A 36 -67.224 2.263 7.591 1.00 0.00 H new ATOM 0 HA SER A 36 -66.051 2.058 4.888 1.00 0.00 H new ATOM 0 HB2 SER A 36 -66.014 -0.411 5.184 1.00 0.00 H new ATOM 0 HB3 SER A 36 -64.859 0.429 6.200 1.00 0.00 H new ATOM 0 HG SER A 36 -66.032 -1.201 7.366 1.00 0.00 H new ATOM 516 N ARG A 37 -68.189 0.876 4.040 1.00 0.00 N ATOM 517 CA ARG A 37 -69.506 0.604 3.490 1.00 0.00 C ATOM 518 C ARG A 37 -69.408 -0.428 2.364 1.00 0.00 C ATOM 519 O ARG A 37 -68.310 -0.800 1.953 1.00 0.00 O ATOM 520 CB ARG A 37 -70.152 1.880 2.948 1.00 0.00 C ATOM 521 CG ARG A 37 -69.319 2.476 1.810 1.00 0.00 C ATOM 522 CD ARG A 37 -70.077 3.604 1.108 1.00 0.00 C ATOM 523 NE ARG A 37 -69.797 3.574 -0.345 1.00 0.00 N ATOM 524 CZ ARG A 37 -70.585 4.133 -1.273 1.00 0.00 C ATOM 525 NH1 ARG A 37 -71.706 4.769 -0.906 1.00 0.00 N ATOM 526 NH2 ARG A 37 -70.252 4.057 -2.569 1.00 0.00 N ATOM 0 H ARG A 37 -67.413 0.666 3.412 1.00 0.00 H new ATOM 0 HA ARG A 37 -70.126 0.211 4.295 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -71.158 1.659 2.590 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -70.253 2.610 3.751 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -68.377 2.857 2.205 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -69.071 1.697 1.090 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -71.148 3.498 1.283 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -69.780 4.567 1.524 1.00 0.00 H new ATOM 0 HE ARG A 37 -68.951 3.098 -0.659 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -71.960 4.828 0.080 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -72.306 5.195 -1.613 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -69.399 3.573 -2.849 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -70.852 4.483 -3.276 1.00 0.00 H new ATOM 540 N VAL A 38 -70.570 -0.860 1.898 1.00 0.00 N ATOM 541 CA VAL A 38 -70.629 -1.841 0.827 1.00 0.00 C ATOM 542 C VAL A 38 -71.559 -1.331 -0.276 1.00 0.00 C ATOM 543 O VAL A 38 -72.584 -0.714 0.008 1.00 0.00 O ATOM 544 CB VAL A 38 -71.054 -3.200 1.386 1.00 0.00 C ATOM 545 CG1 VAL A 38 -71.709 -4.058 0.302 1.00 0.00 C ATOM 546 CG2 VAL A 38 -69.867 -3.928 2.019 1.00 0.00 C ATOM 0 H VAL A 38 -71.478 -0.549 2.242 1.00 0.00 H new ATOM 0 HA VAL A 38 -69.644 -1.981 0.382 1.00 0.00 H new ATOM 0 HB VAL A 38 -71.794 -3.024 2.167 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -72.002 -5.019 0.726 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -72.592 -3.547 -0.083 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -71.001 -4.221 -0.511 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -70.197 -4.891 2.409 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -69.094 -4.086 1.267 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -69.463 -3.326 2.833 1.00 0.00 H new ATOM 556 N ASN A 39 -71.167 -1.607 -1.511 1.00 0.00 N ATOM 557 CA ASN A 39 -71.952 -1.184 -2.657 1.00 0.00 C ATOM 558 C ASN A 39 -72.599 -2.409 -3.307 1.00 0.00 C ATOM 559 O ASN A 39 -71.908 -3.249 -3.883 1.00 0.00 O ATOM 560 CB ASN A 39 -71.072 -0.502 -3.707 1.00 0.00 C ATOM 561 CG ASN A 39 -71.310 1.009 -3.724 1.00 0.00 C ATOM 562 OD1 ASN A 39 -71.495 1.646 -2.700 1.00 0.00 O ATOM 563 ND2 ASN A 39 -71.296 1.545 -4.941 1.00 0.00 N ATOM 0 H ASN A 39 -70.316 -2.119 -1.743 1.00 0.00 H new ATOM 0 HA ASN A 39 -72.707 -0.480 -2.307 1.00 0.00 H new ATOM 0 HB2 ASN A 39 -70.022 -0.706 -3.495 1.00 0.00 H new ATOM 0 HB3 ASN A 39 -71.285 -0.918 -4.691 1.00 0.00 H new ATOM 0 HD21 ASN A 39 -71.446 2.547 -5.059 1.00 0.00 H new ATOM 0 HD22 ASN A 39 -71.135 0.954 -5.757 1.00 0.00 H new ATOM 570 N ASP A 40 -73.918 -2.473 -3.193 1.00 0.00 N ATOM 571 CA ASP A 40 -74.665 -3.581 -3.762 1.00 0.00 C ATOM 572 C ASP A 40 -74.741 -3.414 -5.281 1.00 0.00 C ATOM 573 O ASP A 40 -74.587 -4.382 -6.024 1.00 0.00 O ATOM 574 CB ASP A 40 -76.095 -3.618 -3.219 1.00 0.00 C ATOM 575 CG ASP A 40 -76.475 -4.905 -2.484 1.00 0.00 C ATOM 576 OD1 ASP A 40 -76.823 -5.878 -3.186 1.00 0.00 O ATOM 577 OD2 ASP A 40 -76.409 -4.886 -1.235 1.00 0.00 O ATOM 0 H ASP A 40 -74.488 -1.775 -2.715 1.00 0.00 H new ATOM 0 HA ASP A 40 -74.153 -4.505 -3.494 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -76.232 -2.776 -2.540 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -76.787 -3.474 -4.049 1.00 0.00 H new ATOM 582 N GLN A 41 -74.978 -2.178 -5.697 1.00 0.00 N ATOM 583 CA GLN A 41 -75.075 -1.871 -7.113 1.00 0.00 C ATOM 584 C GLN A 41 -73.822 -2.352 -7.848 1.00 0.00 C ATOM 585 O GLN A 41 -73.909 -3.175 -8.758 1.00 0.00 O ATOM 586 CB GLN A 41 -75.302 -0.375 -7.336 1.00 0.00 C ATOM 587 CG GLN A 41 -76.279 0.192 -6.304 1.00 0.00 C ATOM 588 CD GLN A 41 -76.951 1.463 -6.825 1.00 0.00 C ATOM 589 OE1 GLN A 41 -76.532 2.062 -7.802 1.00 0.00 O ATOM 590 NE2 GLN A 41 -78.016 1.839 -6.122 1.00 0.00 N ATOM 0 H GLN A 41 -75.106 -1.378 -5.077 1.00 0.00 H new ATOM 0 HA GLN A 41 -75.937 -2.400 -7.521 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -74.351 0.154 -7.271 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -75.691 -0.209 -8.340 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -77.038 -0.554 -6.068 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -75.748 0.411 -5.377 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -78.313 1.292 -5.314 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -78.535 2.675 -6.391 1.00 0.00 H new ATOM 599 N GLU A 42 -72.686 -1.818 -7.426 1.00 0.00 N ATOM 600 CA GLU A 42 -71.417 -2.181 -8.032 1.00 0.00 C ATOM 601 C GLU A 42 -70.952 -3.543 -7.513 1.00 0.00 C ATOM 602 O GLU A 42 -70.327 -4.310 -8.245 1.00 0.00 O ATOM 603 CB GLU A 42 -70.358 -1.107 -7.776 1.00 0.00 C ATOM 604 CG GLU A 42 -70.220 -0.175 -8.982 1.00 0.00 C ATOM 605 CD GLU A 42 -69.118 -0.660 -9.926 1.00 0.00 C ATOM 606 OE1 GLU A 42 -69.014 -1.895 -10.090 1.00 0.00 O ATOM 607 OE2 GLU A 42 -68.404 0.215 -10.462 1.00 0.00 O ATOM 0 H GLU A 42 -72.618 -1.136 -6.671 1.00 0.00 H new ATOM 0 HA GLU A 42 -71.560 -2.253 -9.110 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -70.628 -0.528 -6.893 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -69.399 -1.580 -7.566 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -71.168 -0.126 -9.518 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -69.994 0.835 -8.641 1.00 0.00 H new ATOM 614 N GLY A 43 -71.274 -3.803 -6.254 1.00 0.00 N ATOM 615 CA GLY A 43 -70.897 -5.059 -5.629 1.00 0.00 C ATOM 616 C GLY A 43 -69.430 -5.037 -5.194 1.00 0.00 C ATOM 617 O GLY A 43 -68.686 -5.980 -5.458 1.00 0.00 O ATOM 0 H GLY A 43 -71.792 -3.165 -5.650 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -71.534 -5.244 -4.764 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -71.061 -5.880 -6.327 1.00 0.00 H new ATOM 621 N ARG A 44 -69.058 -3.950 -4.535 1.00 0.00 N ATOM 622 CA ARG A 44 -67.694 -3.792 -4.061 1.00 0.00 C ATOM 623 C ARG A 44 -67.681 -3.073 -2.710 1.00 0.00 C ATOM 624 O ARG A 44 -68.697 -2.525 -2.285 1.00 0.00 O ATOM 625 CB ARG A 44 -66.851 -2.999 -5.061 1.00 0.00 C ATOM 626 CG ARG A 44 -66.720 -3.752 -6.386 1.00 0.00 C ATOM 627 CD ARG A 44 -65.580 -3.180 -7.232 1.00 0.00 C ATOM 628 NE ARG A 44 -66.018 -3.033 -8.638 1.00 0.00 N ATOM 629 CZ ARG A 44 -65.394 -2.267 -9.543 1.00 0.00 C ATOM 630 NH1 ARG A 44 -64.302 -1.573 -9.195 1.00 0.00 N ATOM 631 NH2 ARG A 44 -65.862 -2.194 -10.796 1.00 0.00 N ATOM 0 H ARG A 44 -69.678 -3.170 -4.318 1.00 0.00 H new ATOM 0 HA ARG A 44 -67.265 -4.788 -3.951 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -67.308 -2.025 -5.236 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -65.861 -2.816 -4.643 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -66.538 -4.809 -6.191 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -67.657 -3.687 -6.940 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -65.272 -2.213 -6.835 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -64.712 -3.837 -7.180 1.00 0.00 H new ATOM 0 HE ARG A 44 -66.847 -3.547 -8.937 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -63.946 -1.628 -8.241 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -63.827 -0.990 -9.884 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -66.694 -2.722 -11.061 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -65.387 -1.611 -11.485 1.00 0.00 H new ATOM 645 N GLU A 45 -66.519 -3.098 -2.074 1.00 0.00 N ATOM 646 CA GLU A 45 -66.361 -2.455 -0.780 1.00 0.00 C ATOM 647 C GLU A 45 -65.760 -1.058 -0.952 1.00 0.00 C ATOM 648 O GLU A 45 -65.092 -0.784 -1.948 1.00 0.00 O ATOM 649 CB GLU A 45 -65.504 -3.310 0.156 1.00 0.00 C ATOM 650 CG GLU A 45 -66.199 -4.633 0.479 1.00 0.00 C ATOM 651 CD GLU A 45 -65.256 -5.580 1.224 1.00 0.00 C ATOM 652 OE1 GLU A 45 -64.792 -5.178 2.314 1.00 0.00 O ATOM 653 OE2 GLU A 45 -65.019 -6.684 0.688 1.00 0.00 O ATOM 0 H GLU A 45 -65.678 -3.553 -2.430 1.00 0.00 H new ATOM 0 HA GLU A 45 -67.346 -2.352 -0.324 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -64.538 -3.507 -0.308 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -65.309 -2.763 1.078 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -67.085 -4.444 1.086 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -66.539 -5.104 -0.443 1.00 0.00 H new ATOM 660 N GLU A 46 -66.018 -0.212 0.035 1.00 0.00 N ATOM 661 CA GLU A 46 -65.511 1.149 0.005 1.00 0.00 C ATOM 662 C GLU A 46 -65.228 1.641 1.426 1.00 0.00 C ATOM 663 O GLU A 46 -65.782 1.115 2.391 1.00 0.00 O ATOM 664 CB GLU A 46 -66.487 2.082 -0.714 1.00 0.00 C ATOM 665 CG GLU A 46 -65.947 2.487 -2.087 1.00 0.00 C ATOM 666 CD GLU A 46 -66.693 1.759 -3.207 1.00 0.00 C ATOM 667 OE1 GLU A 46 -66.705 0.510 -3.162 1.00 0.00 O ATOM 668 OE2 GLU A 46 -67.235 2.468 -4.082 1.00 0.00 O ATOM 0 H GLU A 46 -66.571 -0.443 0.860 1.00 0.00 H new ATOM 0 HA GLU A 46 -64.575 1.155 -0.554 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -67.451 1.586 -0.830 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -66.657 2.973 -0.109 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -66.049 3.564 -2.218 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -64.883 2.258 -2.145 1.00 0.00 H new ATOM 675 N PHE A 47 -64.367 2.644 1.510 1.00 0.00 N ATOM 676 CA PHE A 47 -64.004 3.213 2.797 1.00 0.00 C ATOM 677 C PHE A 47 -63.857 4.733 2.703 1.00 0.00 C ATOM 678 O PHE A 47 -63.080 5.236 1.893 1.00 0.00 O ATOM 679 CB PHE A 47 -62.657 2.605 3.191 1.00 0.00 C ATOM 680 CG PHE A 47 -62.701 1.094 3.429 1.00 0.00 C ATOM 681 CD1 PHE A 47 -62.992 0.609 4.666 1.00 0.00 C ATOM 682 CD2 PHE A 47 -62.449 0.237 2.404 1.00 0.00 C ATOM 683 CE1 PHE A 47 -63.034 -0.793 4.887 1.00 0.00 C ATOM 684 CE2 PHE A 47 -62.490 -1.165 2.626 1.00 0.00 C ATOM 685 CZ PHE A 47 -62.782 -1.650 3.862 1.00 0.00 C ATOM 0 H PHE A 47 -63.910 3.078 0.708 1.00 0.00 H new ATOM 0 HA PHE A 47 -64.779 2.995 3.532 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -61.931 2.818 2.406 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -62.300 3.095 4.097 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -63.191 1.290 5.480 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -62.218 0.622 1.422 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -63.266 -1.178 5.869 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -62.289 -1.846 1.812 1.00 0.00 H new ATOM 0 HZ PHE A 47 -62.814 -2.716 4.030 1.00 0.00 H new ATOM 695 N TYR A 48 -64.616 5.422 3.543 1.00 0.00 N ATOM 696 CA TYR A 48 -64.579 6.874 3.565 1.00 0.00 C ATOM 697 C TYR A 48 -63.300 7.381 4.234 1.00 0.00 C ATOM 698 O TYR A 48 -63.244 7.511 5.456 1.00 0.00 O ATOM 699 CB TYR A 48 -65.785 7.314 4.398 1.00 0.00 C ATOM 700 CG TYR A 48 -66.259 8.739 4.103 1.00 0.00 C ATOM 701 CD1 TYR A 48 -66.429 9.153 2.798 1.00 0.00 C ATOM 702 CD2 TYR A 48 -66.515 9.609 5.143 1.00 0.00 C ATOM 703 CE1 TYR A 48 -66.875 10.494 2.521 1.00 0.00 C ATOM 704 CE2 TYR A 48 -66.961 10.950 4.866 1.00 0.00 C ATOM 705 CZ TYR A 48 -67.119 11.327 3.569 1.00 0.00 C ATOM 706 OH TYR A 48 -67.540 12.593 3.307 1.00 0.00 O ATOM 0 H TYR A 48 -65.260 5.001 4.213 1.00 0.00 H new ATOM 0 HA TYR A 48 -64.603 7.273 2.551 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -66.609 6.624 4.218 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -65.530 7.238 5.455 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -66.228 8.472 1.985 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -66.381 9.284 6.164 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -67.013 10.831 1.504 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -67.165 11.641 5.670 1.00 0.00 H new ATOM 0 HH TYR A 48 -67.676 13.074 4.150 1.00 0.00 H new ATOM 716 N VAL A 49 -62.304 7.653 3.404 1.00 0.00 N ATOM 717 CA VAL A 49 -61.029 8.143 3.900 1.00 0.00 C ATOM 718 C VAL A 49 -60.997 9.668 3.793 1.00 0.00 C ATOM 719 O VAL A 49 -61.452 10.234 2.800 1.00 0.00 O ATOM 720 CB VAL A 49 -59.881 7.466 3.149 1.00 0.00 C ATOM 721 CG1 VAL A 49 -60.042 5.944 3.156 1.00 0.00 C ATOM 722 CG2 VAL A 49 -59.772 7.999 1.719 1.00 0.00 C ATOM 0 H VAL A 49 -62.354 7.543 2.391 1.00 0.00 H new ATOM 0 HA VAL A 49 -60.905 7.889 4.953 1.00 0.00 H new ATOM 0 HB VAL A 49 -58.953 7.707 3.668 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -59.213 5.488 2.615 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -60.047 5.583 4.185 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -60.981 5.675 2.673 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -58.948 7.501 1.207 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -60.702 7.803 1.186 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -59.588 9.073 1.744 1.00 0.00 H new ATOM 732 N HIS A 50 -60.454 10.291 4.829 1.00 0.00 N ATOM 733 CA HIS A 50 -60.357 11.741 4.863 1.00 0.00 C ATOM 734 C HIS A 50 -58.893 12.160 4.708 1.00 0.00 C ATOM 735 O HIS A 50 -58.042 11.760 5.501 1.00 0.00 O ATOM 736 CB HIS A 50 -61.002 12.298 6.133 1.00 0.00 C ATOM 737 CG HIS A 50 -60.754 13.772 6.352 1.00 0.00 C ATOM 738 ND1 HIS A 50 -61.730 14.733 6.157 1.00 0.00 N ATOM 739 CD2 HIS A 50 -59.633 14.437 6.751 1.00 0.00 C ATOM 740 CE1 HIS A 50 -61.209 15.920 6.429 1.00 0.00 C ATOM 741 NE2 HIS A 50 -59.908 15.735 6.796 1.00 0.00 N ATOM 0 H HIS A 50 -60.077 9.819 5.651 1.00 0.00 H new ATOM 0 HA HIS A 50 -60.911 12.167 4.027 1.00 0.00 H new ATOM 0 HB2 HIS A 50 -62.077 12.123 6.089 1.00 0.00 H new ATOM 0 HB3 HIS A 50 -60.624 11.745 6.993 1.00 0.00 H new ATOM 0 HD2 HIS A 50 -58.682 13.984 6.990 1.00 0.00 H new ATOM 0 HE1 HIS A 50 -61.724 16.868 6.371 1.00 0.00 H new ATOM 0 HE2 HIS A 50 -59.255 16.472 7.061 1.00 0.00 H new ATOM 749 N TYR A 51 -58.646 12.961 3.682 1.00 0.00 N ATOM 750 CA TYR A 51 -57.301 13.439 3.413 1.00 0.00 C ATOM 751 C TYR A 51 -56.974 14.665 4.268 1.00 0.00 C ATOM 752 O TYR A 51 -57.275 15.794 3.883 1.00 0.00 O ATOM 753 CB TYR A 51 -57.284 13.843 1.937 1.00 0.00 C ATOM 754 CG TYR A 51 -57.742 12.736 0.985 1.00 0.00 C ATOM 755 CD1 TYR A 51 -56.843 11.785 0.548 1.00 0.00 C ATOM 756 CD2 TYR A 51 -59.055 12.690 0.562 1.00 0.00 C ATOM 757 CE1 TYR A 51 -57.274 10.744 -0.348 1.00 0.00 C ATOM 758 CE2 TYR A 51 -59.487 11.649 -0.335 1.00 0.00 C ATOM 759 CZ TYR A 51 -58.575 10.727 -0.745 1.00 0.00 C ATOM 760 OH TYR A 51 -58.982 9.744 -1.592 1.00 0.00 O ATOM 0 H TYR A 51 -59.355 13.291 3.027 1.00 0.00 H new ATOM 0 HA TYR A 51 -56.566 12.668 3.644 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -57.926 14.714 1.801 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -56.273 14.147 1.665 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -55.815 11.822 0.878 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -59.759 13.435 0.904 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -56.580 9.994 -0.697 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -60.511 11.602 -0.674 1.00 0.00 H new ATOM 0 HH TYR A 51 -58.483 8.922 -1.403 1.00 0.00 H new ATOM 770 N VAL A 52 -56.360 14.402 5.413 1.00 0.00 N ATOM 771 CA VAL A 52 -55.989 15.469 6.326 1.00 0.00 C ATOM 772 C VAL A 52 -55.247 16.561 5.552 1.00 0.00 C ATOM 773 O VAL A 52 -55.265 17.727 5.945 1.00 0.00 O ATOM 774 CB VAL A 52 -55.173 14.903 7.489 1.00 0.00 C ATOM 775 CG1 VAL A 52 -55.888 13.713 8.132 1.00 0.00 C ATOM 776 CG2 VAL A 52 -53.765 14.516 7.034 1.00 0.00 C ATOM 0 H VAL A 52 -56.110 13.465 5.729 1.00 0.00 H new ATOM 0 HA VAL A 52 -56.878 15.925 6.762 1.00 0.00 H new ATOM 0 HB VAL A 52 -55.078 15.684 8.243 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -55.287 13.329 8.956 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -56.859 14.033 8.510 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -56.028 12.928 7.389 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -53.206 14.116 7.880 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -53.830 13.759 6.252 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -53.254 15.396 6.645 1.00 0.00 H new ATOM 906 N GLU A 60 -64.201 11.396 0.473 1.00 0.00 N ATOM 907 CA GLU A 60 -64.785 10.445 -0.457 1.00 0.00 C ATOM 908 C GLU A 60 -64.364 9.019 -0.093 1.00 0.00 C ATOM 909 O GLU A 60 -63.405 8.822 0.651 1.00 0.00 O ATOM 910 CB GLU A 60 -64.398 10.779 -1.899 1.00 0.00 C ATOM 911 CG GLU A 60 -62.881 10.723 -2.087 1.00 0.00 C ATOM 912 CD GLU A 60 -62.485 11.172 -3.495 1.00 0.00 C ATOM 913 OE1 GLU A 60 -62.701 10.369 -4.428 1.00 0.00 O ATOM 914 OE2 GLU A 60 -61.977 12.309 -3.606 1.00 0.00 O ATOM 0 HA GLU A 60 -65.870 10.513 -0.382 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -64.878 10.077 -2.580 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -64.763 11.773 -2.156 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -62.396 11.361 -1.348 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -62.527 9.707 -1.913 1.00 0.00 H new ATOM 921 N TRP A 61 -65.103 8.062 -0.635 1.00 0.00 N ATOM 922 CA TRP A 61 -64.818 6.661 -0.377 1.00 0.00 C ATOM 923 C TRP A 61 -63.707 6.220 -1.333 1.00 0.00 C ATOM 924 O TRP A 61 -63.523 6.816 -2.393 1.00 0.00 O ATOM 925 CB TRP A 61 -66.085 5.812 -0.501 1.00 0.00 C ATOM 926 CG TRP A 61 -67.306 6.410 0.201 1.00 0.00 C ATOM 927 CD1 TRP A 61 -68.102 7.399 -0.228 1.00 0.00 C ATOM 928 CD2 TRP A 61 -67.841 6.014 1.482 1.00 0.00 C ATOM 929 NE1 TRP A 61 -69.106 7.669 0.679 1.00 0.00 N ATOM 930 CE2 TRP A 61 -68.943 6.800 1.751 1.00 0.00 C ATOM 931 CE3 TRP A 61 -67.408 5.025 2.382 1.00 0.00 C ATOM 932 CZ2 TRP A 61 -69.704 6.678 2.920 1.00 0.00 C ATOM 933 CZ3 TRP A 61 -68.179 4.916 3.546 1.00 0.00 C ATOM 934 CH2 TRP A 61 -69.291 5.699 3.832 1.00 0.00 C ATOM 0 H TRP A 61 -65.898 8.229 -1.251 1.00 0.00 H new ATOM 0 HA TRP A 61 -64.472 6.520 0.647 1.00 0.00 H new ATOM 0 HB2 TRP A 61 -66.317 5.676 -1.557 1.00 0.00 H new ATOM 0 HB3 TRP A 61 -65.889 4.823 -0.087 1.00 0.00 H new ATOM 0 HD1 TRP A 61 -67.974 7.919 -1.166 1.00 0.00 H new ATOM 0 HE1 TRP A 61 -69.834 8.377 0.581 1.00 0.00 H new ATOM 0 HE3 TRP A 61 -66.549 4.399 2.191 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 -70.563 7.305 3.108 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 -67.889 4.171 4.272 1.00 0.00 H new ATOM 0 HH2 TRP A 61 -69.834 5.553 4.754 1.00 0.00 H new ATOM 945 N VAL A 62 -62.997 5.179 -0.923 1.00 0.00 N ATOM 946 CA VAL A 62 -61.909 4.652 -1.730 1.00 0.00 C ATOM 947 C VAL A 62 -61.989 3.124 -1.749 1.00 0.00 C ATOM 948 O VAL A 62 -62.825 2.534 -1.067 1.00 0.00 O ATOM 949 CB VAL A 62 -60.569 5.175 -1.208 1.00 0.00 C ATOM 950 CG1 VAL A 62 -60.638 6.678 -0.932 1.00 0.00 C ATOM 951 CG2 VAL A 62 -60.130 4.407 0.040 1.00 0.00 C ATOM 0 H VAL A 62 -63.154 4.687 -0.044 1.00 0.00 H new ATOM 0 HA VAL A 62 -61.996 4.995 -2.761 1.00 0.00 H new ATOM 0 HB VAL A 62 -59.820 5.011 -1.982 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -59.673 7.025 -0.562 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -60.884 7.206 -1.853 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -61.406 6.876 -0.184 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -59.175 4.798 0.391 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -60.880 4.525 0.822 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -60.022 3.350 -0.203 1.00 0.00 H new ATOM 961 N ASP A 63 -61.106 2.527 -2.536 1.00 0.00 N ATOM 962 CA ASP A 63 -61.065 1.079 -2.652 1.00 0.00 C ATOM 963 C ASP A 63 -59.879 0.541 -1.851 1.00 0.00 C ATOM 964 O ASP A 63 -58.948 1.282 -1.538 1.00 0.00 O ATOM 965 CB ASP A 63 -60.887 0.648 -4.109 1.00 0.00 C ATOM 966 CG ASP A 63 -62.128 0.809 -4.988 1.00 0.00 C ATOM 967 OD1 ASP A 63 -63.018 1.585 -4.577 1.00 0.00 O ATOM 968 OD2 ASP A 63 -62.160 0.152 -6.051 1.00 0.00 O ATOM 0 H ASP A 63 -60.413 3.020 -3.100 1.00 0.00 H new ATOM 0 HA ASP A 63 -62.007 0.683 -2.272 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -60.073 1.227 -4.546 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -60.580 -0.398 -4.128 1.00 0.00 H new ATOM 973 N LYS A 64 -59.950 -0.746 -1.541 1.00 0.00 N ATOM 974 CA LYS A 64 -58.893 -1.392 -0.782 1.00 0.00 C ATOM 975 C LYS A 64 -57.580 -1.299 -1.562 1.00 0.00 C ATOM 976 O LYS A 64 -56.505 -1.218 -0.969 1.00 0.00 O ATOM 977 CB LYS A 64 -59.292 -2.824 -0.420 1.00 0.00 C ATOM 978 CG LYS A 64 -60.486 -2.835 0.537 1.00 0.00 C ATOM 979 CD LYS A 64 -60.587 -4.173 1.271 1.00 0.00 C ATOM 980 CE LYS A 64 -60.431 -3.983 2.781 1.00 0.00 C ATOM 981 NZ LYS A 64 -61.229 -4.989 3.516 1.00 0.00 N ATOM 0 H LYS A 64 -60.723 -1.358 -1.802 1.00 0.00 H new ATOM 0 HA LYS A 64 -58.738 -0.879 0.167 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -59.542 -3.376 -1.326 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -58.447 -3.335 0.041 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -60.384 -2.026 1.260 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -61.405 -2.651 -0.020 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -61.549 -4.638 1.057 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -59.817 -4.852 0.905 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -59.380 -4.071 3.058 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -60.752 -2.980 3.062 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -61.111 -4.845 4.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -62.233 -4.886 3.265 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -60.904 -5.944 3.261 1.00 0.00 H new ATOM 995 N ASN A 65 -57.710 -1.312 -2.881 1.00 0.00 N ATOM 996 CA ASN A 65 -56.547 -1.230 -3.749 1.00 0.00 C ATOM 997 C ASN A 65 -55.964 0.183 -3.680 1.00 0.00 C ATOM 998 O ASN A 65 -54.752 0.353 -3.564 1.00 0.00 O ATOM 999 CB ASN A 65 -56.924 -1.516 -5.204 1.00 0.00 C ATOM 1000 CG ASN A 65 -56.550 -2.946 -5.596 1.00 0.00 C ATOM 1001 OD1 ASN A 65 -55.726 -3.594 -4.971 1.00 0.00 O ATOM 1002 ND2 ASN A 65 -57.199 -3.401 -6.664 1.00 0.00 N ATOM 0 H ASN A 65 -58.603 -1.378 -3.370 1.00 0.00 H new ATOM 0 HA ASN A 65 -55.822 -1.971 -3.413 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -57.995 -1.365 -5.342 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -56.415 -0.810 -5.861 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -57.019 -4.345 -7.006 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -57.877 -2.806 -7.141 1.00 0.00 H new ATOM 1009 N ARG A 66 -56.856 1.161 -3.754 1.00 0.00 N ATOM 1010 CA ARG A 66 -56.445 2.553 -3.702 1.00 0.00 C ATOM 1011 C ARG A 66 -55.614 2.815 -2.444 1.00 0.00 C ATOM 1012 O ARG A 66 -54.755 3.695 -2.435 1.00 0.00 O ATOM 1013 CB ARG A 66 -57.658 3.486 -3.708 1.00 0.00 C ATOM 1014 CG ARG A 66 -58.020 3.906 -5.133 1.00 0.00 C ATOM 1015 CD ARG A 66 -58.905 5.154 -5.129 1.00 0.00 C ATOM 1016 NE ARG A 66 -59.369 5.450 -6.503 1.00 0.00 N ATOM 1017 CZ ARG A 66 -59.994 6.581 -6.858 1.00 0.00 C ATOM 1018 NH1 ARG A 66 -60.234 7.529 -5.942 1.00 0.00 N ATOM 1019 NH2 ARG A 66 -60.380 6.763 -8.128 1.00 0.00 N ATOM 0 H ARG A 66 -57.861 1.016 -3.850 1.00 0.00 H new ATOM 0 HA ARG A 66 -55.842 2.754 -4.588 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -58.509 2.985 -3.246 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -57.444 4.370 -3.108 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -57.110 4.103 -5.700 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -58.539 3.090 -5.636 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -59.761 5.000 -4.472 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -58.348 6.003 -4.733 1.00 0.00 H new ATOM 0 HE ARG A 66 -59.203 4.749 -7.225 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -59.941 7.390 -4.975 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -60.710 8.390 -6.212 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -60.198 6.041 -8.825 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -60.856 7.624 -8.398 1.00 0.00 H new ATOM 1033 N LEU A 67 -55.900 2.034 -1.412 1.00 0.00 N ATOM 1034 CA LEU A 67 -55.190 2.171 -0.152 1.00 0.00 C ATOM 1035 C LEU A 67 -53.967 1.251 -0.158 1.00 0.00 C ATOM 1036 O LEU A 67 -53.760 0.495 -1.105 1.00 0.00 O ATOM 1037 CB LEU A 67 -56.137 1.927 1.025 1.00 0.00 C ATOM 1038 CG LEU A 67 -57.422 2.757 1.034 1.00 0.00 C ATOM 1039 CD1 LEU A 67 -58.613 1.917 1.502 1.00 0.00 C ATOM 1040 CD2 LEU A 67 -57.251 4.025 1.872 1.00 0.00 C ATOM 0 H LEU A 67 -56.613 1.305 -1.423 1.00 0.00 H new ATOM 0 HA LEU A 67 -54.822 3.190 -0.030 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -56.409 0.872 1.034 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -55.594 2.124 1.949 1.00 0.00 H new ATOM 0 HG LEU A 67 -57.631 3.073 0.012 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -59.514 2.530 1.499 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -58.748 1.071 0.829 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -58.426 1.551 2.512 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -58.179 4.596 1.861 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -57.005 3.752 2.898 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -56.447 4.631 1.455 1.00 0.00 H new ATOM 1052 N ALA A 68 -53.190 1.346 0.911 1.00 0.00 N ATOM 1053 CA ALA A 68 -51.993 0.532 1.040 1.00 0.00 C ATOM 1054 C ALA A 68 -52.189 -0.478 2.173 1.00 0.00 C ATOM 1055 O ALA A 68 -52.132 -0.117 3.348 1.00 0.00 O ATOM 1056 CB ALA A 68 -50.782 1.437 1.270 1.00 0.00 C ATOM 0 H ALA A 68 -53.366 1.974 1.695 1.00 0.00 H new ATOM 0 HA ALA A 68 -51.810 -0.030 0.124 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -49.884 0.826 1.367 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -50.669 2.116 0.425 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -50.928 2.015 2.183 1.00 0.00 H new ATOM 1062 N LEU A 69 -52.415 -1.723 1.781 1.00 0.00 N ATOM 1063 CA LEU A 69 -52.619 -2.787 2.748 1.00 0.00 C ATOM 1064 C LEU A 69 -51.464 -3.786 2.653 1.00 0.00 C ATOM 1065 O LEU A 69 -51.477 -4.677 1.806 1.00 0.00 O ATOM 1066 CB LEU A 69 -53.999 -3.423 2.562 1.00 0.00 C ATOM 1067 CG LEU A 69 -55.150 -2.457 2.278 1.00 0.00 C ATOM 1068 CD1 LEU A 69 -56.274 -3.154 1.508 1.00 0.00 C ATOM 1069 CD2 LEU A 69 -55.655 -1.811 3.569 1.00 0.00 C ATOM 0 H LEU A 69 -52.461 -2.019 0.806 1.00 0.00 H new ATOM 0 HA LEU A 69 -52.612 -2.386 3.762 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -53.940 -4.138 1.741 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -54.240 -3.990 3.461 1.00 0.00 H new ATOM 0 HG LEU A 69 -54.774 -1.655 1.643 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -57.080 -2.445 1.319 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -55.888 -3.526 0.559 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -56.656 -3.988 2.097 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -56.473 -1.129 3.339 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -56.009 -2.586 4.249 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -54.843 -1.258 4.041 1.00 0.00 H new ATOM 1464 N ARG A 94 -58.762 -31.164 13.193 1.00 0.00 N ATOM 1465 CA ARG A 94 -58.858 -32.570 13.547 1.00 0.00 C ATOM 1466 C ARG A 94 -58.624 -33.445 12.314 1.00 0.00 C ATOM 1467 O ARG A 94 -58.881 -33.019 11.189 1.00 0.00 O ATOM 1468 CB ARG A 94 -60.229 -32.896 14.143 1.00 0.00 C ATOM 1469 CG ARG A 94 -60.116 -33.978 15.219 1.00 0.00 C ATOM 1470 CD ARG A 94 -59.836 -33.360 16.590 1.00 0.00 C ATOM 1471 NE ARG A 94 -59.976 -34.387 17.647 1.00 0.00 N ATOM 1472 CZ ARG A 94 -59.060 -35.330 17.904 1.00 0.00 C ATOM 1473 NH1 ARG A 94 -57.931 -35.381 17.184 1.00 0.00 N ATOM 1474 NH2 ARG A 94 -59.272 -36.221 18.882 1.00 0.00 N ATOM 0 HA ARG A 94 -58.092 -32.777 14.294 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -60.666 -31.995 14.573 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -60.902 -33.232 13.354 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -61.040 -34.555 15.258 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -59.317 -34.672 14.959 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -58.830 -32.940 16.610 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -60.528 -32.539 16.776 1.00 0.00 H new ATOM 0 HE ARG A 94 -60.823 -34.376 18.215 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -57.769 -34.702 16.440 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -57.233 -36.099 17.380 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -60.131 -36.181 19.431 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -58.575 -36.939 19.078 1.00 0.00 H new ATOM 1488 N LYS A 95 -58.140 -34.652 12.567 1.00 0.00 N ATOM 1489 CA LYS A 95 -57.870 -35.591 11.492 1.00 0.00 C ATOM 1490 C LYS A 95 -58.459 -36.956 11.851 1.00 0.00 C ATOM 1491 O LYS A 95 -58.236 -37.463 12.950 1.00 0.00 O ATOM 1492 CB LYS A 95 -56.373 -35.630 11.179 1.00 0.00 C ATOM 1493 CG LYS A 95 -56.086 -36.537 9.980 1.00 0.00 C ATOM 1494 CD LYS A 95 -54.581 -36.690 9.756 1.00 0.00 C ATOM 1495 CE LYS A 95 -54.294 -37.595 8.556 1.00 0.00 C ATOM 1496 NZ LYS A 95 -52.972 -38.244 8.700 1.00 0.00 N ATOM 0 H LYS A 95 -57.928 -35.001 13.502 1.00 0.00 H new ATOM 0 HA LYS A 95 -58.357 -35.267 10.572 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -56.015 -34.622 10.970 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -55.825 -35.989 12.050 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -56.534 -37.517 10.145 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -56.550 -36.121 9.086 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -54.133 -35.710 9.592 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -54.117 -37.107 10.650 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -55.071 -38.355 8.472 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -54.320 -37.009 7.637 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -52.793 -38.854 7.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -52.232 -37.515 8.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -52.960 -38.819 9.567 1.00 0.00 H new ATOM 1510 N ILE A 96 -59.200 -37.514 10.905 1.00 0.00 N ATOM 1511 CA ILE A 96 -59.823 -38.811 11.108 1.00 0.00 C ATOM 1512 C ILE A 96 -58.736 -39.882 11.220 1.00 0.00 C ATOM 1513 O ILE A 96 -57.565 -39.613 10.953 1.00 0.00 O ATOM 1514 CB ILE A 96 -60.851 -39.089 10.010 1.00 0.00 C ATOM 1515 CG1 ILE A 96 -61.732 -40.285 10.375 1.00 0.00 C ATOM 1516 CG2 ILE A 96 -60.167 -39.274 8.654 1.00 0.00 C ATOM 1517 CD1 ILE A 96 -63.023 -40.286 9.553 1.00 0.00 C ATOM 0 H ILE A 96 -59.383 -37.091 9.995 1.00 0.00 H new ATOM 0 HA ILE A 96 -60.381 -38.824 12.044 1.00 0.00 H new ATOM 0 HB ILE A 96 -61.505 -38.221 9.926 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -61.185 -41.211 10.200 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -61.973 -40.253 11.438 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -60.920 -39.470 7.891 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -59.617 -38.368 8.397 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -59.476 -40.115 8.707 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -63.631 -41.146 9.832 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -63.580 -39.369 9.749 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -62.779 -40.343 8.492 1.00 0.00 H new ATOM 1529 N THR A 97 -59.162 -41.073 11.614 1.00 0.00 N ATOM 1530 CA THR A 97 -58.239 -42.185 11.764 1.00 0.00 C ATOM 1531 C THR A 97 -58.881 -43.481 11.264 1.00 0.00 C ATOM 1532 O THR A 97 -60.070 -43.508 10.950 1.00 0.00 O ATOM 1533 CB THR A 97 -57.808 -42.247 13.231 1.00 0.00 C ATOM 1534 OG1 THR A 97 -59.032 -42.388 13.947 1.00 0.00 O ATOM 1535 CG2 THR A 97 -57.235 -40.919 13.730 1.00 0.00 C ATOM 0 H THR A 97 -60.134 -41.292 11.834 1.00 0.00 H new ATOM 0 HA THR A 97 -57.347 -42.044 11.154 1.00 0.00 H new ATOM 0 HB THR A 97 -57.064 -43.033 13.357 1.00 0.00 H new ATOM 0 HG1 THR A 97 -58.845 -42.438 14.908 1.00 0.00 H new ATOM 0 HG21 THR A 97 -56.945 -41.018 14.776 1.00 0.00 H new ATOM 0 HG22 THR A 97 -56.361 -40.653 13.135 1.00 0.00 H new ATOM 0 HG23 THR A 97 -57.990 -40.138 13.635 1.00 0.00 H new ATOM 1543 N ARG A 98 -58.065 -44.523 11.205 1.00 0.00 N ATOM 1544 CA ARG A 98 -58.538 -45.819 10.749 1.00 0.00 C ATOM 1545 C ARG A 98 -57.747 -46.941 11.424 1.00 0.00 C ATOM 1546 O ARG A 98 -56.655 -46.711 11.942 1.00 0.00 O ATOM 1547 CB ARG A 98 -58.402 -45.951 9.231 1.00 0.00 C ATOM 1548 CG ARG A 98 -59.773 -46.112 8.569 1.00 0.00 C ATOM 1549 CD ARG A 98 -60.143 -47.590 8.426 1.00 0.00 C ATOM 1550 NE ARG A 98 -61.527 -47.813 8.900 1.00 0.00 N ATOM 1551 CZ ARG A 98 -62.621 -47.413 8.237 1.00 0.00 C ATOM 1552 NH1 ARG A 98 -62.498 -46.767 7.069 1.00 0.00 N ATOM 1553 NH2 ARG A 98 -63.837 -47.659 8.742 1.00 0.00 N ATOM 0 H ARG A 98 -57.079 -44.496 11.465 1.00 0.00 H new ATOM 0 HA ARG A 98 -59.591 -45.901 11.017 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -57.901 -45.070 8.829 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -57.776 -46.810 8.992 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -60.530 -45.600 9.163 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -59.764 -45.639 7.587 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -60.053 -47.897 7.384 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -59.450 -48.204 9.000 1.00 0.00 H new ATOM 0 HE ARG A 98 -61.656 -48.301 9.786 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -61.572 -46.580 6.685 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -63.331 -46.463 6.564 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -63.930 -48.151 9.631 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -64.670 -47.355 8.238 1.00 0.00 H new ATOM 1567 N ASN A 99 -58.330 -48.131 11.398 1.00 0.00 N ATOM 1568 CA ASN A 99 -57.693 -49.289 12.001 1.00 0.00 C ATOM 1569 C ASN A 99 -58.274 -50.564 11.385 1.00 0.00 C ATOM 1570 O ASN A 99 -59.221 -50.503 10.603 1.00 0.00 O ATOM 1571 CB ASN A 99 -57.947 -49.334 13.509 1.00 0.00 C ATOM 1572 CG ASN A 99 -59.444 -49.262 13.815 1.00 0.00 C ATOM 1573 OD1 ASN A 99 -60.197 -50.195 13.588 1.00 0.00 O ATOM 1574 ND2 ASN A 99 -59.833 -48.105 14.342 1.00 0.00 N ATOM 0 H ASN A 99 -59.236 -48.318 10.969 1.00 0.00 H new ATOM 0 HA ASN A 99 -56.621 -49.218 11.818 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -57.531 -50.252 13.924 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -57.433 -48.504 13.993 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -60.813 -47.958 14.582 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -59.151 -47.365 14.507 1.00 0.00 H new ATOM 1581 N GLN A 100 -57.682 -51.688 11.762 1.00 0.00 N ATOM 1582 CA GLN A 100 -58.130 -52.975 11.257 1.00 0.00 C ATOM 1583 C GLN A 100 -57.621 -54.104 12.156 1.00 0.00 C ATOM 1584 O GLN A 100 -56.709 -53.902 12.956 1.00 0.00 O ATOM 1585 CB GLN A 100 -57.679 -53.182 9.810 1.00 0.00 C ATOM 1586 CG GLN A 100 -58.815 -53.753 8.958 1.00 0.00 C ATOM 1587 CD GLN A 100 -58.276 -54.361 7.662 1.00 0.00 C ATOM 1588 OE1 GLN A 100 -57.474 -53.773 6.956 1.00 0.00 O ATOM 1589 NE2 GLN A 100 -58.761 -55.570 7.389 1.00 0.00 N ATOM 0 H GLN A 100 -56.896 -51.734 12.411 1.00 0.00 H new ATOM 0 HA GLN A 100 -59.220 -52.990 11.270 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -57.346 -52.233 9.390 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -56.825 -53.859 9.785 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -59.352 -54.513 9.525 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -59.530 -52.965 8.724 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -59.430 -56.006 8.023 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -58.463 -56.060 6.546 1.00 0.00 H new ATOM 1598 N LYS A 101 -58.234 -55.267 11.995 1.00 0.00 N ATOM 1599 CA LYS A 101 -57.856 -56.428 12.782 1.00 0.00 C ATOM 1600 C LYS A 101 -58.297 -57.699 12.053 1.00 0.00 C ATOM 1601 O LYS A 101 -59.340 -57.715 11.401 1.00 0.00 O ATOM 1602 CB LYS A 101 -58.405 -56.313 14.205 1.00 0.00 C ATOM 1603 CG LYS A 101 -57.362 -56.754 15.233 1.00 0.00 C ATOM 1604 CD LYS A 101 -57.896 -57.895 16.101 1.00 0.00 C ATOM 1605 CE LYS A 101 -56.751 -58.757 16.639 1.00 0.00 C ATOM 1606 NZ LYS A 101 -57.225 -59.615 17.747 1.00 0.00 N ATOM 0 H LYS A 101 -58.990 -55.430 11.331 1.00 0.00 H new ATOM 0 HA LYS A 101 -56.772 -56.480 12.887 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -58.702 -55.283 14.402 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -59.300 -56.927 14.304 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -56.455 -57.076 14.721 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -57.089 -55.909 15.865 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -58.470 -57.486 16.933 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -58.578 -58.513 15.517 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -56.347 -59.377 15.838 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -55.940 -58.118 16.987 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -56.436 -60.193 18.100 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -57.589 -59.018 18.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -57.984 -60.238 17.404 1.00 0.00 H new ATOM 1620 N ARG A 102 -57.480 -58.734 12.187 1.00 0.00 N ATOM 1621 CA ARG A 102 -57.773 -60.006 11.550 1.00 0.00 C ATOM 1622 C ARG A 102 -57.729 -61.138 12.578 1.00 0.00 C ATOM 1623 O ARG A 102 -57.102 -61.004 13.628 1.00 0.00 O ATOM 1624 CB ARG A 102 -56.773 -60.304 10.430 1.00 0.00 C ATOM 1625 CG ARG A 102 -57.446 -61.056 9.280 1.00 0.00 C ATOM 1626 CD ARG A 102 -56.841 -62.451 9.109 1.00 0.00 C ATOM 1627 NE ARG A 102 -57.915 -63.442 8.873 1.00 0.00 N ATOM 1628 CZ ARG A 102 -58.649 -63.503 7.754 1.00 0.00 C ATOM 1629 NH1 ARG A 102 -58.430 -62.630 6.761 1.00 0.00 N ATOM 1630 NH2 ARG A 102 -59.602 -64.437 7.627 1.00 0.00 N ATOM 0 H ARG A 102 -56.615 -58.717 12.728 1.00 0.00 H new ATOM 0 HA ARG A 102 -58.773 -59.939 11.121 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -56.348 -59.371 10.060 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -55.947 -60.897 10.823 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -58.516 -61.141 9.473 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -57.332 -60.491 8.355 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -56.142 -62.453 8.273 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -56.274 -62.722 9.999 1.00 0.00 H new ATOM 0 HE ARG A 102 -58.108 -64.121 9.609 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -57.705 -61.919 6.857 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -58.989 -62.676 5.909 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -59.769 -65.102 8.383 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -60.161 -64.483 6.775 1.00 0.00 H new ATOM 1644 N LYS A 103 -58.403 -62.227 12.241 1.00 0.00 N ATOM 1645 CA LYS A 103 -58.449 -63.382 13.122 1.00 0.00 C ATOM 1646 C LYS A 103 -58.262 -64.656 12.297 1.00 0.00 C ATOM 1647 O LYS A 103 -58.386 -64.631 11.073 1.00 0.00 O ATOM 1648 CB LYS A 103 -59.734 -63.371 13.953 1.00 0.00 C ATOM 1649 CG LYS A 103 -60.961 -63.604 13.069 1.00 0.00 C ATOM 1650 CD LYS A 103 -61.431 -65.057 13.156 1.00 0.00 C ATOM 1651 CE LYS A 103 -62.680 -65.281 12.301 1.00 0.00 C ATOM 1652 NZ LYS A 103 -63.760 -65.889 13.110 1.00 0.00 N ATOM 0 H LYS A 103 -58.922 -62.334 11.370 1.00 0.00 H new ATOM 0 HA LYS A 103 -57.631 -63.345 13.841 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -59.682 -64.144 14.720 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -59.829 -62.416 14.469 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -61.767 -62.938 13.377 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -60.721 -63.357 12.035 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -60.634 -65.721 12.823 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -61.646 -65.312 14.194 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -63.019 -64.332 11.886 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -62.440 -65.929 11.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -64.600 -66.034 12.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -63.439 -66.804 13.485 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -64.001 -65.256 13.900 1.00 0.00 H new ATOM 1666 N HIS A 104 -57.966 -65.740 12.999 1.00 0.00 N ATOM 1667 CA HIS A 104 -57.760 -67.021 12.346 1.00 0.00 C ATOM 1668 C HIS A 104 -58.201 -68.150 13.280 1.00 0.00 C ATOM 1669 O HIS A 104 -58.534 -67.907 14.439 1.00 0.00 O ATOM 1670 CB HIS A 104 -56.309 -67.168 11.883 1.00 0.00 C ATOM 1671 CG HIS A 104 -55.296 -67.067 12.997 1.00 0.00 C ATOM 1672 ND1 HIS A 104 -55.440 -67.194 14.348 1.00 0.00 N flip ATOM 1673 CD2 HIS A 104 -53.956 -66.805 12.770 1.00 0.00 C flip ATOM 1674 CE1 HIS A 104 -54.252 -67.020 14.914 1.00 0.00 C flip ATOM 1675 NE2 HIS A 104 -53.331 -66.778 13.938 1.00 0.00 N flip ATOM 0 H HIS A 104 -57.864 -65.757 14.014 1.00 0.00 H new ATOM 0 HA HIS A 104 -58.375 -67.078 11.448 1.00 0.00 H new ATOM 0 HB2 HIS A 104 -56.193 -68.131 11.386 1.00 0.00 H new ATOM 0 HB3 HIS A 104 -56.096 -66.399 11.141 1.00 0.00 H new ATOM 0 HD2 HIS A 104 -53.498 -66.649 11.805 1.00 0.00 H new ATOM 0 HE1 HIS A 104 -54.048 -67.063 15.974 1.00 0.00 H new ATOM 0 HE2 HIS A 104 -52.336 -66.606 14.082 1.00 0.00 H new ATOM 1683 N ASP A 105 -58.190 -69.360 12.741 1.00 0.00 N ATOM 1684 CA ASP A 105 -58.585 -70.527 13.512 1.00 0.00 C ATOM 1685 C ASP A 105 -57.950 -71.777 12.898 1.00 0.00 C ATOM 1686 O ASP A 105 -57.372 -71.715 11.814 1.00 0.00 O ATOM 1687 CB ASP A 105 -60.103 -70.711 13.493 1.00 0.00 C ATOM 1688 CG ASP A 105 -60.804 -70.434 14.825 1.00 0.00 C ATOM 1689 OD1 ASP A 105 -60.226 -69.664 15.622 1.00 0.00 O ATOM 1690 OD2 ASP A 105 -61.902 -71.000 15.016 1.00 0.00 O ATOM 0 H ASP A 105 -57.914 -69.558 11.779 1.00 0.00 H new ATOM 0 HA ASP A 105 -58.252 -70.381 14.540 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -60.524 -70.052 12.734 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -60.326 -71.733 13.188 1.00 0.00 H new ATOM 1695 N GLU A 106 -58.078 -72.881 13.619 1.00 0.00 N ATOM 1696 CA GLU A 106 -57.524 -74.143 13.159 1.00 0.00 C ATOM 1697 C GLU A 106 -58.438 -75.302 13.563 1.00 0.00 C ATOM 1698 O GLU A 106 -58.956 -75.330 14.678 1.00 0.00 O ATOM 1699 CB GLU A 106 -56.107 -74.349 13.699 1.00 0.00 C ATOM 1700 CG GLU A 106 -55.482 -75.622 13.125 1.00 0.00 C ATOM 1701 CD GLU A 106 -54.567 -75.298 11.942 1.00 0.00 C ATOM 1702 OE1 GLU A 106 -53.681 -74.436 12.128 1.00 0.00 O ATOM 1703 OE2 GLU A 106 -54.775 -75.920 10.878 1.00 0.00 O ATOM 0 H GLU A 106 -58.557 -72.928 14.518 1.00 0.00 H new ATOM 0 HA GLU A 106 -57.463 -74.116 12.071 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -55.488 -73.489 13.444 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -56.134 -74.411 14.787 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -54.912 -76.133 13.901 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -56.269 -76.305 12.805 1.00 0.00 H new ATOM 1710 N ILE A 107 -58.608 -76.231 12.633 1.00 0.00 N ATOM 1711 CA ILE A 107 -59.450 -77.389 12.878 1.00 0.00 C ATOM 1712 C ILE A 107 -58.670 -78.418 13.699 1.00 0.00 C ATOM 1713 O ILE A 107 -57.494 -78.215 13.999 1.00 0.00 O ATOM 1714 CB ILE A 107 -59.998 -77.942 11.560 1.00 0.00 C ATOM 1715 CG1 ILE A 107 -58.865 -78.454 10.668 1.00 0.00 C ATOM 1716 CG2 ILE A 107 -60.864 -76.901 10.847 1.00 0.00 C ATOM 1717 CD1 ILE A 107 -58.714 -79.971 10.790 1.00 0.00 C ATOM 0 H ILE A 107 -58.177 -76.205 11.709 1.00 0.00 H new ATOM 0 HA ILE A 107 -60.323 -77.107 13.467 1.00 0.00 H new ATOM 0 HB ILE A 107 -60.640 -78.794 11.786 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -59.066 -78.187 9.630 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -57.930 -77.968 10.947 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -61.241 -77.319 9.914 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -61.703 -76.626 11.486 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -60.266 -76.015 10.633 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -57.902 -80.309 10.146 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -58.490 -80.232 11.824 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -59.643 -80.455 10.487 1.00 0.00 H new ATOM 1729 N ASN A 108 -59.355 -79.499 14.039 1.00 0.00 N ATOM 1730 CA ASN A 108 -58.740 -80.560 14.820 1.00 0.00 C ATOM 1731 C ASN A 108 -59.455 -81.881 14.529 1.00 0.00 C ATOM 1732 O ASN A 108 -60.489 -81.898 13.863 1.00 0.00 O ATOM 1733 CB ASN A 108 -58.858 -80.279 16.319 1.00 0.00 C ATOM 1734 CG ASN A 108 -57.544 -79.727 16.878 1.00 0.00 C ATOM 1735 OD1 ASN A 108 -56.469 -79.963 16.352 1.00 0.00 O ATOM 1736 ND2 ASN A 108 -57.692 -78.982 17.969 1.00 0.00 N ATOM 0 H ASN A 108 -60.330 -79.664 13.788 1.00 0.00 H new ATOM 0 HA ASN A 108 -57.687 -80.615 14.545 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -59.662 -79.564 16.497 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -59.125 -81.196 16.845 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -56.875 -78.568 18.418 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -58.622 -78.825 18.357 1.00 0.00 H new ATOM 1743 N HIS A 109 -58.876 -82.956 15.043 1.00 0.00 N ATOM 1744 CA HIS A 109 -59.445 -84.278 14.847 1.00 0.00 C ATOM 1745 C HIS A 109 -59.446 -85.039 16.174 1.00 0.00 C ATOM 1746 O HIS A 109 -58.600 -84.795 17.034 1.00 0.00 O ATOM 1747 CB HIS A 109 -58.708 -85.027 13.735 1.00 0.00 C ATOM 1748 CG HIS A 109 -57.548 -85.864 14.222 1.00 0.00 C ATOM 1749 ND1 HIS A 109 -57.492 -86.843 15.169 1.00 0.00 N flip ATOM 1750 CD2 HIS A 109 -56.265 -85.731 13.720 1.00 0.00 C flip ATOM 1751 CE1 HIS A 109 -56.243 -87.286 15.242 1.00 0.00 C flip ATOM 1752 NE2 HIS A 109 -55.481 -86.597 14.344 1.00 0.00 N flip ATOM 0 H HIS A 109 -58.018 -82.938 15.595 1.00 0.00 H new ATOM 0 HA HIS A 109 -60.481 -84.187 14.520 1.00 0.00 H new ATOM 0 HB2 HIS A 109 -59.416 -85.673 13.215 1.00 0.00 H new ATOM 0 HB3 HIS A 109 -58.341 -84.305 13.006 1.00 0.00 H new ATOM 0 HD2 HIS A 109 -55.956 -85.039 12.951 1.00 0.00 H new ATOM 0 HE1 HIS A 109 -55.888 -88.063 15.903 1.00 0.00 H new ATOM 0 HE2 HIS A 109 -54.482 -86.726 14.182 1.00 0.00 H new ATOM 1760 N VAL A 110 -60.404 -85.945 16.300 1.00 0.00 N ATOM 1761 CA VAL A 110 -60.526 -86.742 17.508 1.00 0.00 C ATOM 1762 C VAL A 110 -60.019 -88.159 17.232 1.00 0.00 C ATOM 1763 O VAL A 110 -60.307 -88.732 16.183 1.00 0.00 O ATOM 1764 CB VAL A 110 -61.971 -86.712 18.012 1.00 0.00 C ATOM 1765 CG1 VAL A 110 -62.185 -87.739 19.125 1.00 0.00 C ATOM 1766 CG2 VAL A 110 -62.359 -85.308 18.479 1.00 0.00 C ATOM 0 H VAL A 110 -61.103 -86.145 15.585 1.00 0.00 H new ATOM 0 HA VAL A 110 -59.910 -86.325 18.304 1.00 0.00 H new ATOM 0 HB VAL A 110 -62.622 -86.980 17.180 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -63.220 -87.697 19.465 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -61.968 -88.737 18.745 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -61.520 -87.516 19.959 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -63.390 -85.314 18.832 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -61.700 -84.999 19.290 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -62.264 -84.609 17.648 1.00 0.00 H new ATOM 1776 N GLN A 111 -59.273 -88.684 18.194 1.00 0.00 N ATOM 1777 CA GLN A 111 -58.723 -90.023 18.067 1.00 0.00 C ATOM 1778 C GLN A 111 -59.506 -91.003 18.943 1.00 0.00 C ATOM 1779 O GLN A 111 -60.366 -90.595 19.722 1.00 0.00 O ATOM 1780 CB GLN A 111 -57.235 -90.040 18.421 1.00 0.00 C ATOM 1781 CG GLN A 111 -57.023 -89.794 19.916 1.00 0.00 C ATOM 1782 CD GLN A 111 -57.156 -91.096 20.710 1.00 0.00 C ATOM 1783 OE1 GLN A 111 -58.243 -91.155 21.474 1.00 0.00 O flip ATOM 1784 NE2 GLN A 111 -56.327 -91.988 20.632 1.00 0.00 N flip ATOM 0 H GLN A 111 -59.037 -88.206 19.064 1.00 0.00 H new ATOM 0 HA GLN A 111 -58.819 -90.338 17.028 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -56.802 -91.001 18.142 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -56.712 -89.276 17.846 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -56.036 -89.362 20.081 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -57.752 -89.068 20.276 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -55.515 -91.878 20.025 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -56.446 -92.844 21.174 1.00 0.00 H new ATOM 1793 N LYS A 112 -59.179 -92.277 18.787 1.00 0.00 N ATOM 1794 CA LYS A 112 -59.841 -93.319 19.554 1.00 0.00 C ATOM 1795 C LYS A 112 -59.109 -94.646 19.341 1.00 0.00 C ATOM 1796 O LYS A 112 -58.270 -94.760 18.450 1.00 0.00 O ATOM 1797 CB LYS A 112 -61.330 -93.376 19.207 1.00 0.00 C ATOM 1798 CG LYS A 112 -62.147 -93.919 20.381 1.00 0.00 C ATOM 1799 CD LYS A 112 -62.620 -95.348 20.105 1.00 0.00 C ATOM 1800 CE LYS A 112 -63.119 -96.017 21.388 1.00 0.00 C ATOM 1801 NZ LYS A 112 -63.390 -97.453 21.151 1.00 0.00 N ATOM 0 H LYS A 112 -58.464 -92.612 18.141 1.00 0.00 H new ATOM 0 HA LYS A 112 -59.794 -93.096 20.620 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -61.684 -92.379 18.943 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -61.479 -94.009 18.332 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -61.543 -93.901 21.288 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -63.008 -93.275 20.558 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -63.419 -95.334 19.363 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -61.802 -95.930 19.681 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -62.374 -95.906 22.176 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -64.026 -95.522 21.735 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -63.728 -97.892 22.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -64.117 -97.552 20.414 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -62.516 -97.925 20.842 1.00 0.00 H new ATOM 1829 N TYR A 114 -59.142 -99.166 20.938 1.00 0.00 N ATOM 1830 CA TYR A 114 -59.836-100.247 21.617 1.00 0.00 C ATOM 1831 C TYR A 114 -58.867-101.367 21.997 1.00 0.00 C ATOM 1832 O TYR A 114 -57.681-101.303 21.676 1.00 0.00 O ATOM 1833 CB TYR A 114 -60.856-100.789 20.614 1.00 0.00 C ATOM 1834 CG TYR A 114 -60.276-101.799 19.622 1.00 0.00 C ATOM 1835 CD1 TYR A 114 -60.242-103.141 19.943 1.00 0.00 C ATOM 1836 CD2 TYR A 114 -59.786-101.368 18.406 1.00 0.00 C ATOM 1837 CE1 TYR A 114 -59.696-104.091 19.009 1.00 0.00 C ATOM 1838 CE2 TYR A 114 -59.239-102.318 17.472 1.00 0.00 C ATOM 1839 CZ TYR A 114 -59.222-103.633 17.819 1.00 0.00 C ATOM 1840 OH TYR A 114 -58.706-104.531 16.937 1.00 0.00 O ATOM 0 HA TYR A 114 -60.302 -99.887 22.534 1.00 0.00 H new ATOM 0 HB2 TYR A 114 -61.673-101.260 21.161 1.00 0.00 H new ATOM 0 HB3 TYR A 114 -61.283 -99.954 20.059 1.00 0.00 H new ATOM 0 HD1 TYR A 114 -60.625-103.478 20.895 1.00 0.00 H new ATOM 0 HD2 TYR A 114 -59.813-100.318 18.155 1.00 0.00 H new ATOM 0 HE1 TYR A 114 -59.663-105.144 19.248 1.00 0.00 H new ATOM 0 HE2 TYR A 114 -58.851-101.994 16.518 1.00 0.00 H new ATOM 0 HH TYR A 114 -58.407-104.062 16.130 1.00 0.00 H new ATOM 1850 N ALA A 115 -59.406-102.369 22.677 1.00 0.00 N ATOM 1851 CA ALA A 115 -58.604-103.502 23.104 1.00 0.00 C ATOM 1852 C ALA A 115 -59.479-104.756 23.143 1.00 0.00 C ATOM 1853 O ALA A 115 -60.703-104.666 23.053 1.00 0.00 O ATOM 1854 CB ALA A 115 -57.966-103.193 24.460 1.00 0.00 C ATOM 0 H ALA A 115 -60.390-102.419 22.943 1.00 0.00 H new ATOM 0 HA ALA A 115 -57.795-103.688 22.397 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -57.364-104.043 24.781 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -57.331-102.312 24.371 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -58.748-103.004 25.195 1.00 0.00 H new ATOM 1860 N GLU A 116 -58.819-105.896 23.278 1.00 0.00 N ATOM 1861 CA GLU A 116 -59.522-107.167 23.330 1.00 0.00 C ATOM 1862 C GLU A 116 -59.085-107.965 24.561 1.00 0.00 C ATOM 1863 O GLU A 116 -57.892-108.096 24.829 1.00 0.00 O ATOM 1864 CB GLU A 116 -59.298-107.971 22.048 1.00 0.00 C ATOM 1865 CG GLU A 116 -57.831-108.384 21.909 1.00 0.00 C ATOM 1866 CD GLU A 116 -57.620-109.246 20.663 1.00 0.00 C ATOM 1867 OE1 GLU A 116 -57.754-110.482 20.799 1.00 0.00 O ATOM 1868 OE2 GLU A 116 -57.330-108.651 19.603 1.00 0.00 O ATOM 0 H GLU A 116 -57.804-105.967 23.353 1.00 0.00 H new ATOM 0 HA GLU A 116 -60.590-106.966 23.411 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -59.930-108.859 22.056 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -59.595-107.376 21.185 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -57.203-107.495 21.851 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -57.520-108.937 22.795 1.00 0.00 H new ATOM 1875 N MET A 117 -60.076-108.477 25.276 1.00 0.00 N ATOM 1876 CA MET A 117 -59.809-109.259 26.472 1.00 0.00 C ATOM 1877 C MET A 117 -60.060-110.747 26.221 1.00 0.00 C ATOM 1878 O MET A 117 -60.634-111.120 25.199 1.00 0.00 O ATOM 1879 CB MET A 117 -60.709-108.773 27.610 1.00 0.00 C ATOM 1880 CG MET A 117 -60.264-107.398 28.113 1.00 0.00 C ATOM 1881 SD MET A 117 -61.380-106.140 27.516 1.00 0.00 S ATOM 1882 CE MET A 117 -60.293-105.264 26.403 1.00 0.00 C ATOM 0 H MET A 117 -61.065-108.366 25.051 1.00 0.00 H new ATOM 0 HA MET A 117 -58.762-109.128 26.744 1.00 0.00 H new ATOM 0 HB2 MET A 117 -61.742-108.721 27.265 1.00 0.00 H new ATOM 0 HB3 MET A 117 -60.683-109.490 28.430 1.00 0.00 H new ATOM 0 HG2 MET A 117 -60.243-107.390 29.203 1.00 0.00 H new ATOM 0 HG3 MET A 117 -59.250-107.188 27.773 1.00 0.00 H new ATOM 0 HE1 MET A 117 -60.034-104.297 26.834 1.00 0.00 H new ATOM 0 HE2 MET A 117 -59.385-105.847 26.247 1.00 0.00 H new ATOM 0 HE3 MET A 117 -60.795-105.113 25.448 1.00 0.00 H new ATOM 1892 N ASP A 118 -59.618-111.557 27.172 1.00 0.00 N ATOM 1893 CA ASP A 118 -59.787-112.996 27.067 1.00 0.00 C ATOM 1894 C ASP A 118 -61.280-113.333 27.096 1.00 0.00 C ATOM 1895 O ASP A 118 -62.062-112.647 27.752 1.00 0.00 O ATOM 1896 CB ASP A 118 -59.117-113.716 28.239 1.00 0.00 C ATOM 1897 CG ASP A 118 -57.734-113.185 28.619 1.00 0.00 C ATOM 1898 OD1 ASP A 118 -57.693-112.094 29.228 1.00 0.00 O ATOM 1899 OD2 ASP A 118 -56.749-113.881 28.292 1.00 0.00 O ATOM 0 H ASP A 118 -59.143-111.244 28.019 1.00 0.00 H new ATOM 0 HA ASP A 118 -59.329-113.322 26.134 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -59.769-113.645 29.110 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -59.028-114.774 27.993 1.00 0.00 H new ATOM 1904 N PRO A 119 -61.638-114.418 26.358 1.00 0.00 N ATOM 1905 CA PRO A 119 -63.023-114.854 26.293 1.00 0.00 C ATOM 1906 C PRO A 119 -63.438-115.554 27.589 1.00 0.00 C ATOM 1907 O PRO A 119 -64.380-115.128 28.255 1.00 0.00 O ATOM 1908 CB PRO A 119 -63.092-115.764 25.078 1.00 0.00 C ATOM 1909 CG PRO A 119 -61.658-116.173 24.781 1.00 0.00 C ATOM 1910 CD PRO A 119 -60.739-115.255 25.569 1.00 0.00 C ATOM 0 HA PRO A 119 -63.722-114.024 26.192 1.00 0.00 H new ATOM 0 HB2 PRO A 119 -63.713-116.637 25.279 1.00 0.00 H new ATOM 0 HB3 PRO A 119 -63.535-115.246 24.227 1.00 0.00 H new ATOM 0 HG2 PRO A 119 -61.492-117.213 25.062 1.00 0.00 H new ATOM 0 HG3 PRO A 119 -61.452-116.095 23.714 1.00 0.00 H new ATOM 0 HD2 PRO A 119 -60.065-115.824 26.209 1.00 0.00 H new ATOM 0 HD3 PRO A 119 -60.117-114.653 24.906 1.00 0.00 H new ATOM 1918 N THR A 120 -62.715-116.618 27.907 1.00 0.00 N ATOM 1919 CA THR A 120 -62.997-117.382 29.111 1.00 0.00 C ATOM 1920 C THR A 120 -61.899-118.420 29.353 1.00 0.00 C ATOM 1921 O THR A 120 -61.075-118.673 28.475 1.00 0.00 O ATOM 1922 CB THR A 120 -64.391-117.994 28.967 1.00 0.00 C ATOM 1923 OG1 THR A 120 -64.669-118.533 30.256 1.00 0.00 O ATOM 1924 CG2 THR A 120 -64.403-119.213 28.043 1.00 0.00 C ATOM 0 H THR A 120 -61.935-116.969 27.352 1.00 0.00 H new ATOM 0 HA THR A 120 -62.997-116.743 29.994 1.00 0.00 H new ATOM 0 HB THR A 120 -65.079-117.241 28.583 1.00 0.00 H new ATOM 0 HG1 THR A 120 -65.557-118.949 30.252 1.00 0.00 H new ATOM 0 HG21 THR A 120 -65.416-119.609 27.976 1.00 0.00 H new ATOM 0 HG22 THR A 120 -64.061-118.920 27.050 1.00 0.00 H new ATOM 0 HG23 THR A 120 -63.740-119.980 28.444 1.00 0.00 H new ATOM 1932 N THR A 121 -61.924-118.993 30.547 1.00 0.00 N ATOM 1933 CA THR A 121 -60.942-119.998 30.915 1.00 0.00 C ATOM 1934 C THR A 121 -61.357-120.700 32.210 1.00 0.00 C ATOM 1935 O THR A 121 -62.122-120.151 33.001 1.00 0.00 O ATOM 1936 CB THR A 121 -59.576-119.314 31.006 1.00 0.00 C ATOM 1937 OG1 THR A 121 -58.661-120.389 31.200 1.00 0.00 O ATOM 1938 CG2 THR A 121 -59.429-118.467 32.272 1.00 0.00 C ATOM 0 H THR A 121 -62.609-118.780 31.272 1.00 0.00 H new ATOM 0 HA THR A 121 -60.879-120.783 30.162 1.00 0.00 H new ATOM 0 HB THR A 121 -59.426-118.685 30.128 1.00 0.00 H new ATOM 0 HG1 THR A 121 -57.750-120.035 31.268 1.00 0.00 H new ATOM 0 HG21 THR A 121 -58.442-118.004 32.287 1.00 0.00 H new ATOM 0 HG22 THR A 121 -60.194-117.691 32.281 1.00 0.00 H new ATOM 0 HG23 THR A 121 -59.546-119.102 33.150 1.00 0.00 H new ATOM 1946 N ALA A 122 -60.833-121.905 32.386 1.00 0.00 N ATOM 1947 CA ALA A 122 -61.140-122.688 33.571 1.00 0.00 C ATOM 1948 C ALA A 122 -60.439-124.045 33.475 1.00 0.00 C ATOM 1949 O ALA A 122 -59.790-124.343 32.474 1.00 0.00 O ATOM 1950 CB ALA A 122 -62.657-122.824 33.715 1.00 0.00 C ATOM 0 H ALA A 122 -60.198-122.358 31.728 1.00 0.00 H new ATOM 0 HA ALA A 122 -60.772-122.189 34.467 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -62.887-123.411 34.604 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -63.104-121.834 33.809 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -63.063-123.323 32.835 1.00 0.00 H new ATOM 1956 N ALA A 123 -60.594-124.830 34.531 1.00 0.00 N ATOM 1957 CA ALA A 123 -59.984-126.148 34.579 1.00 0.00 C ATOM 1958 C ALA A 123 -60.952-127.129 35.243 1.00 0.00 C ATOM 1959 O ALA A 123 -62.106-126.790 35.502 1.00 0.00 O ATOM 1960 CB ALA A 123 -58.644-126.064 35.313 1.00 0.00 C ATOM 0 H ALA A 123 -61.133-124.579 35.360 1.00 0.00 H new ATOM 0 HA ALA A 123 -59.782-126.514 33.573 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -58.186-127.053 35.349 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -57.983-125.377 34.785 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -58.807-125.703 36.328 1.00 0.00 H new ATOM 1966 N LEU A 124 -60.447-128.327 35.500 1.00 0.00 N ATOM 1967 CA LEU A 124 -61.252-129.360 36.129 1.00 0.00 C ATOM 1968 C LEU A 124 -60.698-129.654 37.525 1.00 0.00 C ATOM 1969 O LEU A 124 -60.787-128.816 38.421 1.00 0.00 O ATOM 1970 CB LEU A 124 -61.339-130.594 35.229 1.00 0.00 C ATOM 1971 CG LEU A 124 -60.023-131.062 34.604 1.00 0.00 C ATOM 1972 CD1 LEU A 124 -59.970-132.589 34.517 1.00 0.00 C ATOM 1973 CD2 LEU A 124 -59.797-130.402 33.243 1.00 0.00 C ATOM 0 H LEU A 124 -59.490-128.605 35.284 1.00 0.00 H new ATOM 0 HA LEU A 124 -62.278-129.016 36.259 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -61.754-131.416 35.812 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -62.046-130.384 34.426 1.00 0.00 H new ATOM 0 HG LEU A 124 -59.206-130.748 35.253 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -59.025-132.895 34.069 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -60.052-133.014 35.518 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -60.796-132.947 33.902 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -58.855-130.752 32.821 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -60.615-130.663 32.572 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -59.760-129.320 33.365 1.00 0.00 H new ATOM 1985 N GLU A 125 -60.138-130.846 37.665 1.00 0.00 N ATOM 1986 CA GLU A 125 -59.569-131.261 38.936 1.00 0.00 C ATOM 1987 C GLU A 125 -58.961-132.660 38.814 1.00 0.00 C ATOM 1988 O GLU A 125 -59.353-133.438 37.945 1.00 0.00 O ATOM 1989 CB GLU A 125 -60.619-131.215 40.047 1.00 0.00 C ATOM 1990 CG GLU A 125 -59.963-131.000 41.413 1.00 0.00 C ATOM 1991 CD GLU A 125 -61.004-130.619 42.467 1.00 0.00 C ATOM 1992 OE1 GLU A 125 -61.654-131.552 42.987 1.00 0.00 O ATOM 1993 OE2 GLU A 125 -61.127-129.403 42.730 1.00 0.00 O ATOM 0 H GLU A 125 -60.066-131.538 36.919 1.00 0.00 H new ATOM 0 HA GLU A 125 -58.775-130.563 39.202 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -61.328-130.411 39.849 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -61.187-132.145 40.055 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -59.446-131.909 41.719 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -59.210-130.215 41.340 1.00 0.00 H new ATOM 2000 N LYS A 126 -58.012-132.937 39.697 1.00 0.00 N ATOM 2001 CA LYS A 126 -57.346-134.228 39.699 1.00 0.00 C ATOM 2002 C LYS A 126 -57.983-135.124 40.762 1.00 0.00 C ATOM 2003 O LYS A 126 -58.443-134.638 41.794 1.00 0.00 O ATOM 2004 CB LYS A 126 -55.836-134.051 39.868 1.00 0.00 C ATOM 2005 CG LYS A 126 -55.157-135.389 40.168 1.00 0.00 C ATOM 2006 CD LYS A 126 -53.690-135.186 40.551 1.00 0.00 C ATOM 2007 CE LYS A 126 -53.079-136.482 41.089 1.00 0.00 C ATOM 2008 NZ LYS A 126 -51.789-136.207 41.760 1.00 0.00 N ATOM 0 H LYS A 126 -57.689-132.289 40.416 1.00 0.00 H new ATOM 0 HA LYS A 126 -57.480-134.727 38.739 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -55.413-133.620 38.961 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -55.637-133.349 40.677 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -55.682-135.893 40.979 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -55.222-136.038 39.294 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -53.127-134.848 39.681 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -53.612-134.403 41.305 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -53.768-136.952 41.791 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -52.927-137.187 40.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -51.388-137.097 42.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -51.128-135.779 41.080 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -51.943-135.552 42.553 1.00 0.00 H new ATOM 2022 N GLU A 127 -57.990-136.417 40.474 1.00 0.00 N ATOM 2023 CA GLU A 127 -58.564-137.386 41.392 1.00 0.00 C ATOM 2024 C GLU A 127 -57.666-138.621 41.490 1.00 0.00 C ATOM 2025 O GLU A 127 -57.081-139.048 40.495 1.00 0.00 O ATOM 2026 CB GLU A 127 -59.982-137.771 40.968 1.00 0.00 C ATOM 2027 CG GLU A 127 -60.765-138.360 42.143 1.00 0.00 C ATOM 2028 CD GLU A 127 -61.350-139.727 41.782 1.00 0.00 C ATOM 2029 OE1 GLU A 127 -62.008-139.801 40.722 1.00 0.00 O ATOM 2030 OE2 GLU A 127 -61.127-140.667 42.575 1.00 0.00 O ATOM 0 H GLU A 127 -57.607-136.817 39.617 1.00 0.00 H new ATOM 0 HA GLU A 127 -58.628-136.928 42.379 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -60.501-136.893 40.584 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -59.938-138.496 40.156 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -60.110-138.458 43.009 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -61.568-137.680 42.427 1.00 0.00 H new ATOM 2037 N SER A 128 -57.584-139.160 42.698 1.00 0.00 N ATOM 2038 CA SER A 128 -56.768-140.338 42.938 1.00 0.00 C ATOM 2039 C SER A 128 -57.070-140.910 44.324 1.00 0.00 C ATOM 2040 O SER A 128 -57.486-140.181 45.223 1.00 0.00 O ATOM 2041 CB SER A 128 -55.278-140.010 42.812 1.00 0.00 C ATOM 2042 OG SER A 128 -54.486-141.183 42.648 1.00 0.00 O ATOM 0 H SER A 128 -58.069-138.802 43.521 1.00 0.00 H new ATOM 0 HA SER A 128 -57.014-141.085 42.183 1.00 0.00 H new ATOM 0 HB2 SER A 128 -55.123-139.346 41.961 1.00 0.00 H new ATOM 0 HB3 SER A 128 -54.949-139.471 43.701 1.00 0.00 H new ATOM 0 HG SER A 128 -53.542-140.932 42.570 1.00 0.00 H new ATOM 2048 N GLY A 129 -56.847-142.209 44.454 1.00 0.00 N ATOM 2049 CA GLY A 129 -57.090-142.888 45.716 1.00 0.00 C ATOM 2050 C GLY A 129 -56.782-144.382 45.604 1.00 0.00 C ATOM 2051 O GLY A 129 -57.584-145.147 45.070 1.00 0.00 O ATOM 0 H GLY A 129 -56.501-142.810 43.706 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -56.473-142.444 46.497 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -58.129-142.749 46.013 1.00 0.00 H new ATOM 2055 N PRO A 130 -55.586-144.763 46.129 1.00 0.00 N ATOM 2056 CA PRO A 130 -55.162-146.152 46.092 1.00 0.00 C ATOM 2057 C PRO A 130 -55.921-146.985 47.127 1.00 0.00 C ATOM 2058 O PRO A 130 -56.837-146.486 47.779 1.00 0.00 O ATOM 2059 CB PRO A 130 -53.663-146.112 46.345 1.00 0.00 C ATOM 2060 CG PRO A 130 -53.383-144.756 46.973 1.00 0.00 C ATOM 2061 CD PRO A 130 -54.611-143.885 46.768 1.00 0.00 C ATOM 0 HA PRO A 130 -55.379-146.633 45.138 1.00 0.00 H new ATOM 0 HB2 PRO A 130 -53.357-146.921 47.009 1.00 0.00 H new ATOM 0 HB3 PRO A 130 -53.107-146.235 45.416 1.00 0.00 H new ATOM 0 HG2 PRO A 130 -53.165-144.865 48.035 1.00 0.00 H new ATOM 0 HG3 PRO A 130 -52.508-144.296 46.514 1.00 0.00 H new ATOM 0 HD2 PRO A 130 -54.986-143.500 47.716 1.00 0.00 H new ATOM 0 HD3 PRO A 130 -54.384-143.022 46.141 1.00 0.00 H new ATOM 2069 N SER A 131 -55.511-148.239 47.246 1.00 0.00 N ATOM 2070 CA SER A 131 -56.141-149.146 48.191 1.00 0.00 C ATOM 2071 C SER A 131 -55.087-150.055 48.827 1.00 0.00 C ATOM 2072 O SER A 131 -53.931-150.059 48.407 1.00 0.00 O ATOM 2073 CB SER A 131 -57.225-149.985 47.510 1.00 0.00 C ATOM 2074 OG SER A 131 -56.679-150.881 46.546 1.00 0.00 O ATOM 0 H SER A 131 -54.750-148.649 46.704 1.00 0.00 H new ATOM 0 HA SER A 131 -56.616-148.551 48.971 1.00 0.00 H new ATOM 0 HB2 SER A 131 -57.771-150.552 48.264 1.00 0.00 H new ATOM 0 HB3 SER A 131 -57.944-149.324 47.025 1.00 0.00 H new ATOM 0 HG SER A 131 -57.402-151.400 46.135 1.00 0.00 H new ATOM 2080 N SER A 132 -55.524-150.803 49.829 1.00 0.00 N ATOM 2081 CA SER A 132 -54.633-151.714 50.527 1.00 0.00 C ATOM 2082 C SER A 132 -55.438-152.623 51.457 1.00 0.00 C ATOM 2083 O SER A 132 -56.624-152.392 51.684 1.00 0.00 O ATOM 2084 CB SER A 132 -53.573-150.947 51.321 1.00 0.00 C ATOM 2085 OG SER A 132 -54.156-150.083 52.293 1.00 0.00 O ATOM 0 H SER A 132 -56.484-150.797 50.174 1.00 0.00 H new ATOM 0 HA SER A 132 -54.120-152.326 49.785 1.00 0.00 H new ATOM 0 HB2 SER A 132 -52.909-151.655 51.817 1.00 0.00 H new ATOM 0 HB3 SER A 132 -52.960-150.361 50.636 1.00 0.00 H new ATOM 0 HG SER A 132 -53.447-149.613 52.780 1.00 0.00 H new ATOM 2091 N GLY A 133 -54.760-153.640 51.971 1.00 0.00 N ATOM 2092 CA GLY A 133 -55.397-154.585 52.871 1.00 0.00 C ATOM 2093 C GLY A 133 -54.636-155.912 52.901 1.00 0.00 C ATOM 2094 O GLY A 133 -53.407-155.928 52.868 1.00 0.00 O ATOM 0 H GLY A 133 -53.776-153.829 51.781 1.00 0.00 H new ATOM 0 HA2 GLY A 133 -55.440-154.164 53.875 1.00 0.00 H new ATOM 0 HA3 GLY A 133 -56.425-154.758 52.554 1.00 0.00 H new