USER MOD reduce.3.24.130724 H: found=0, std=0, add=948, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 949 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 MET CE :methyl -156:sc= -1.89! (180deg=-2.47!) USER MOD Set 1.2: A 182 GLN :FLIP amide:sc= -3.73 F(o=-6.9!,f=-5.6) USER MOD Set 2.1: A 143 MET CE :methyl 147:sc= -0.396 (180deg=-1.94!) USER MOD Set 2.2: A 185 CYS SG : rot 176:sc= -0.122 USER MOD Set 3.1: A 77 TYR OH : rot 30:sc= 0.656 USER MOD Set 3.2: A 166 HIS : no HD1:sc= -1.83! K(o=-1.2!,f=-1.8) USER MOD Set 4.1: A 19 SER OG : rot 78:sc= 0.281 USER MOD Set 4.2: A 23 GLN : amide:sc= -0.427 K(o=-0.15,f=-1.2!) USER MOD Single : A 17 HIS : no HD1:sc= -0.279 X(o=-0.28,f=-0.00036) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 GLN : amide:sc= 0.00371 K(o=0.0037,f=-0.55) USER MOD Single : A 24 ASN :FLIP amide:sc= 0 F(o=-0.53,f=0) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 ASN : amide:sc= -0.397 K(o=-0.4,f=-4.1!) USER MOD Single : A 71 GLN :FLIP amide:sc= -0.501 F(o=-1.5,f=-0.5) USER MOD Single : A 72 LYS NZ :NH3+ -128:sc= 0 (180deg=-0.767) USER MOD Single : A 76 GLN :FLIP amide:sc= -0.552 F(o=-1.8,f=-0.55) USER MOD Single : A 80 MET CE :methyl -109:sc= -0.795 (180deg=-4.19!) USER MOD Single : A 89 MET CE :methyl 163:sc= -1.24 (180deg=-1.63) USER MOD Single : A 91 THR OG1 : rot 160:sc= 0 USER MOD Single : A 93 ASN : amide:sc= -2.41 K(o=-2.4,f=-7.7!) USER MOD Single : A 94 SER OG : rot 96:sc= 0.17 USER MOD Single : A 98 ASN : amide:sc= -1.53 X(o=-1.5,f=-1.5) USER MOD Single : A 100 MET CE :methyl -129:sc= -0.575 (180deg=-3.45!) USER MOD Single : A 101 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot -34:sc= 0.339 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 105 LYS NZ :NH3+ -116:sc= 1.02 (180deg=-0.0558) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 112 ASN : amide:sc= -1.11 K(o=-1.1,f=-1.8) USER MOD Single : A 113 MET CE :methyl -140:sc= -0.345 (180deg=-2!) USER MOD Single : A 114 ASN : amide:sc= -1.75 K(o=-1.8,f=-6.6!) USER MOD Single : A 119 THR OG1 : rot 62:sc= 0.126 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 ASN : amide:sc=-0.000661 K(o=-0.00066,f=-1.3) USER MOD Single : A 135 CYS SG : rot 107:sc= -0.693 USER MOD Single : A 141 SER OG : rot -59:sc= 0.682 USER MOD Single : A 147 LYS NZ :NH3+ -167:sc=-5.56e-05 (180deg=-0.0524) USER MOD Single : A 150 HIS : no HD1:sc= -0.949 X(o=-0.95,f=-0.92) USER MOD Single : A 151 THR OG1 : rot -27:sc= 0.609 USER MOD Single : A 156 MET CE :methyl 151:sc= 0 (180deg=-0.657) USER MOD Single : A 158 THR OG1 : rot 180:sc= 0 USER MOD Single : A 165 CYS SG : rot 150:sc= -0.115 USER MOD Single : A 170 CYS SG : rot -177:sc= -4.79! USER MOD Single : A 173 ASN : amide:sc= -0.0545 K(o=-0.054,f=-3.4!) USER MOD Single : A 176 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 178 SER OG : rot -36:sc= 0.266 USER MOD ----------------------------------------------------------------- ATOM 196 N HIS A 17 15.722 6.264 -7.042 1.00 0.00 N ATOM 197 CA HIS A 17 14.300 6.394 -6.747 1.00 0.00 C ATOM 198 C HIS A 17 13.967 5.778 -5.391 1.00 0.00 C ATOM 199 O HIS A 17 13.206 6.348 -4.608 1.00 0.00 O ATOM 200 CB HIS A 17 13.467 5.726 -7.841 1.00 0.00 C ATOM 201 CG HIS A 17 12.154 5.196 -7.355 1.00 0.00 C ATOM 202 ND1 HIS A 17 10.984 5.925 -7.402 1.00 0.00 N ATOM 203 CD2 HIS A 17 11.828 4.000 -6.812 1.00 0.00 C ATOM 204 CE1 HIS A 17 9.996 5.201 -6.906 1.00 0.00 C ATOM 205 NE2 HIS A 17 10.482 4.028 -6.542 1.00 0.00 N ATOM 0 HA HIS A 17 14.058 7.456 -6.713 1.00 0.00 H new ATOM 0 HB2 HIS A 17 13.286 6.446 -8.639 1.00 0.00 H new ATOM 0 HB3 HIS A 17 14.042 4.908 -8.275 1.00 0.00 H new ATOM 0 HD2 HIS A 17 12.501 3.177 -6.626 1.00 0.00 H new ATOM 0 HE1 HIS A 17 8.967 5.515 -6.814 1.00 0.00 H new ATOM 0 HE2 HIS A 17 9.945 3.267 -6.128 1.00 0.00 H new ATOM 213 N LEU A 18 14.542 4.611 -5.120 1.00 0.00 N ATOM 214 CA LEU A 18 14.307 3.917 -3.859 1.00 0.00 C ATOM 215 C LEU A 18 14.633 4.818 -2.672 1.00 0.00 C ATOM 216 O LEU A 18 13.872 4.891 -1.707 1.00 0.00 O ATOM 217 CB LEU A 18 15.147 2.641 -3.792 1.00 0.00 C ATOM 218 CG LEU A 18 14.571 1.419 -4.507 1.00 0.00 C ATOM 219 CD1 LEU A 18 15.635 0.345 -4.671 1.00 0.00 C ATOM 220 CD2 LEU A 18 13.371 0.873 -3.747 1.00 0.00 C ATOM 0 H LEU A 18 15.174 4.126 -5.757 1.00 0.00 H new ATOM 0 HA LEU A 18 13.251 3.652 -3.810 1.00 0.00 H new ATOM 0 HB2 LEU A 18 16.129 2.854 -4.214 1.00 0.00 H new ATOM 0 HB3 LEU A 18 15.299 2.385 -2.743 1.00 0.00 H new ATOM 0 HG LEU A 18 14.239 1.726 -5.499 1.00 0.00 H new ATOM 0 HD11 LEU A 18 15.206 -0.517 -5.182 1.00 0.00 H new ATOM 0 HD12 LEU A 18 16.463 0.740 -5.259 1.00 0.00 H new ATOM 0 HD13 LEU A 18 15.999 0.041 -3.690 1.00 0.00 H new ATOM 0 HD21 LEU A 18 12.974 0.003 -4.270 1.00 0.00 H new ATOM 0 HD22 LEU A 18 13.678 0.583 -2.742 1.00 0.00 H new ATOM 0 HD23 LEU A 18 12.600 1.641 -3.683 1.00 0.00 H new ATOM 232 N SER A 19 15.769 5.504 -2.752 1.00 0.00 N ATOM 233 CA SER A 19 16.197 6.400 -1.683 1.00 0.00 C ATOM 234 C SER A 19 15.088 7.383 -1.321 1.00 0.00 C ATOM 235 O SER A 19 14.879 7.698 -0.149 1.00 0.00 O ATOM 236 CB SER A 19 17.455 7.164 -2.103 1.00 0.00 C ATOM 237 OG SER A 19 17.836 8.101 -1.111 1.00 0.00 O ATOM 0 H SER A 19 16.409 5.457 -3.545 1.00 0.00 H new ATOM 0 HA SER A 19 16.423 5.796 -0.804 1.00 0.00 H new ATOM 0 HB2 SER A 19 18.270 6.462 -2.277 1.00 0.00 H new ATOM 0 HB3 SER A 19 17.273 7.681 -3.045 1.00 0.00 H new ATOM 0 HG SER A 19 18.288 7.635 -0.377 1.00 0.00 H new ATOM 243 N LYS A 20 14.379 7.865 -2.336 1.00 0.00 N ATOM 244 CA LYS A 20 13.290 8.812 -2.128 1.00 0.00 C ATOM 245 C LYS A 20 12.276 8.264 -1.129 1.00 0.00 C ATOM 246 O LYS A 20 11.965 8.909 -0.129 1.00 0.00 O ATOM 247 CB LYS A 20 12.596 9.124 -3.456 1.00 0.00 C ATOM 248 CG LYS A 20 13.498 9.812 -4.466 1.00 0.00 C ATOM 249 CD LYS A 20 13.425 11.325 -4.338 1.00 0.00 C ATOM 250 CE LYS A 20 14.442 11.849 -3.336 1.00 0.00 C ATOM 251 NZ LYS A 20 14.591 13.328 -3.418 1.00 0.00 N ATOM 0 H LYS A 20 14.539 7.615 -3.312 1.00 0.00 H new ATOM 0 HA LYS A 20 13.714 9.731 -1.722 1.00 0.00 H new ATOM 0 HB2 LYS A 20 12.222 8.196 -3.888 1.00 0.00 H new ATOM 0 HB3 LYS A 20 11.730 9.757 -3.264 1.00 0.00 H new ATOM 0 HG2 LYS A 20 14.527 9.483 -4.320 1.00 0.00 H new ATOM 0 HG3 LYS A 20 13.209 9.517 -5.475 1.00 0.00 H new ATOM 0 HD2 LYS A 20 13.602 11.783 -5.311 1.00 0.00 H new ATOM 0 HD3 LYS A 20 12.422 11.617 -4.027 1.00 0.00 H new ATOM 0 HE2 LYS A 20 14.135 11.570 -2.328 1.00 0.00 H new ATOM 0 HE3 LYS A 20 15.407 11.376 -3.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 15.293 13.645 -2.719 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 14.908 13.593 -4.372 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 13.676 13.781 -3.220 1.00 0.00 H new ATOM 265 N MET A 21 11.765 7.069 -1.407 1.00 0.00 N ATOM 266 CA MET A 21 10.788 6.433 -0.531 1.00 0.00 C ATOM 267 C MET A 21 11.211 6.550 0.930 1.00 0.00 C ATOM 268 O MET A 21 10.376 6.742 1.813 1.00 0.00 O ATOM 269 CB MET A 21 10.615 4.960 -0.908 1.00 0.00 C ATOM 270 CG MET A 21 9.908 4.752 -2.237 1.00 0.00 C ATOM 271 SD MET A 21 8.112 4.808 -2.084 1.00 0.00 S ATOM 272 CE MET A 21 7.617 4.352 -3.744 1.00 0.00 C ATOM 0 H MET A 21 12.011 6.522 -2.232 1.00 0.00 H new ATOM 0 HA MET A 21 9.835 6.947 -0.657 1.00 0.00 H new ATOM 0 HB2 MET A 21 11.596 4.486 -0.950 1.00 0.00 H new ATOM 0 HB3 MET A 21 10.051 4.456 -0.123 1.00 0.00 H new ATOM 0 HG2 MET A 21 10.233 5.518 -2.941 1.00 0.00 H new ATOM 0 HG3 MET A 21 10.203 3.790 -2.655 1.00 0.00 H new ATOM 0 HE1 MET A 21 6.617 4.738 -3.945 1.00 0.00 H new ATOM 0 HE2 MET A 21 8.320 4.774 -4.462 1.00 0.00 H new ATOM 0 HE3 MET A 21 7.612 3.266 -3.837 1.00 0.00 H new ATOM 282 N GLN A 22 12.512 6.433 1.176 1.00 0.00 N ATOM 283 CA GLN A 22 13.044 6.524 2.531 1.00 0.00 C ATOM 284 C GLN A 22 13.162 7.980 2.972 1.00 0.00 C ATOM 285 O GLN A 22 12.852 8.318 4.113 1.00 0.00 O ATOM 286 CB GLN A 22 14.410 5.842 2.612 1.00 0.00 C ATOM 287 CG GLN A 22 14.392 4.388 2.166 1.00 0.00 C ATOM 288 CD GLN A 22 15.754 3.731 2.264 1.00 0.00 C ATOM 289 OE1 GLN A 22 16.784 4.378 2.072 1.00 0.00 O ATOM 290 NE2 GLN A 22 15.767 2.437 2.564 1.00 0.00 N ATOM 0 H GLN A 22 13.217 6.275 0.456 1.00 0.00 H new ATOM 0 HA GLN A 22 12.352 6.015 3.202 1.00 0.00 H new ATOM 0 HB2 GLN A 22 15.119 6.394 1.995 1.00 0.00 H new ATOM 0 HB3 GLN A 22 14.772 5.894 3.639 1.00 0.00 H new ATOM 0 HG2 GLN A 22 13.680 3.833 2.777 1.00 0.00 H new ATOM 0 HG3 GLN A 22 14.039 4.332 1.136 1.00 0.00 H new ATOM 0 HE21 GLN A 22 14.889 1.940 2.715 1.00 0.00 H new ATOM 0 HE22 GLN A 22 16.655 1.941 2.643 1.00 0.00 H new ATOM 299 N GLN A 23 13.613 8.834 2.059 1.00 0.00 N ATOM 300 CA GLN A 23 13.773 10.253 2.356 1.00 0.00 C ATOM 301 C GLN A 23 12.501 10.828 2.969 1.00 0.00 C ATOM 302 O GLN A 23 12.521 11.362 4.077 1.00 0.00 O ATOM 303 CB GLN A 23 14.135 11.023 1.084 1.00 0.00 C ATOM 304 CG GLN A 23 15.526 10.711 0.558 1.00 0.00 C ATOM 305 CD GLN A 23 16.527 10.460 1.669 1.00 0.00 C ATOM 306 OE1 GLN A 23 16.636 11.245 2.611 1.00 0.00 O ATOM 307 NE2 GLN A 23 17.265 9.361 1.564 1.00 0.00 N ATOM 0 H GLN A 23 13.874 8.569 1.109 1.00 0.00 H new ATOM 0 HA GLN A 23 14.582 10.359 3.079 1.00 0.00 H new ATOM 0 HB2 GLN A 23 13.403 10.793 0.310 1.00 0.00 H new ATOM 0 HB3 GLN A 23 14.063 12.092 1.284 1.00 0.00 H new ATOM 0 HG2 GLN A 23 15.478 9.834 -0.088 1.00 0.00 H new ATOM 0 HG3 GLN A 23 15.872 11.541 -0.057 1.00 0.00 H new ATOM 0 HE21 GLN A 23 17.141 8.738 0.766 1.00 0.00 H new ATOM 0 HE22 GLN A 23 17.955 9.140 2.281 1.00 0.00 H new ATOM 316 N ASN A 24 11.396 10.716 2.239 1.00 0.00 N ATOM 317 CA ASN A 24 10.113 11.226 2.711 1.00 0.00 C ATOM 318 C ASN A 24 9.025 10.165 2.581 1.00 0.00 C ATOM 319 O ASN A 24 8.235 9.955 3.501 1.00 0.00 O ATOM 320 CB ASN A 24 9.718 12.478 1.925 1.00 0.00 C ATOM 321 CG ASN A 24 10.391 13.729 2.453 1.00 0.00 C ATOM 322 OD1 ASN A 24 11.709 13.798 2.310 1.00 0.00 O flip ATOM 323 ND2 ASN A 24 9.733 14.624 2.985 1.00 0.00 N flip ATOM 0 H ASN A 24 11.363 10.277 1.319 1.00 0.00 H new ATOM 0 HA ASN A 24 10.218 11.485 3.764 1.00 0.00 H new ATOM 0 HB2 ASN A 24 9.981 12.343 0.876 1.00 0.00 H new ATOM 0 HB3 ASN A 24 8.636 12.605 1.969 1.00 0.00 H new ATOM 0 HD21 ASN A 24 8.721 14.529 3.074 1.00 0.00 H new ATOM 0 HD22 ASN A 24 10.200 15.460 3.337 1.00 0.00 H new ATOM 330 N GLY A 25 8.990 9.498 1.431 1.00 0.00 N ATOM 331 CA GLY A 25 7.995 8.467 1.202 1.00 0.00 C ATOM 332 C GLY A 25 7.005 8.847 0.118 1.00 0.00 C ATOM 333 O GLY A 25 7.218 9.813 -0.615 1.00 0.00 O ATOM 0 H GLY A 25 9.633 9.653 0.654 1.00 0.00 H new ATOM 0 HA2 GLY A 25 8.495 7.539 0.924 1.00 0.00 H new ATOM 0 HA3 GLY A 25 7.457 8.273 2.130 1.00 0.00 H new ATOM 337 N TYR A 26 5.922 8.085 0.015 1.00 0.00 N ATOM 338 CA TYR A 26 4.898 8.344 -0.989 1.00 0.00 C ATOM 339 C TYR A 26 3.502 8.255 -0.380 1.00 0.00 C ATOM 340 O TYR A 26 3.071 7.188 0.056 1.00 0.00 O ATOM 341 CB TYR A 26 5.026 7.352 -2.146 1.00 0.00 C ATOM 342 CG TYR A 26 4.315 7.794 -3.405 1.00 0.00 C ATOM 343 CD1 TYR A 26 4.955 8.594 -4.344 1.00 0.00 C ATOM 344 CD2 TYR A 26 3.003 7.412 -3.656 1.00 0.00 C ATOM 345 CE1 TYR A 26 4.309 9.001 -5.495 1.00 0.00 C ATOM 346 CE2 TYR A 26 2.350 7.813 -4.806 1.00 0.00 C ATOM 347 CZ TYR A 26 3.007 8.608 -5.721 1.00 0.00 C ATOM 348 OH TYR A 26 2.360 9.010 -6.867 1.00 0.00 O ATOM 0 H TYR A 26 5.731 7.283 0.615 1.00 0.00 H new ATOM 0 HA TYR A 26 5.045 9.355 -1.368 1.00 0.00 H new ATOM 0 HB2 TYR A 26 6.082 7.202 -2.369 1.00 0.00 H new ATOM 0 HB3 TYR A 26 4.626 6.388 -1.833 1.00 0.00 H new ATOM 0 HD1 TYR A 26 5.975 8.903 -4.171 1.00 0.00 H new ATOM 0 HD2 TYR A 26 2.485 6.791 -2.940 1.00 0.00 H new ATOM 0 HE1 TYR A 26 4.821 9.624 -6.214 1.00 0.00 H new ATOM 0 HE2 TYR A 26 1.331 7.505 -4.987 1.00 0.00 H new ATOM 0 HH TYR A 26 1.450 8.646 -6.874 1.00 0.00 H new ATOM 358 N GLU A 27 2.801 9.384 -0.355 1.00 0.00 N ATOM 359 CA GLU A 27 1.454 9.434 0.200 1.00 0.00 C ATOM 360 C GLU A 27 0.408 9.472 -0.911 1.00 0.00 C ATOM 361 O GLU A 27 0.689 9.906 -2.027 1.00 0.00 O ATOM 362 CB GLU A 27 1.297 10.656 1.106 1.00 0.00 C ATOM 363 CG GLU A 27 1.818 10.440 2.517 1.00 0.00 C ATOM 364 CD GLU A 27 1.903 11.728 3.312 1.00 0.00 C ATOM 365 OE1 GLU A 27 1.001 12.579 3.160 1.00 0.00 O ATOM 366 OE2 GLU A 27 2.870 11.886 4.085 1.00 0.00 O ATOM 0 H GLU A 27 3.144 10.276 -0.712 1.00 0.00 H new ATOM 0 HA GLU A 27 1.298 8.531 0.790 1.00 0.00 H new ATOM 0 HB2 GLU A 27 1.823 11.499 0.659 1.00 0.00 H new ATOM 0 HB3 GLU A 27 0.243 10.928 1.155 1.00 0.00 H new ATOM 0 HG2 GLU A 27 1.166 9.739 3.038 1.00 0.00 H new ATOM 0 HG3 GLU A 27 2.806 9.981 2.469 1.00 0.00 H new ATOM 373 N ASN A 28 -0.799 9.015 -0.595 1.00 0.00 N ATOM 374 CA ASN A 28 -1.887 8.996 -1.566 1.00 0.00 C ATOM 375 C ASN A 28 -2.695 10.289 -1.503 1.00 0.00 C ATOM 376 O ASN A 28 -3.371 10.580 -0.516 1.00 0.00 O ATOM 377 CB ASN A 28 -2.802 7.796 -1.314 1.00 0.00 C ATOM 378 CG ASN A 28 -3.980 7.757 -2.269 1.00 0.00 C ATOM 379 OD1 ASN A 28 -4.152 8.652 -3.097 1.00 0.00 O ATOM 380 ND2 ASN A 28 -4.797 6.716 -2.158 1.00 0.00 N ATOM 0 H ASN A 28 -1.048 8.653 0.325 1.00 0.00 H new ATOM 0 HA ASN A 28 -1.451 8.909 -2.561 1.00 0.00 H new ATOM 0 HB2 ASN A 28 -2.226 6.876 -1.414 1.00 0.00 H new ATOM 0 HB3 ASN A 28 -3.170 7.832 -0.289 1.00 0.00 H new ATOM 0 HD21 ASN A 28 -5.606 6.635 -2.774 1.00 0.00 H new ATOM 0 HD22 ASN A 28 -4.615 5.998 -1.457 1.00 0.00 H new ATOM 939 N VAL A 70 -3.264 -6.762 -16.181 1.00 0.00 N ATOM 940 CA VAL A 70 -2.931 -6.925 -14.771 1.00 0.00 C ATOM 941 C VAL A 70 -1.455 -7.262 -14.590 1.00 0.00 C ATOM 942 O VAL A 70 -0.884 -8.025 -15.368 1.00 0.00 O ATOM 943 CB VAL A 70 -3.783 -8.029 -14.116 1.00 0.00 C ATOM 944 CG1 VAL A 70 -3.678 -9.323 -14.908 1.00 0.00 C ATOM 945 CG2 VAL A 70 -3.359 -8.242 -12.671 1.00 0.00 C ATOM 0 HA VAL A 70 -3.146 -5.974 -14.284 1.00 0.00 H new ATOM 0 HB VAL A 70 -4.826 -7.711 -14.121 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -4.286 -10.092 -14.431 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -4.034 -9.157 -15.925 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -2.638 -9.649 -14.937 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -3.971 -9.025 -12.224 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -2.311 -8.538 -12.639 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -3.491 -7.315 -12.113 1.00 0.00 H new ATOM 955 N GLN A 71 -0.845 -6.690 -13.557 1.00 0.00 N ATOM 956 CA GLN A 71 0.565 -6.930 -13.274 1.00 0.00 C ATOM 957 C GLN A 71 0.729 -7.868 -12.082 1.00 0.00 C ATOM 958 O GLN A 71 0.184 -7.622 -11.006 1.00 0.00 O ATOM 959 CB GLN A 71 1.285 -5.609 -13.001 1.00 0.00 C ATOM 960 CG GLN A 71 1.362 -4.696 -14.215 1.00 0.00 C ATOM 961 CD GLN A 71 1.465 -3.231 -13.837 1.00 0.00 C ATOM 962 OE1 GLN A 71 2.496 -2.888 -13.073 1.00 0.00 O flip ATOM 963 NE2 GLN A 71 0.628 -2.417 -14.228 1.00 0.00 N flip ATOM 0 H GLN A 71 -1.305 -6.057 -12.902 1.00 0.00 H new ATOM 0 HA GLN A 71 1.009 -7.403 -14.150 1.00 0.00 H new ATOM 0 HB2 GLN A 71 0.772 -5.085 -12.195 1.00 0.00 H new ATOM 0 HB3 GLN A 71 2.295 -5.821 -12.651 1.00 0.00 H new ATOM 0 HG2 GLN A 71 2.226 -4.973 -14.819 1.00 0.00 H new ATOM 0 HG3 GLN A 71 0.478 -4.846 -14.835 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -0.148 -2.725 -14.814 1.00 0.00 H new ATOM 0 HE22 GLN A 71 0.711 -1.435 -13.966 1.00 0.00 H new ATOM 972 N LYS A 72 1.482 -8.944 -12.281 1.00 0.00 N ATOM 973 CA LYS A 72 1.719 -9.919 -11.224 1.00 0.00 C ATOM 974 C LYS A 72 3.200 -9.981 -10.863 1.00 0.00 C ATOM 975 O LYS A 72 4.044 -10.274 -11.710 1.00 0.00 O ATOM 976 CB LYS A 72 1.231 -11.302 -11.658 1.00 0.00 C ATOM 977 CG LYS A 72 -0.281 -11.448 -11.638 1.00 0.00 C ATOM 978 CD LYS A 72 -0.705 -12.888 -11.874 1.00 0.00 C ATOM 979 CE LYS A 72 -0.776 -13.212 -13.358 1.00 0.00 C ATOM 980 NZ LYS A 72 0.529 -13.702 -13.882 1.00 0.00 N ATOM 0 H LYS A 72 1.939 -9.163 -13.166 1.00 0.00 H new ATOM 0 HA LYS A 72 1.161 -9.604 -10.342 1.00 0.00 H new ATOM 0 HB2 LYS A 72 1.594 -11.506 -12.665 1.00 0.00 H new ATOM 0 HB3 LYS A 72 1.669 -12.055 -11.002 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -0.668 -11.107 -10.678 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -0.719 -10.808 -12.404 1.00 0.00 H new ATOM 0 HD2 LYS A 72 0.001 -13.561 -11.387 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -1.679 -13.061 -11.416 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -1.543 -13.968 -13.528 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -1.078 -12.322 -13.910 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 0.795 -13.149 -14.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 1.260 -13.594 -13.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 0.444 -14.706 -14.141 1.00 0.00 H new ATOM 994 N PHE A 73 3.509 -9.704 -9.600 1.00 0.00 N ATOM 995 CA PHE A 73 4.888 -9.729 -9.127 1.00 0.00 C ATOM 996 C PHE A 73 5.087 -10.830 -8.089 1.00 0.00 C ATOM 997 O PHE A 73 4.128 -11.304 -7.480 1.00 0.00 O ATOM 998 CB PHE A 73 5.269 -8.374 -8.529 1.00 0.00 C ATOM 999 CG PHE A 73 5.420 -7.287 -9.555 1.00 0.00 C ATOM 1000 CD1 PHE A 73 4.312 -6.603 -10.028 1.00 0.00 C ATOM 1001 CD2 PHE A 73 6.671 -6.949 -10.047 1.00 0.00 C ATOM 1002 CE1 PHE A 73 4.448 -5.604 -10.972 1.00 0.00 C ATOM 1003 CE2 PHE A 73 6.813 -5.950 -10.992 1.00 0.00 C ATOM 1004 CZ PHE A 73 5.700 -5.276 -11.454 1.00 0.00 C ATOM 0 H PHE A 73 2.823 -9.460 -8.886 1.00 0.00 H new ATOM 0 HA PHE A 73 5.535 -9.937 -9.980 1.00 0.00 H new ATOM 0 HB2 PHE A 73 4.508 -8.078 -7.807 1.00 0.00 H new ATOM 0 HB3 PHE A 73 6.205 -8.478 -7.981 1.00 0.00 H new ATOM 0 HD1 PHE A 73 3.330 -6.854 -9.654 1.00 0.00 H new ATOM 0 HD2 PHE A 73 7.545 -7.472 -9.688 1.00 0.00 H new ATOM 0 HE1 PHE A 73 3.576 -5.080 -11.333 1.00 0.00 H new ATOM 0 HE2 PHE A 73 7.793 -5.697 -11.368 1.00 0.00 H new ATOM 0 HZ PHE A 73 5.808 -4.494 -12.191 1.00 0.00 H new ATOM 1014 N ARG A 74 6.339 -11.231 -7.893 1.00 0.00 N ATOM 1015 CA ARG A 74 6.665 -12.276 -6.931 1.00 0.00 C ATOM 1016 C ARG A 74 7.229 -11.676 -5.646 1.00 0.00 C ATOM 1017 O ARG A 74 8.242 -10.975 -5.668 1.00 0.00 O ATOM 1018 CB ARG A 74 7.671 -13.258 -7.533 1.00 0.00 C ATOM 1019 CG ARG A 74 8.154 -14.314 -6.552 1.00 0.00 C ATOM 1020 CD ARG A 74 9.431 -13.881 -5.850 1.00 0.00 C ATOM 1021 NE ARG A 74 10.625 -14.318 -6.568 1.00 0.00 N ATOM 1022 CZ ARG A 74 11.080 -15.566 -6.547 1.00 0.00 C ATOM 1023 NH1 ARG A 74 10.442 -16.496 -5.849 1.00 0.00 N ATOM 1024 NH2 ARG A 74 12.173 -15.887 -7.227 1.00 0.00 N ATOM 0 H ARG A 74 7.144 -10.848 -8.388 1.00 0.00 H new ATOM 0 HA ARG A 74 5.747 -12.811 -6.689 1.00 0.00 H new ATOM 0 HB2 ARG A 74 7.214 -13.753 -8.390 1.00 0.00 H new ATOM 0 HB3 ARG A 74 8.530 -12.701 -7.907 1.00 0.00 H new ATOM 0 HG2 ARG A 74 7.378 -14.506 -5.811 1.00 0.00 H new ATOM 0 HG3 ARG A 74 8.328 -15.251 -7.081 1.00 0.00 H new ATOM 0 HD2 ARG A 74 9.442 -12.795 -5.755 1.00 0.00 H new ATOM 0 HD3 ARG A 74 9.446 -14.290 -4.840 1.00 0.00 H new ATOM 0 HE ARG A 74 11.138 -13.627 -7.116 1.00 0.00 H new ATOM 0 HH11 ARG A 74 9.600 -16.254 -5.327 1.00 0.00 H new ATOM 0 HH12 ARG A 74 10.793 -17.453 -5.834 1.00 0.00 H new ATOM 0 HH21 ARG A 74 12.665 -15.175 -7.767 1.00 0.00 H new ATOM 0 HH22 ARG A 74 12.521 -16.846 -7.210 1.00 0.00 H new ATOM 1038 N VAL A 75 6.567 -11.955 -4.528 1.00 0.00 N ATOM 1039 CA VAL A 75 7.003 -11.443 -3.234 1.00 0.00 C ATOM 1040 C VAL A 75 6.525 -12.341 -2.099 1.00 0.00 C ATOM 1041 O VAL A 75 5.767 -13.286 -2.319 1.00 0.00 O ATOM 1042 CB VAL A 75 6.487 -10.012 -2.994 1.00 0.00 C ATOM 1043 CG1 VAL A 75 7.109 -9.046 -3.990 1.00 0.00 C ATOM 1044 CG2 VAL A 75 4.969 -9.972 -3.076 1.00 0.00 C ATOM 0 H VAL A 75 5.727 -12.533 -4.492 1.00 0.00 H new ATOM 0 HA VAL A 75 8.093 -11.430 -3.249 1.00 0.00 H new ATOM 0 HB VAL A 75 6.782 -9.702 -1.991 1.00 0.00 H new ATOM 0 HG11 VAL A 75 6.732 -8.040 -3.805 1.00 0.00 H new ATOM 0 HG12 VAL A 75 8.193 -9.054 -3.877 1.00 0.00 H new ATOM 0 HG13 VAL A 75 6.848 -9.350 -5.004 1.00 0.00 H new ATOM 0 HG21 VAL A 75 4.622 -8.953 -2.904 1.00 0.00 H new ATOM 0 HG22 VAL A 75 4.649 -10.302 -4.064 1.00 0.00 H new ATOM 0 HG23 VAL A 75 4.546 -10.632 -2.319 1.00 0.00 H new ATOM 1054 N GLN A 76 6.973 -12.040 -0.884 1.00 0.00 N ATOM 1055 CA GLN A 76 6.590 -12.821 0.286 1.00 0.00 C ATOM 1056 C GLN A 76 5.696 -12.006 1.215 1.00 0.00 C ATOM 1057 O GLN A 76 5.670 -10.777 1.149 1.00 0.00 O ATOM 1058 CB GLN A 76 7.835 -13.292 1.041 1.00 0.00 C ATOM 1059 CG GLN A 76 8.372 -14.628 0.553 1.00 0.00 C ATOM 1060 CD GLN A 76 9.825 -14.844 0.929 1.00 0.00 C ATOM 1061 OE1 GLN A 76 10.053 -15.531 2.042 1.00 0.00 O flip ATOM 1062 NE2 GLN A 76 10.733 -14.398 0.226 1.00 0.00 N flip ATOM 0 H GLN A 76 7.601 -11.261 -0.685 1.00 0.00 H new ATOM 0 HA GLN A 76 6.030 -13.691 -0.056 1.00 0.00 H new ATOM 0 HB2 GLN A 76 8.616 -12.538 0.943 1.00 0.00 H new ATOM 0 HB3 GLN A 76 7.599 -13.370 2.102 1.00 0.00 H new ATOM 0 HG2 GLN A 76 7.768 -15.433 0.972 1.00 0.00 H new ATOM 0 HG3 GLN A 76 8.269 -14.683 -0.531 1.00 0.00 H new ATOM 0 HE21 GLN A 76 10.512 -13.875 -0.622 1.00 0.00 H new ATOM 0 HE22 GLN A 76 11.706 -14.551 0.492 1.00 0.00 H new ATOM 1071 N TYR A 77 4.963 -12.699 2.080 1.00 0.00 N ATOM 1072 CA TYR A 77 4.065 -12.040 3.021 1.00 0.00 C ATOM 1073 C TYR A 77 4.452 -12.364 4.461 1.00 0.00 C ATOM 1074 O TYR A 77 4.180 -13.457 4.959 1.00 0.00 O ATOM 1075 CB TYR A 77 2.619 -12.467 2.762 1.00 0.00 C ATOM 1076 CG TYR A 77 1.613 -11.761 3.643 1.00 0.00 C ATOM 1077 CD1 TYR A 77 1.716 -10.399 3.896 1.00 0.00 C ATOM 1078 CD2 TYR A 77 0.560 -12.457 4.223 1.00 0.00 C ATOM 1079 CE1 TYR A 77 0.799 -9.751 4.701 1.00 0.00 C ATOM 1080 CE2 TYR A 77 -0.362 -11.817 5.028 1.00 0.00 C ATOM 1081 CZ TYR A 77 -0.238 -10.464 5.265 1.00 0.00 C ATOM 1082 OH TYR A 77 -1.154 -9.822 6.067 1.00 0.00 O ATOM 0 H TYR A 77 4.973 -13.717 2.149 1.00 0.00 H new ATOM 0 HA TYR A 77 4.151 -10.963 2.874 1.00 0.00 H new ATOM 0 HB2 TYR A 77 2.373 -12.274 1.718 1.00 0.00 H new ATOM 0 HB3 TYR A 77 2.533 -13.543 2.916 1.00 0.00 H new ATOM 0 HD1 TYR A 77 2.527 -9.837 3.456 1.00 0.00 H new ATOM 0 HD2 TYR A 77 0.461 -13.517 4.041 1.00 0.00 H new ATOM 0 HE1 TYR A 77 0.894 -8.691 4.888 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -1.176 -12.373 5.470 1.00 0.00 H new ATOM 0 HH TYR A 77 -1.245 -8.890 5.779 1.00 0.00 H new ATOM 1092 N LEU A 78 5.087 -11.405 5.125 1.00 0.00 N ATOM 1093 CA LEU A 78 5.512 -11.585 6.509 1.00 0.00 C ATOM 1094 C LEU A 78 4.308 -11.731 7.434 1.00 0.00 C ATOM 1095 O LEU A 78 4.242 -12.655 8.243 1.00 0.00 O ATOM 1096 CB LEU A 78 6.373 -10.402 6.957 1.00 0.00 C ATOM 1097 CG LEU A 78 7.802 -10.369 6.416 1.00 0.00 C ATOM 1098 CD1 LEU A 78 7.808 -9.970 4.948 1.00 0.00 C ATOM 1099 CD2 LEU A 78 8.661 -9.415 7.233 1.00 0.00 C ATOM 0 H LEU A 78 5.319 -10.495 4.728 1.00 0.00 H new ATOM 0 HA LEU A 78 6.103 -12.499 6.565 1.00 0.00 H new ATOM 0 HB2 LEU A 78 5.872 -9.481 6.660 1.00 0.00 H new ATOM 0 HB3 LEU A 78 6.418 -10.403 8.046 1.00 0.00 H new ATOM 0 HG LEU A 78 8.225 -11.370 6.501 1.00 0.00 H new ATOM 0 HD11 LEU A 78 8.834 -9.952 4.580 1.00 0.00 H new ATOM 0 HD12 LEU A 78 7.229 -10.692 4.372 1.00 0.00 H new ATOM 0 HD13 LEU A 78 7.366 -8.980 4.838 1.00 0.00 H new ATOM 0 HD21 LEU A 78 9.675 -9.405 6.833 1.00 0.00 H new ATOM 0 HD22 LEU A 78 8.240 -8.411 7.181 1.00 0.00 H new ATOM 0 HD23 LEU A 78 8.684 -9.745 8.272 1.00 0.00 H new ATOM 1111 N GLY A 79 3.355 -10.813 7.306 1.00 0.00 N ATOM 1112 CA GLY A 79 2.165 -10.858 8.135 1.00 0.00 C ATOM 1113 C GLY A 79 1.579 -9.483 8.384 1.00 0.00 C ATOM 1114 O GLY A 79 2.219 -8.469 8.108 1.00 0.00 O ATOM 0 H GLY A 79 3.386 -10.039 6.643 1.00 0.00 H new ATOM 0 HA2 GLY A 79 1.415 -11.487 7.655 1.00 0.00 H new ATOM 0 HA3 GLY A 79 2.409 -11.324 9.090 1.00 0.00 H new ATOM 1118 N MET A 80 0.357 -9.448 8.906 1.00 0.00 N ATOM 1119 CA MET A 80 -0.316 -8.186 9.192 1.00 0.00 C ATOM 1120 C MET A 80 0.210 -7.570 10.485 1.00 0.00 C ATOM 1121 O MET A 80 0.198 -8.210 11.538 1.00 0.00 O ATOM 1122 CB MET A 80 -1.827 -8.400 9.293 1.00 0.00 C ATOM 1123 CG MET A 80 -2.636 -7.128 9.095 1.00 0.00 C ATOM 1124 SD MET A 80 -4.260 -7.209 9.874 1.00 0.00 S ATOM 1125 CE MET A 80 -3.809 -7.115 11.605 1.00 0.00 C ATOM 0 H MET A 80 -0.187 -10.279 9.139 1.00 0.00 H new ATOM 0 HA MET A 80 -0.108 -7.499 8.372 1.00 0.00 H new ATOM 0 HB2 MET A 80 -2.132 -9.135 8.548 1.00 0.00 H new ATOM 0 HB3 MET A 80 -2.061 -8.821 10.271 1.00 0.00 H new ATOM 0 HG2 MET A 80 -2.083 -6.283 9.504 1.00 0.00 H new ATOM 0 HG3 MET A 80 -2.758 -6.942 8.028 1.00 0.00 H new ATOM 0 HE1 MET A 80 -3.975 -8.083 12.077 1.00 0.00 H new ATOM 0 HE2 MET A 80 -2.757 -6.844 11.693 1.00 0.00 H new ATOM 0 HE3 MET A 80 -4.420 -6.360 12.100 1.00 0.00 H new ATOM 1135 N LEU A 81 0.670 -6.327 10.399 1.00 0.00 N ATOM 1136 CA LEU A 81 1.200 -5.626 11.563 1.00 0.00 C ATOM 1137 C LEU A 81 0.524 -4.270 11.736 1.00 0.00 C ATOM 1138 O LEU A 81 0.624 -3.385 10.886 1.00 0.00 O ATOM 1139 CB LEU A 81 2.713 -5.440 11.426 1.00 0.00 C ATOM 1140 CG LEU A 81 3.495 -5.313 12.734 1.00 0.00 C ATOM 1141 CD1 LEU A 81 3.005 -4.117 13.535 1.00 0.00 C ATOM 1142 CD2 LEU A 81 3.376 -6.591 13.552 1.00 0.00 C ATOM 0 H LEU A 81 0.687 -5.784 9.536 1.00 0.00 H new ATOM 0 HA LEU A 81 0.993 -6.231 12.446 1.00 0.00 H new ATOM 0 HB2 LEU A 81 3.114 -6.286 10.867 1.00 0.00 H new ATOM 0 HB3 LEU A 81 2.896 -4.547 10.828 1.00 0.00 H new ATOM 0 HG LEU A 81 4.546 -5.156 12.493 1.00 0.00 H new ATOM 0 HD11 LEU A 81 3.573 -4.043 14.462 1.00 0.00 H new ATOM 0 HD12 LEU A 81 3.143 -3.207 12.951 1.00 0.00 H new ATOM 0 HD13 LEU A 81 1.947 -4.243 13.767 1.00 0.00 H new ATOM 0 HD21 LEU A 81 3.938 -6.483 14.479 1.00 0.00 H new ATOM 0 HD22 LEU A 81 2.327 -6.779 13.783 1.00 0.00 H new ATOM 0 HD23 LEU A 81 3.777 -7.428 12.980 1.00 0.00 H new ATOM 1154 N PRO A 82 -0.181 -4.100 12.865 1.00 0.00 N ATOM 1155 CA PRO A 82 -0.886 -2.853 13.178 1.00 0.00 C ATOM 1156 C PRO A 82 0.071 -1.708 13.488 1.00 0.00 C ATOM 1157 O PRO A 82 1.172 -1.926 13.995 1.00 0.00 O ATOM 1158 CB PRO A 82 -1.709 -3.213 14.417 1.00 0.00 C ATOM 1159 CG PRO A 82 -0.967 -4.338 15.051 1.00 0.00 C ATOM 1160 CD PRO A 82 -0.344 -5.112 13.922 1.00 0.00 C ATOM 0 HA PRO A 82 -1.486 -2.502 12.338 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -1.796 -2.364 15.095 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -2.722 -3.510 14.147 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -0.205 -3.966 15.736 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -1.638 -4.969 15.633 1.00 0.00 H new ATOM 0 HD2 PRO A 82 0.612 -5.547 14.213 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -0.983 -5.933 13.597 1.00 0.00 H new ATOM 1168 N VAL A 83 -0.354 -0.487 13.180 1.00 0.00 N ATOM 1169 CA VAL A 83 0.465 0.693 13.428 1.00 0.00 C ATOM 1170 C VAL A 83 -0.308 1.743 14.218 1.00 0.00 C ATOM 1171 O VAL A 83 -1.539 1.742 14.232 1.00 0.00 O ATOM 1172 CB VAL A 83 0.960 1.319 12.111 1.00 0.00 C ATOM 1173 CG1 VAL A 83 2.015 0.436 11.463 1.00 0.00 C ATOM 1174 CG2 VAL A 83 -0.206 1.555 11.162 1.00 0.00 C ATOM 0 H VAL A 83 -1.261 -0.289 12.758 1.00 0.00 H new ATOM 0 HA VAL A 83 1.325 0.364 14.012 1.00 0.00 H new ATOM 0 HB VAL A 83 1.416 2.283 12.336 1.00 0.00 H new ATOM 0 HG11 VAL A 83 2.353 0.895 10.534 1.00 0.00 H new ATOM 0 HG12 VAL A 83 2.861 0.323 12.141 1.00 0.00 H new ATOM 0 HG13 VAL A 83 1.588 -0.544 11.250 1.00 0.00 H new ATOM 0 HG21 VAL A 83 0.162 1.998 10.236 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -0.693 0.605 10.941 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -0.923 2.231 11.628 1.00 0.00 H new ATOM 1184 N ASP A 84 0.422 2.638 14.874 1.00 0.00 N ATOM 1185 CA ASP A 84 -0.195 3.696 15.666 1.00 0.00 C ATOM 1186 C ASP A 84 -0.660 4.843 14.773 1.00 0.00 C ATOM 1187 O ASP A 84 -1.701 5.452 15.019 1.00 0.00 O ATOM 1188 CB ASP A 84 0.788 4.217 16.715 1.00 0.00 C ATOM 1189 CG ASP A 84 0.159 5.238 17.642 1.00 0.00 C ATOM 1190 OD1 ASP A 84 -0.942 4.965 18.166 1.00 0.00 O ATOM 1191 OD2 ASP A 84 0.767 6.310 17.844 1.00 0.00 O ATOM 0 H ASP A 84 1.442 2.652 14.873 1.00 0.00 H new ATOM 0 HA ASP A 84 -1.065 3.277 16.171 1.00 0.00 H new ATOM 0 HB2 ASP A 84 1.164 3.380 17.303 1.00 0.00 H new ATOM 0 HB3 ASP A 84 1.646 4.666 16.214 1.00 0.00 H new ATOM 1196 N ARG A 85 0.120 5.131 13.735 1.00 0.00 N ATOM 1197 CA ARG A 85 -0.211 6.206 12.807 1.00 0.00 C ATOM 1198 C ARG A 85 -0.383 5.667 11.390 1.00 0.00 C ATOM 1199 O ARG A 85 0.238 4.680 10.996 1.00 0.00 O ATOM 1200 CB ARG A 85 0.880 7.279 12.827 1.00 0.00 C ATOM 1201 CG ARG A 85 1.244 7.751 14.225 1.00 0.00 C ATOM 1202 CD ARG A 85 2.673 8.267 14.284 1.00 0.00 C ATOM 1203 NE ARG A 85 3.044 8.700 15.629 1.00 0.00 N ATOM 1204 CZ ARG A 85 4.297 8.918 16.012 1.00 0.00 C ATOM 1205 NH1 ARG A 85 5.295 8.745 15.156 1.00 0.00 N ATOM 1206 NH2 ARG A 85 4.554 9.311 17.253 1.00 0.00 N ATOM 0 H ARG A 85 0.984 4.635 13.516 1.00 0.00 H new ATOM 0 HA ARG A 85 -1.154 6.650 13.125 1.00 0.00 H new ATOM 0 HB2 ARG A 85 1.773 6.886 12.341 1.00 0.00 H new ATOM 0 HB3 ARG A 85 0.547 8.134 12.239 1.00 0.00 H new ATOM 0 HG2 ARG A 85 0.558 8.540 14.534 1.00 0.00 H new ATOM 0 HG3 ARG A 85 1.123 6.929 14.931 1.00 0.00 H new ATOM 0 HD2 ARG A 85 3.355 7.483 13.954 1.00 0.00 H new ATOM 0 HD3 ARG A 85 2.786 9.100 13.591 1.00 0.00 H new ATOM 0 HE ARG A 85 2.300 8.843 16.312 1.00 0.00 H new ATOM 0 HH11 ARG A 85 5.101 8.444 14.201 1.00 0.00 H new ATOM 0 HH12 ARG A 85 6.256 8.913 15.453 1.00 0.00 H new ATOM 0 HH21 ARG A 85 3.789 9.446 17.914 1.00 0.00 H new ATOM 0 HH22 ARG A 85 5.517 9.478 17.546 1.00 0.00 H new ATOM 1220 N PRO A 86 -1.246 6.329 10.606 1.00 0.00 N ATOM 1221 CA PRO A 86 -1.521 5.934 9.221 1.00 0.00 C ATOM 1222 C PRO A 86 -0.334 6.192 8.299 1.00 0.00 C ATOM 1223 O PRO A 86 -0.265 5.654 7.194 1.00 0.00 O ATOM 1224 CB PRO A 86 -2.706 6.819 8.828 1.00 0.00 C ATOM 1225 CG PRO A 86 -2.598 8.012 9.714 1.00 0.00 C ATOM 1226 CD PRO A 86 -2.021 7.514 11.010 1.00 0.00 C ATOM 0 HA PRO A 86 -1.722 4.866 9.134 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -2.658 7.101 7.776 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -3.653 6.301 8.976 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -1.957 8.773 9.268 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -3.574 8.470 9.872 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -1.389 8.265 11.483 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -2.802 7.258 11.726 1.00 0.00 H new ATOM 1234 N VAL A 87 0.600 7.018 8.761 1.00 0.00 N ATOM 1235 CA VAL A 87 1.785 7.346 7.978 1.00 0.00 C ATOM 1236 C VAL A 87 3.002 7.536 8.876 1.00 0.00 C ATOM 1237 O VAL A 87 2.891 7.521 10.101 1.00 0.00 O ATOM 1238 CB VAL A 87 1.572 8.624 7.145 1.00 0.00 C ATOM 1239 CG1 VAL A 87 0.344 8.485 6.258 1.00 0.00 C ATOM 1240 CG2 VAL A 87 1.448 9.837 8.054 1.00 0.00 C ATOM 0 H VAL A 87 0.558 7.472 9.673 1.00 0.00 H new ATOM 0 HA VAL A 87 1.961 6.507 7.305 1.00 0.00 H new ATOM 0 HB VAL A 87 2.441 8.767 6.502 1.00 0.00 H new ATOM 0 HG11 VAL A 87 0.210 9.397 5.677 1.00 0.00 H new ATOM 0 HG12 VAL A 87 0.477 7.641 5.582 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -0.536 8.317 6.879 1.00 0.00 H new ATOM 0 HG21 VAL A 87 1.298 10.731 7.449 1.00 0.00 H new ATOM 0 HG22 VAL A 87 0.598 9.705 8.723 1.00 0.00 H new ATOM 0 HG23 VAL A 87 2.359 9.946 8.642 1.00 0.00 H new ATOM 1250 N GLY A 88 4.166 7.714 8.258 1.00 0.00 N ATOM 1251 CA GLY A 88 5.388 7.904 9.017 1.00 0.00 C ATOM 1252 C GLY A 88 6.375 6.770 8.821 1.00 0.00 C ATOM 1253 O GLY A 88 6.089 5.624 9.165 1.00 0.00 O ATOM 0 H GLY A 88 4.284 7.730 7.245 1.00 0.00 H new ATOM 0 HA2 GLY A 88 5.855 8.843 8.719 1.00 0.00 H new ATOM 0 HA3 GLY A 88 5.145 7.991 10.076 1.00 0.00 H new ATOM 1257 N MET A 89 7.539 7.091 8.265 1.00 0.00 N ATOM 1258 CA MET A 89 8.571 6.089 8.024 1.00 0.00 C ATOM 1259 C MET A 89 8.938 5.365 9.315 1.00 0.00 C ATOM 1260 O MET A 89 8.874 4.137 9.388 1.00 0.00 O ATOM 1261 CB MET A 89 9.815 6.744 7.421 1.00 0.00 C ATOM 1262 CG MET A 89 9.803 6.789 5.901 1.00 0.00 C ATOM 1263 SD MET A 89 10.556 5.330 5.157 1.00 0.00 S ATOM 1264 CE MET A 89 9.109 4.495 4.510 1.00 0.00 C ATOM 0 H MET A 89 7.791 8.035 7.973 1.00 0.00 H new ATOM 0 HA MET A 89 8.176 5.358 7.319 1.00 0.00 H new ATOM 0 HB2 MET A 89 9.903 7.760 7.806 1.00 0.00 H new ATOM 0 HB3 MET A 89 10.699 6.200 7.753 1.00 0.00 H new ATOM 0 HG2 MET A 89 8.774 6.880 5.552 1.00 0.00 H new ATOM 0 HG3 MET A 89 10.334 7.679 5.564 1.00 0.00 H new ATOM 0 HE1 MET A 89 9.416 3.752 3.774 1.00 0.00 H new ATOM 0 HE2 MET A 89 8.579 4.002 5.325 1.00 0.00 H new ATOM 0 HE3 MET A 89 8.450 5.223 4.037 1.00 0.00 H new ATOM 1274 N ASP A 90 9.323 6.131 10.329 1.00 0.00 N ATOM 1275 CA ASP A 90 9.700 5.562 11.618 1.00 0.00 C ATOM 1276 C ASP A 90 8.698 4.498 12.055 1.00 0.00 C ATOM 1277 O ASP A 90 9.067 3.500 12.677 1.00 0.00 O ATOM 1278 CB ASP A 90 9.792 6.660 12.678 1.00 0.00 C ATOM 1279 CG ASP A 90 11.105 7.416 12.617 1.00 0.00 C ATOM 1280 OD1 ASP A 90 12.132 6.855 13.051 1.00 0.00 O ATOM 1281 OD2 ASP A 90 11.105 8.568 12.135 1.00 0.00 O ATOM 0 H ASP A 90 9.382 7.148 10.284 1.00 0.00 H new ATOM 0 HA ASP A 90 10.678 5.092 11.508 1.00 0.00 H new ATOM 0 HB2 ASP A 90 8.967 7.360 12.545 1.00 0.00 H new ATOM 0 HB3 ASP A 90 9.677 6.217 13.667 1.00 0.00 H new ATOM 1286 N THR A 91 7.429 4.717 11.728 1.00 0.00 N ATOM 1287 CA THR A 91 6.373 3.779 12.089 1.00 0.00 C ATOM 1288 C THR A 91 6.380 2.563 11.169 1.00 0.00 C ATOM 1289 O THR A 91 6.375 1.421 11.632 1.00 0.00 O ATOM 1290 CB THR A 91 4.985 4.444 12.030 1.00 0.00 C ATOM 1291 OG1 THR A 91 5.016 5.703 12.714 1.00 0.00 O ATOM 1292 CG2 THR A 91 3.928 3.548 12.656 1.00 0.00 C ATOM 0 H THR A 91 7.107 5.537 11.213 1.00 0.00 H new ATOM 0 HA THR A 91 6.571 3.459 13.112 1.00 0.00 H new ATOM 0 HB THR A 91 4.728 4.605 10.983 1.00 0.00 H new ATOM 0 HG1 THR A 91 4.265 6.257 12.414 1.00 0.00 H new ATOM 0 HG21 THR A 91 2.956 4.039 12.602 1.00 0.00 H new ATOM 0 HG22 THR A 91 3.887 2.602 12.116 1.00 0.00 H new ATOM 0 HG23 THR A 91 4.182 3.359 13.699 1.00 0.00 H new ATOM 1300 N LEU A 92 6.393 2.814 9.865 1.00 0.00 N ATOM 1301 CA LEU A 92 6.402 1.739 8.879 1.00 0.00 C ATOM 1302 C LEU A 92 7.600 0.818 9.088 1.00 0.00 C ATOM 1303 O LEU A 92 7.448 -0.396 9.216 1.00 0.00 O ATOM 1304 CB LEU A 92 6.430 2.318 7.464 1.00 0.00 C ATOM 1305 CG LEU A 92 6.059 1.354 6.336 1.00 0.00 C ATOM 1306 CD1 LEU A 92 5.422 2.107 5.178 1.00 0.00 C ATOM 1307 CD2 LEU A 92 7.285 0.586 5.865 1.00 0.00 C ATOM 0 H LEU A 92 6.398 3.753 9.466 1.00 0.00 H new ATOM 0 HA LEU A 92 5.491 1.154 9.007 1.00 0.00 H new ATOM 0 HB2 LEU A 92 5.748 3.168 7.427 1.00 0.00 H new ATOM 0 HB3 LEU A 92 7.431 2.704 7.271 1.00 0.00 H new ATOM 0 HG LEU A 92 5.333 0.638 6.721 1.00 0.00 H new ATOM 0 HD11 LEU A 92 5.165 1.405 4.385 1.00 0.00 H new ATOM 0 HD12 LEU A 92 4.519 2.610 5.524 1.00 0.00 H new ATOM 0 HD13 LEU A 92 6.125 2.846 4.794 1.00 0.00 H new ATOM 0 HD21 LEU A 92 7.002 -0.095 5.062 1.00 0.00 H new ATOM 0 HD22 LEU A 92 8.035 1.287 5.498 1.00 0.00 H new ATOM 0 HD23 LEU A 92 7.698 0.015 6.696 1.00 0.00 H new ATOM 1319 N ASN A 93 8.792 1.405 9.123 1.00 0.00 N ATOM 1320 CA ASN A 93 10.017 0.638 9.318 1.00 0.00 C ATOM 1321 C ASN A 93 9.942 -0.189 10.598 1.00 0.00 C ATOM 1322 O ASN A 93 10.461 -1.304 10.660 1.00 0.00 O ATOM 1323 CB ASN A 93 11.226 1.573 9.372 1.00 0.00 C ATOM 1324 CG ASN A 93 11.830 1.817 8.002 1.00 0.00 C ATOM 1325 OD1 ASN A 93 12.819 1.187 7.626 1.00 0.00 O ATOM 1326 ND2 ASN A 93 11.236 2.735 7.248 1.00 0.00 N ATOM 0 H ASN A 93 8.936 2.409 9.019 1.00 0.00 H new ATOM 0 HA ASN A 93 10.129 -0.041 8.473 1.00 0.00 H new ATOM 0 HB2 ASN A 93 10.926 2.526 9.809 1.00 0.00 H new ATOM 0 HB3 ASN A 93 11.983 1.146 10.029 1.00 0.00 H new ATOM 0 HD21 ASN A 93 11.597 2.942 6.317 1.00 0.00 H new ATOM 0 HD22 ASN A 93 10.418 3.233 7.600 1.00 0.00 H new ATOM 1333 N SER A 94 9.293 0.364 11.617 1.00 0.00 N ATOM 1334 CA SER A 94 9.153 -0.320 12.897 1.00 0.00 C ATOM 1335 C SER A 94 8.298 -1.576 12.750 1.00 0.00 C ATOM 1336 O SER A 94 8.649 -2.641 13.257 1.00 0.00 O ATOM 1337 CB SER A 94 8.531 0.616 13.934 1.00 0.00 C ATOM 1338 OG SER A 94 9.531 1.290 14.678 1.00 0.00 O ATOM 0 H SER A 94 8.855 1.285 11.581 1.00 0.00 H new ATOM 0 HA SER A 94 10.147 -0.615 13.235 1.00 0.00 H new ATOM 0 HB2 SER A 94 7.892 1.344 13.434 1.00 0.00 H new ATOM 0 HB3 SER A 94 7.895 0.044 14.609 1.00 0.00 H new ATOM 0 HG SER A 94 9.691 2.173 14.285 1.00 0.00 H new ATOM 1344 N ALA A 95 7.175 -1.441 12.054 1.00 0.00 N ATOM 1345 CA ALA A 95 6.270 -2.564 11.838 1.00 0.00 C ATOM 1346 C ALA A 95 6.974 -3.704 11.110 1.00 0.00 C ATOM 1347 O ALA A 95 6.720 -4.877 11.384 1.00 0.00 O ATOM 1348 CB ALA A 95 5.045 -2.112 11.056 1.00 0.00 C ATOM 0 H ALA A 95 6.869 -0.565 11.630 1.00 0.00 H new ATOM 0 HA ALA A 95 5.949 -2.933 12.812 1.00 0.00 H new ATOM 0 HB1 ALA A 95 4.378 -2.960 10.902 1.00 0.00 H new ATOM 0 HB2 ALA A 95 4.522 -1.336 11.615 1.00 0.00 H new ATOM 0 HB3 ALA A 95 5.356 -1.715 10.090 1.00 0.00 H new ATOM 1354 N ILE A 96 7.857 -3.351 10.182 1.00 0.00 N ATOM 1355 CA ILE A 96 8.597 -4.346 9.416 1.00 0.00 C ATOM 1356 C ILE A 96 9.355 -5.297 10.336 1.00 0.00 C ATOM 1357 O ILE A 96 9.216 -6.515 10.235 1.00 0.00 O ATOM 1358 CB ILE A 96 9.595 -3.682 8.448 1.00 0.00 C ATOM 1359 CG1 ILE A 96 8.849 -2.842 7.409 1.00 0.00 C ATOM 1360 CG2 ILE A 96 10.453 -4.738 7.766 1.00 0.00 C ATOM 1361 CD1 ILE A 96 9.765 -2.050 6.502 1.00 0.00 C ATOM 0 H ILE A 96 8.077 -2.384 9.943 1.00 0.00 H new ATOM 0 HA ILE A 96 7.864 -4.910 8.840 1.00 0.00 H new ATOM 0 HB ILE A 96 10.249 -3.023 9.019 1.00 0.00 H new ATOM 0 HG12 ILE A 96 8.228 -3.499 6.800 1.00 0.00 H new ATOM 0 HG13 ILE A 96 8.177 -2.155 7.924 1.00 0.00 H new ATOM 0 HG21 ILE A 96 11.153 -4.254 7.085 1.00 0.00 H new ATOM 0 HG22 ILE A 96 11.008 -5.298 8.519 1.00 0.00 H new ATOM 0 HG23 ILE A 96 9.814 -5.419 7.205 1.00 0.00 H new ATOM 0 HD11 ILE A 96 9.168 -1.479 5.791 1.00 0.00 H new ATOM 0 HD12 ILE A 96 10.368 -1.367 7.100 1.00 0.00 H new ATOM 0 HD13 ILE A 96 10.419 -2.733 5.960 1.00 0.00 H new ATOM 1373 N GLU A 97 10.155 -4.731 11.234 1.00 0.00 N ATOM 1374 CA GLU A 97 10.934 -5.529 12.173 1.00 0.00 C ATOM 1375 C GLU A 97 10.021 -6.371 13.059 1.00 0.00 C ATOM 1376 O GLU A 97 10.296 -7.542 13.318 1.00 0.00 O ATOM 1377 CB GLU A 97 11.812 -4.625 13.040 1.00 0.00 C ATOM 1378 CG GLU A 97 12.853 -3.849 12.251 1.00 0.00 C ATOM 1379 CD GLU A 97 13.777 -4.752 11.458 1.00 0.00 C ATOM 1380 OE1 GLU A 97 14.418 -5.630 12.074 1.00 0.00 O ATOM 1381 OE2 GLU A 97 13.861 -4.582 10.224 1.00 0.00 O ATOM 0 H GLU A 97 10.281 -3.723 11.331 1.00 0.00 H new ATOM 0 HA GLU A 97 11.573 -6.199 11.598 1.00 0.00 H new ATOM 0 HB2 GLU A 97 11.176 -3.921 13.576 1.00 0.00 H new ATOM 0 HB3 GLU A 97 12.317 -5.234 13.790 1.00 0.00 H new ATOM 0 HG2 GLU A 97 12.350 -3.162 11.570 1.00 0.00 H new ATOM 0 HG3 GLU A 97 13.445 -3.242 12.936 1.00 0.00 H new ATOM 1388 N ASN A 98 8.932 -5.765 13.523 1.00 0.00 N ATOM 1389 CA ASN A 98 7.978 -6.458 14.381 1.00 0.00 C ATOM 1390 C ASN A 98 7.653 -7.842 13.827 1.00 0.00 C ATOM 1391 O ASN A 98 7.467 -8.797 14.582 1.00 0.00 O ATOM 1392 CB ASN A 98 6.695 -5.636 14.519 1.00 0.00 C ATOM 1393 CG ASN A 98 6.001 -5.867 15.847 1.00 0.00 C ATOM 1394 OD1 ASN A 98 6.194 -6.898 16.491 1.00 0.00 O ATOM 1395 ND2 ASN A 98 5.187 -4.904 16.264 1.00 0.00 N ATOM 0 H ASN A 98 8.689 -4.796 13.319 1.00 0.00 H new ATOM 0 HA ASN A 98 8.432 -6.578 15.365 1.00 0.00 H new ATOM 0 HB2 ASN A 98 6.932 -4.577 14.415 1.00 0.00 H new ATOM 0 HB3 ASN A 98 6.014 -5.891 13.707 1.00 0.00 H new ATOM 0 HD21 ASN A 98 4.692 -5.003 17.151 1.00 0.00 H new ATOM 0 HD22 ASN A 98 5.057 -4.066 15.698 1.00 0.00 H new ATOM 1402 N LEU A 99 7.587 -7.942 12.504 1.00 0.00 N ATOM 1403 CA LEU A 99 7.285 -9.210 11.848 1.00 0.00 C ATOM 1404 C LEU A 99 8.555 -10.025 11.627 1.00 0.00 C ATOM 1405 O LEU A 99 8.606 -11.212 11.945 1.00 0.00 O ATOM 1406 CB LEU A 99 6.586 -8.960 10.510 1.00 0.00 C ATOM 1407 CG LEU A 99 5.317 -8.109 10.565 1.00 0.00 C ATOM 1408 CD1 LEU A 99 4.910 -7.666 9.168 1.00 0.00 C ATOM 1409 CD2 LEU A 99 4.186 -8.879 11.232 1.00 0.00 C ATOM 0 H LEU A 99 7.738 -7.162 11.865 1.00 0.00 H new ATOM 0 HA LEU A 99 6.620 -9.778 12.498 1.00 0.00 H new ATOM 0 HB2 LEU A 99 7.295 -8.477 9.837 1.00 0.00 H new ATOM 0 HB3 LEU A 99 6.334 -9.924 10.069 1.00 0.00 H new ATOM 0 HG LEU A 99 5.525 -7.220 11.160 1.00 0.00 H new ATOM 0 HD11 LEU A 99 4.005 -7.061 9.227 1.00 0.00 H new ATOM 0 HD12 LEU A 99 5.712 -7.076 8.725 1.00 0.00 H new ATOM 0 HD13 LEU A 99 4.721 -8.543 8.549 1.00 0.00 H new ATOM 0 HD21 LEU A 99 3.291 -8.258 11.262 1.00 0.00 H new ATOM 0 HD22 LEU A 99 3.979 -9.786 10.664 1.00 0.00 H new ATOM 0 HD23 LEU A 99 4.477 -9.146 12.248 1.00 0.00 H new ATOM 1421 N MET A 100 9.579 -9.377 11.081 1.00 0.00 N ATOM 1422 CA MET A 100 10.851 -10.042 10.820 1.00 0.00 C ATOM 1423 C MET A 100 11.213 -10.989 11.960 1.00 0.00 C ATOM 1424 O MET A 100 11.808 -12.044 11.739 1.00 0.00 O ATOM 1425 CB MET A 100 11.962 -9.007 10.629 1.00 0.00 C ATOM 1426 CG MET A 100 11.950 -8.349 9.259 1.00 0.00 C ATOM 1427 SD MET A 100 12.931 -9.253 8.046 1.00 0.00 S ATOM 1428 CE MET A 100 12.726 -8.214 6.602 1.00 0.00 C ATOM 0 H MET A 100 9.553 -8.394 10.811 1.00 0.00 H new ATOM 0 HA MET A 100 10.747 -10.626 9.905 1.00 0.00 H new ATOM 0 HB2 MET A 100 11.865 -8.237 11.394 1.00 0.00 H new ATOM 0 HB3 MET A 100 12.927 -9.489 10.783 1.00 0.00 H new ATOM 0 HG2 MET A 100 10.922 -8.274 8.905 1.00 0.00 H new ATOM 0 HG3 MET A 100 12.333 -7.332 9.345 1.00 0.00 H new ATOM 0 HE1 MET A 100 12.411 -8.825 5.756 1.00 0.00 H new ATOM 0 HE2 MET A 100 11.970 -7.456 6.804 1.00 0.00 H new ATOM 0 HE3 MET A 100 13.673 -7.728 6.366 1.00 0.00 H new ATOM 1438 N THR A 101 10.852 -10.604 13.180 1.00 0.00 N ATOM 1439 CA THR A 101 11.140 -11.418 14.354 1.00 0.00 C ATOM 1440 C THR A 101 10.038 -12.443 14.597 1.00 0.00 C ATOM 1441 O THR A 101 10.310 -13.588 14.957 1.00 0.00 O ATOM 1442 CB THR A 101 11.303 -10.548 15.615 1.00 0.00 C ATOM 1443 OG1 THR A 101 11.663 -11.367 16.733 1.00 0.00 O ATOM 1444 CG2 THR A 101 10.017 -9.796 15.924 1.00 0.00 C ATOM 0 H THR A 101 10.360 -9.734 13.381 1.00 0.00 H new ATOM 0 HA THR A 101 12.078 -11.937 14.156 1.00 0.00 H new ATOM 0 HB THR A 101 12.094 -9.822 15.428 1.00 0.00 H new ATOM 0 HG1 THR A 101 11.766 -10.806 17.530 1.00 0.00 H new ATOM 0 HG21 THR A 101 10.157 -9.189 16.818 1.00 0.00 H new ATOM 0 HG22 THR A 101 9.762 -9.151 15.083 1.00 0.00 H new ATOM 0 HG23 THR A 101 9.210 -10.509 16.092 1.00 0.00 H new ATOM 1452 N SER A 102 8.792 -12.024 14.397 1.00 0.00 N ATOM 1453 CA SER A 102 7.648 -12.906 14.598 1.00 0.00 C ATOM 1454 C SER A 102 7.747 -14.137 13.702 1.00 0.00 C ATOM 1455 O SER A 102 7.327 -15.229 14.081 1.00 0.00 O ATOM 1456 CB SER A 102 6.345 -12.157 14.313 1.00 0.00 C ATOM 1457 OG SER A 102 6.168 -11.953 12.921 1.00 0.00 O ATOM 0 H SER A 102 8.549 -11.080 14.096 1.00 0.00 H new ATOM 0 HA SER A 102 7.651 -13.234 15.637 1.00 0.00 H new ATOM 0 HB2 SER A 102 5.502 -12.722 14.711 1.00 0.00 H new ATOM 0 HB3 SER A 102 6.355 -11.196 14.826 1.00 0.00 H new ATOM 0 HG SER A 102 7.040 -11.807 12.498 1.00 0.00 H new ATOM 1463 N SER A 103 8.306 -13.950 12.510 1.00 0.00 N ATOM 1464 CA SER A 103 8.457 -15.044 11.558 1.00 0.00 C ATOM 1465 C SER A 103 9.798 -14.952 10.834 1.00 0.00 C ATOM 1466 O SER A 103 10.376 -13.873 10.711 1.00 0.00 O ATOM 1467 CB SER A 103 7.314 -15.025 10.541 1.00 0.00 C ATOM 1468 OG SER A 103 6.102 -15.464 11.129 1.00 0.00 O ATOM 0 H SER A 103 8.661 -13.052 12.181 1.00 0.00 H new ATOM 0 HA SER A 103 8.425 -15.982 12.112 1.00 0.00 H new ATOM 0 HB2 SER A 103 7.188 -14.015 10.150 1.00 0.00 H new ATOM 0 HB3 SER A 103 7.565 -15.665 9.695 1.00 0.00 H new ATOM 0 HG SER A 103 5.387 -15.441 10.460 1.00 0.00 H new ATOM 1474 N SER A 104 10.285 -16.093 10.357 1.00 0.00 N ATOM 1475 CA SER A 104 11.558 -16.144 9.649 1.00 0.00 C ATOM 1476 C SER A 104 11.374 -15.801 8.174 1.00 0.00 C ATOM 1477 O SER A 104 10.270 -15.893 7.636 1.00 0.00 O ATOM 1478 CB SER A 104 12.188 -17.532 9.787 1.00 0.00 C ATOM 1479 OG SER A 104 12.361 -17.880 11.150 1.00 0.00 O ATOM 0 H SER A 104 9.817 -16.995 10.448 1.00 0.00 H new ATOM 0 HA SER A 104 12.223 -15.405 10.096 1.00 0.00 H new ATOM 0 HB2 SER A 104 11.556 -18.272 9.297 1.00 0.00 H new ATOM 0 HB3 SER A 104 13.152 -17.550 9.279 1.00 0.00 H new ATOM 0 HG SER A 104 12.763 -18.771 11.211 1.00 0.00 H new ATOM 1485 N LYS A 105 12.463 -15.405 7.524 1.00 0.00 N ATOM 1486 CA LYS A 105 12.425 -15.049 6.111 1.00 0.00 C ATOM 1487 C LYS A 105 11.727 -16.133 5.295 1.00 0.00 C ATOM 1488 O LYS A 105 10.890 -15.838 4.444 1.00 0.00 O ATOM 1489 CB LYS A 105 13.843 -14.830 5.580 1.00 0.00 C ATOM 1490 CG LYS A 105 13.885 -14.294 4.160 1.00 0.00 C ATOM 1491 CD LYS A 105 15.249 -13.716 3.822 1.00 0.00 C ATOM 1492 CE LYS A 105 15.295 -13.192 2.395 1.00 0.00 C ATOM 1493 NZ LYS A 105 16.583 -12.506 2.097 1.00 0.00 N ATOM 0 H LYS A 105 13.384 -15.323 7.954 1.00 0.00 H new ATOM 0 HA LYS A 105 11.859 -14.123 6.011 1.00 0.00 H new ATOM 0 HB2 LYS A 105 14.365 -14.134 6.237 1.00 0.00 H new ATOM 0 HB3 LYS A 105 14.386 -15.774 5.619 1.00 0.00 H new ATOM 0 HG2 LYS A 105 13.645 -15.095 3.461 1.00 0.00 H new ATOM 0 HG3 LYS A 105 13.122 -13.525 4.038 1.00 0.00 H new ATOM 0 HD2 LYS A 105 15.485 -12.908 4.515 1.00 0.00 H new ATOM 0 HD3 LYS A 105 16.013 -14.482 3.954 1.00 0.00 H new ATOM 0 HE2 LYS A 105 15.155 -14.020 1.700 1.00 0.00 H new ATOM 0 HE3 LYS A 105 14.469 -12.499 2.236 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 16.403 -11.501 1.897 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 17.218 -12.588 2.917 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 17.029 -12.949 1.268 1.00 0.00 H new ATOM 1507 N GLU A 106 12.078 -17.387 5.564 1.00 0.00 N ATOM 1508 CA GLU A 106 11.484 -18.514 4.854 1.00 0.00 C ATOM 1509 C GLU A 106 10.036 -18.727 5.287 1.00 0.00 C ATOM 1510 O GLU A 106 9.152 -18.936 4.456 1.00 0.00 O ATOM 1511 CB GLU A 106 12.295 -19.787 5.104 1.00 0.00 C ATOM 1512 CG GLU A 106 13.708 -19.727 4.549 1.00 0.00 C ATOM 1513 CD GLU A 106 14.259 -21.097 4.204 1.00 0.00 C ATOM 1514 OE1 GLU A 106 13.954 -21.598 3.102 1.00 0.00 O ATOM 1515 OE2 GLU A 106 14.994 -21.668 5.037 1.00 0.00 O ATOM 0 H GLU A 106 12.769 -17.648 6.267 1.00 0.00 H new ATOM 0 HA GLU A 106 11.497 -18.287 3.788 1.00 0.00 H new ATOM 0 HB2 GLU A 106 12.343 -19.972 6.177 1.00 0.00 H new ATOM 0 HB3 GLU A 106 11.774 -20.634 4.657 1.00 0.00 H new ATOM 0 HG2 GLU A 106 13.717 -19.101 3.657 1.00 0.00 H new ATOM 0 HG3 GLU A 106 14.361 -19.250 5.280 1.00 0.00 H new ATOM 1522 N ASP A 107 9.802 -18.674 6.594 1.00 0.00 N ATOM 1523 CA ASP A 107 8.462 -18.861 7.138 1.00 0.00 C ATOM 1524 C ASP A 107 7.425 -18.127 6.293 1.00 0.00 C ATOM 1525 O ASP A 107 6.329 -18.637 6.058 1.00 0.00 O ATOM 1526 CB ASP A 107 8.402 -18.366 8.584 1.00 0.00 C ATOM 1527 CG ASP A 107 7.314 -19.051 9.387 1.00 0.00 C ATOM 1528 OD1 ASP A 107 7.553 -20.177 9.871 1.00 0.00 O ATOM 1529 OD2 ASP A 107 6.223 -18.462 9.531 1.00 0.00 O ATOM 0 H ASP A 107 10.522 -18.503 7.296 1.00 0.00 H new ATOM 0 HA ASP A 107 8.234 -19.927 7.117 1.00 0.00 H new ATOM 0 HB2 ASP A 107 9.366 -18.537 9.064 1.00 0.00 H new ATOM 0 HB3 ASP A 107 8.230 -17.290 8.589 1.00 0.00 H new ATOM 1534 N TRP A 108 7.778 -16.930 5.841 1.00 0.00 N ATOM 1535 CA TRP A 108 6.876 -16.126 5.023 1.00 0.00 C ATOM 1536 C TRP A 108 6.483 -16.871 3.753 1.00 0.00 C ATOM 1537 O TRP A 108 7.326 -17.233 2.931 1.00 0.00 O ATOM 1538 CB TRP A 108 7.534 -14.792 4.664 1.00 0.00 C ATOM 1539 CG TRP A 108 8.339 -14.206 5.784 1.00 0.00 C ATOM 1540 CD1 TRP A 108 8.114 -14.359 7.123 1.00 0.00 C ATOM 1541 CD2 TRP A 108 9.496 -13.372 5.663 1.00 0.00 C ATOM 1542 NE1 TRP A 108 9.062 -13.671 7.840 1.00 0.00 N ATOM 1543 CE2 TRP A 108 9.922 -13.057 6.968 1.00 0.00 C ATOM 1544 CE3 TRP A 108 10.215 -12.862 4.578 1.00 0.00 C ATOM 1545 CZ2 TRP A 108 11.033 -12.255 7.215 1.00 0.00 C ATOM 1546 CZ3 TRP A 108 11.317 -12.065 4.825 1.00 0.00 C ATOM 1547 CH2 TRP A 108 11.718 -11.769 6.135 1.00 0.00 C ATOM 0 H TRP A 108 8.681 -16.494 6.026 1.00 0.00 H new ATOM 0 HA TRP A 108 5.973 -15.934 5.603 1.00 0.00 H new ATOM 0 HB2 TRP A 108 8.180 -14.935 3.798 1.00 0.00 H new ATOM 0 HB3 TRP A 108 6.761 -14.081 4.371 1.00 0.00 H new ATOM 0 HD1 TRP A 108 7.309 -14.936 7.554 1.00 0.00 H new ATOM 0 HE1 TRP A 108 9.117 -13.625 8.857 1.00 0.00 H new ATOM 0 HE3 TRP A 108 9.915 -13.087 3.565 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 11.343 -12.025 8.224 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 11.879 -11.664 3.994 1.00 0.00 H new ATOM 0 HH2 TRP A 108 12.585 -11.145 6.295 1.00 0.00 H new ATOM 1558 N PRO A 109 5.174 -17.108 3.585 1.00 0.00 N ATOM 1559 CA PRO A 109 4.640 -17.812 2.416 1.00 0.00 C ATOM 1560 C PRO A 109 4.754 -16.986 1.139 1.00 0.00 C ATOM 1561 O PRO A 109 4.305 -15.841 1.088 1.00 0.00 O ATOM 1562 CB PRO A 109 3.170 -18.037 2.778 1.00 0.00 C ATOM 1563 CG PRO A 109 2.849 -16.954 3.750 1.00 0.00 C ATOM 1564 CD PRO A 109 4.113 -16.706 4.524 1.00 0.00 C ATOM 0 HA PRO A 109 5.188 -18.731 2.209 1.00 0.00 H new ATOM 0 HB2 PRO A 109 2.532 -17.979 1.896 1.00 0.00 H new ATOM 0 HB3 PRO A 109 3.017 -19.022 3.218 1.00 0.00 H new ATOM 0 HG2 PRO A 109 2.523 -16.051 3.234 1.00 0.00 H new ATOM 0 HG3 PRO A 109 2.037 -17.253 4.413 1.00 0.00 H new ATOM 0 HD2 PRO A 109 4.208 -15.659 4.813 1.00 0.00 H new ATOM 0 HD3 PRO A 109 4.144 -17.294 5.441 1.00 0.00 H new ATOM 1572 N SER A 110 5.356 -17.574 0.111 1.00 0.00 N ATOM 1573 CA SER A 110 5.532 -16.890 -1.165 1.00 0.00 C ATOM 1574 C SER A 110 4.184 -16.494 -1.759 1.00 0.00 C ATOM 1575 O SER A 110 3.355 -17.349 -2.073 1.00 0.00 O ATOM 1576 CB SER A 110 6.293 -17.784 -2.146 1.00 0.00 C ATOM 1577 OG SER A 110 7.673 -17.832 -1.828 1.00 0.00 O ATOM 0 H SER A 110 5.730 -18.523 0.136 1.00 0.00 H new ATOM 0 HA SER A 110 6.111 -15.984 -0.987 1.00 0.00 H new ATOM 0 HB2 SER A 110 5.876 -18.791 -2.123 1.00 0.00 H new ATOM 0 HB3 SER A 110 6.163 -17.408 -3.161 1.00 0.00 H new ATOM 0 HG SER A 110 8.136 -18.411 -2.469 1.00 0.00 H new ATOM 1583 N VAL A 111 3.971 -15.191 -1.912 1.00 0.00 N ATOM 1584 CA VAL A 111 2.724 -14.680 -2.470 1.00 0.00 C ATOM 1585 C VAL A 111 2.978 -13.889 -3.748 1.00 0.00 C ATOM 1586 O VAL A 111 4.120 -13.731 -4.176 1.00 0.00 O ATOM 1587 CB VAL A 111 1.985 -13.781 -1.461 1.00 0.00 C ATOM 1588 CG1 VAL A 111 1.579 -14.580 -0.232 1.00 0.00 C ATOM 1589 CG2 VAL A 111 2.851 -12.592 -1.073 1.00 0.00 C ATOM 0 H VAL A 111 4.646 -14.470 -1.657 1.00 0.00 H new ATOM 0 HA VAL A 111 2.101 -15.545 -2.699 1.00 0.00 H new ATOM 0 HB VAL A 111 1.079 -13.402 -1.934 1.00 0.00 H new ATOM 0 HG11 VAL A 111 1.058 -13.929 0.470 1.00 0.00 H new ATOM 0 HG12 VAL A 111 0.919 -15.395 -0.529 1.00 0.00 H new ATOM 0 HG13 VAL A 111 2.469 -14.990 0.246 1.00 0.00 H new ATOM 0 HG21 VAL A 111 2.313 -11.968 -0.360 1.00 0.00 H new ATOM 0 HG22 VAL A 111 3.776 -12.948 -0.619 1.00 0.00 H new ATOM 0 HG23 VAL A 111 3.086 -12.007 -1.962 1.00 0.00 H new ATOM 1599 N ASN A 112 1.903 -13.394 -4.354 1.00 0.00 N ATOM 1600 CA ASN A 112 2.009 -12.618 -5.585 1.00 0.00 C ATOM 1601 C ASN A 112 1.205 -11.325 -5.484 1.00 0.00 C ATOM 1602 O ASN A 112 0.112 -11.305 -4.919 1.00 0.00 O ATOM 1603 CB ASN A 112 1.520 -13.444 -6.776 1.00 0.00 C ATOM 1604 CG ASN A 112 2.531 -14.487 -7.211 1.00 0.00 C ATOM 1605 OD1 ASN A 112 3.735 -14.232 -7.225 1.00 0.00 O ATOM 1606 ND2 ASN A 112 2.045 -15.670 -7.569 1.00 0.00 N ATOM 0 H ASN A 112 0.949 -13.516 -4.013 1.00 0.00 H new ATOM 0 HA ASN A 112 3.058 -12.362 -5.735 1.00 0.00 H new ATOM 0 HB2 ASN A 112 0.584 -13.937 -6.513 1.00 0.00 H new ATOM 0 HB3 ASN A 112 1.306 -12.779 -7.612 1.00 0.00 H new ATOM 0 HD21 ASN A 112 2.678 -16.411 -7.871 1.00 0.00 H new ATOM 0 HD22 ASN A 112 1.039 -15.838 -7.542 1.00 0.00 H new ATOM 1613 N MET A 113 1.756 -10.249 -6.035 1.00 0.00 N ATOM 1614 CA MET A 113 1.089 -8.952 -6.008 1.00 0.00 C ATOM 1615 C MET A 113 0.276 -8.732 -7.281 1.00 0.00 C ATOM 1616 O MET A 113 0.835 -8.508 -8.354 1.00 0.00 O ATOM 1617 CB MET A 113 2.116 -7.830 -5.846 1.00 0.00 C ATOM 1618 CG MET A 113 1.544 -6.568 -5.221 1.00 0.00 C ATOM 1619 SD MET A 113 1.365 -6.697 -3.432 1.00 0.00 S ATOM 1620 CE MET A 113 3.076 -6.593 -2.913 1.00 0.00 C ATOM 0 H MET A 113 2.661 -10.249 -6.505 1.00 0.00 H new ATOM 0 HA MET A 113 0.409 -8.939 -5.156 1.00 0.00 H new ATOM 0 HB2 MET A 113 2.940 -8.189 -5.230 1.00 0.00 H new ATOM 0 HB3 MET A 113 2.532 -7.585 -6.823 1.00 0.00 H new ATOM 0 HG2 MET A 113 2.193 -5.724 -5.457 1.00 0.00 H new ATOM 0 HG3 MET A 113 0.571 -6.356 -5.665 1.00 0.00 H new ATOM 0 HE1 MET A 113 3.252 -7.295 -2.098 1.00 0.00 H new ATOM 0 HE2 MET A 113 3.726 -6.840 -3.752 1.00 0.00 H new ATOM 0 HE3 MET A 113 3.292 -5.580 -2.573 1.00 0.00 H new ATOM 1630 N ASN A 114 -1.045 -8.799 -7.152 1.00 0.00 N ATOM 1631 CA ASN A 114 -1.934 -8.608 -8.292 1.00 0.00 C ATOM 1632 C ASN A 114 -2.400 -7.158 -8.382 1.00 0.00 C ATOM 1633 O ASN A 114 -3.334 -6.751 -7.690 1.00 0.00 O ATOM 1634 CB ASN A 114 -3.144 -9.538 -8.184 1.00 0.00 C ATOM 1635 CG ASN A 114 -3.699 -9.925 -9.540 1.00 0.00 C ATOM 1636 OD1 ASN A 114 -2.963 -10.012 -10.523 1.00 0.00 O ATOM 1637 ND2 ASN A 114 -5.005 -10.161 -9.600 1.00 0.00 N ATOM 0 H ASN A 114 -1.523 -8.984 -6.270 1.00 0.00 H new ATOM 0 HA ASN A 114 -1.378 -8.850 -9.198 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -2.859 -10.439 -7.641 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -3.924 -9.048 -7.602 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -5.435 -10.426 -10.486 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -5.578 -10.077 -8.760 1.00 0.00 H new ATOM 1644 N VAL A 115 -1.744 -6.383 -9.239 1.00 0.00 N ATOM 1645 CA VAL A 115 -2.091 -4.979 -9.421 1.00 0.00 C ATOM 1646 C VAL A 115 -2.867 -4.768 -10.717 1.00 0.00 C ATOM 1647 O VAL A 115 -2.316 -4.899 -11.810 1.00 0.00 O ATOM 1648 CB VAL A 115 -0.835 -4.087 -9.437 1.00 0.00 C ATOM 1649 CG1 VAL A 115 -1.214 -2.635 -9.688 1.00 0.00 C ATOM 1650 CG2 VAL A 115 -0.066 -4.228 -8.132 1.00 0.00 C ATOM 0 H VAL A 115 -0.969 -6.704 -9.819 1.00 0.00 H new ATOM 0 HA VAL A 115 -2.718 -4.696 -8.575 1.00 0.00 H new ATOM 0 HB VAL A 115 -0.188 -4.414 -10.251 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -0.314 -2.020 -9.696 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -1.719 -2.552 -10.651 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -1.881 -2.291 -8.898 1.00 0.00 H new ATOM 0 HG21 VAL A 115 0.818 -3.591 -8.160 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -0.703 -3.928 -7.300 1.00 0.00 H new ATOM 0 HG23 VAL A 115 0.239 -5.266 -8.000 1.00 0.00 H new ATOM 1660 N ALA A 116 -4.148 -4.440 -10.587 1.00 0.00 N ATOM 1661 CA ALA A 116 -4.999 -4.209 -11.747 1.00 0.00 C ATOM 1662 C ALA A 116 -6.129 -3.241 -11.415 1.00 0.00 C ATOM 1663 O ALA A 116 -6.787 -3.370 -10.382 1.00 0.00 O ATOM 1664 CB ALA A 116 -5.563 -5.526 -12.259 1.00 0.00 C ATOM 0 H ALA A 116 -4.619 -4.328 -9.689 1.00 0.00 H new ATOM 0 HA ALA A 116 -4.389 -3.759 -12.530 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -6.197 -5.338 -13.126 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -4.744 -6.186 -12.545 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -6.153 -5.999 -11.474 1.00 0.00 H new ATOM 1670 N ASP A 117 -6.349 -2.270 -12.295 1.00 0.00 N ATOM 1671 CA ASP A 117 -7.401 -1.280 -12.095 1.00 0.00 C ATOM 1672 C ASP A 117 -7.228 -0.566 -10.758 1.00 0.00 C ATOM 1673 O ASP A 117 -8.192 -0.366 -10.021 1.00 0.00 O ATOM 1674 CB ASP A 117 -8.776 -1.946 -12.157 1.00 0.00 C ATOM 1675 CG ASP A 117 -9.888 -0.953 -12.438 1.00 0.00 C ATOM 1676 OD1 ASP A 117 -10.003 0.036 -11.686 1.00 0.00 O ATOM 1677 OD2 ASP A 117 -10.642 -1.167 -13.411 1.00 0.00 O ATOM 0 H ASP A 117 -5.813 -2.147 -13.154 1.00 0.00 H new ATOM 0 HA ASP A 117 -7.327 -0.541 -12.893 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -8.771 -2.711 -12.933 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -8.975 -2.452 -11.212 1.00 0.00 H new ATOM 1682 N ALA A 118 -5.991 -0.187 -10.451 1.00 0.00 N ATOM 1683 CA ALA A 118 -5.692 0.505 -9.204 1.00 0.00 C ATOM 1684 C ALA A 118 -6.147 -0.313 -8.000 1.00 0.00 C ATOM 1685 O ALA A 118 -6.706 0.227 -7.044 1.00 0.00 O ATOM 1686 CB ALA A 118 -6.349 1.877 -9.190 1.00 0.00 C ATOM 0 H ALA A 118 -5.181 -0.348 -11.049 1.00 0.00 H new ATOM 0 HA ALA A 118 -4.611 0.631 -9.138 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -6.117 2.382 -8.252 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -5.973 2.469 -10.024 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -7.429 1.764 -9.284 1.00 0.00 H new ATOM 1692 N THR A 119 -5.904 -1.619 -8.051 1.00 0.00 N ATOM 1693 CA THR A 119 -6.290 -2.511 -6.966 1.00 0.00 C ATOM 1694 C THR A 119 -5.159 -3.471 -6.614 1.00 0.00 C ATOM 1695 O THR A 119 -4.785 -4.326 -7.416 1.00 0.00 O ATOM 1696 CB THR A 119 -7.546 -3.327 -7.329 1.00 0.00 C ATOM 1697 OG1 THR A 119 -8.615 -2.446 -7.689 1.00 0.00 O ATOM 1698 CG2 THR A 119 -7.975 -4.206 -6.164 1.00 0.00 C ATOM 0 H THR A 119 -5.441 -2.082 -8.833 1.00 0.00 H new ATOM 0 HA THR A 119 -6.511 -1.882 -6.104 1.00 0.00 H new ATOM 0 HB THR A 119 -7.304 -3.968 -8.177 1.00 0.00 H new ATOM 0 HG1 THR A 119 -8.362 -1.932 -8.484 1.00 0.00 H new ATOM 0 HG21 THR A 119 -8.863 -4.772 -6.443 1.00 0.00 H new ATOM 0 HG22 THR A 119 -7.169 -4.896 -5.912 1.00 0.00 H new ATOM 0 HG23 THR A 119 -8.200 -3.581 -5.300 1.00 0.00 H new ATOM 1706 N VAL A 120 -4.618 -3.323 -5.409 1.00 0.00 N ATOM 1707 CA VAL A 120 -3.529 -4.178 -4.950 1.00 0.00 C ATOM 1708 C VAL A 120 -4.064 -5.391 -4.197 1.00 0.00 C ATOM 1709 O VAL A 120 -4.454 -5.291 -3.033 1.00 0.00 O ATOM 1710 CB VAL A 120 -2.557 -3.408 -4.037 1.00 0.00 C ATOM 1711 CG1 VAL A 120 -1.488 -4.340 -3.487 1.00 0.00 C ATOM 1712 CG2 VAL A 120 -1.927 -2.246 -4.789 1.00 0.00 C ATOM 0 H VAL A 120 -4.916 -2.619 -4.733 1.00 0.00 H new ATOM 0 HA VAL A 120 -2.993 -4.512 -5.838 1.00 0.00 H new ATOM 0 HB VAL A 120 -3.120 -3.004 -3.196 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -0.811 -3.778 -2.844 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -1.960 -5.135 -2.909 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -0.926 -4.776 -4.313 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -1.243 -1.713 -4.128 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -1.378 -2.625 -5.651 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -2.708 -1.566 -5.128 1.00 0.00 H new ATOM 1722 N THR A 121 -4.079 -6.539 -4.868 1.00 0.00 N ATOM 1723 CA THR A 121 -4.566 -7.772 -4.263 1.00 0.00 C ATOM 1724 C THR A 121 -3.460 -8.818 -4.181 1.00 0.00 C ATOM 1725 O THR A 121 -2.903 -9.229 -5.199 1.00 0.00 O ATOM 1726 CB THR A 121 -5.751 -8.356 -5.055 1.00 0.00 C ATOM 1727 OG1 THR A 121 -6.759 -7.356 -5.236 1.00 0.00 O ATOM 1728 CG2 THR A 121 -6.344 -9.557 -4.334 1.00 0.00 C ATOM 0 H THR A 121 -3.759 -6.640 -5.831 1.00 0.00 H new ATOM 0 HA THR A 121 -4.900 -7.520 -3.256 1.00 0.00 H new ATOM 0 HB THR A 121 -5.384 -8.682 -6.028 1.00 0.00 H new ATOM 0 HG1 THR A 121 -7.508 -7.734 -5.742 1.00 0.00 H new ATOM 0 HG21 THR A 121 -7.179 -9.952 -4.912 1.00 0.00 H new ATOM 0 HG22 THR A 121 -5.582 -10.328 -4.224 1.00 0.00 H new ATOM 0 HG23 THR A 121 -6.697 -9.252 -3.349 1.00 0.00 H new ATOM 1736 N VAL A 122 -3.146 -9.246 -2.962 1.00 0.00 N ATOM 1737 CA VAL A 122 -2.108 -10.246 -2.746 1.00 0.00 C ATOM 1738 C VAL A 122 -2.651 -11.656 -2.949 1.00 0.00 C ATOM 1739 O VAL A 122 -3.263 -12.231 -2.049 1.00 0.00 O ATOM 1740 CB VAL A 122 -1.508 -10.137 -1.332 1.00 0.00 C ATOM 1741 CG1 VAL A 122 -0.480 -11.234 -1.101 1.00 0.00 C ATOM 1742 CG2 VAL A 122 -0.891 -8.763 -1.119 1.00 0.00 C ATOM 0 H VAL A 122 -3.596 -8.915 -2.109 1.00 0.00 H new ATOM 0 HA VAL A 122 -1.326 -10.052 -3.480 1.00 0.00 H new ATOM 0 HB VAL A 122 -2.310 -10.266 -0.606 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -0.067 -11.140 -0.097 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -0.957 -12.208 -1.208 1.00 0.00 H new ATOM 0 HG13 VAL A 122 0.322 -11.141 -1.833 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -0.472 -8.704 -0.114 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -0.101 -8.602 -1.852 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -1.658 -7.997 -1.238 1.00 0.00 H new ATOM 1752 N ILE A 123 -2.424 -12.206 -4.137 1.00 0.00 N ATOM 1753 CA ILE A 123 -2.890 -13.550 -4.457 1.00 0.00 C ATOM 1754 C ILE A 123 -1.810 -14.588 -4.175 1.00 0.00 C ATOM 1755 O ILE A 123 -0.652 -14.413 -4.555 1.00 0.00 O ATOM 1756 CB ILE A 123 -3.320 -13.660 -5.932 1.00 0.00 C ATOM 1757 CG1 ILE A 123 -4.205 -12.473 -6.318 1.00 0.00 C ATOM 1758 CG2 ILE A 123 -4.049 -14.973 -6.174 1.00 0.00 C ATOM 1759 CD1 ILE A 123 -5.565 -12.494 -5.656 1.00 0.00 C ATOM 0 H ILE A 123 -1.921 -11.742 -4.893 1.00 0.00 H new ATOM 0 HA ILE A 123 -3.753 -13.745 -3.820 1.00 0.00 H new ATOM 0 HB ILE A 123 -2.428 -13.642 -6.558 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -3.694 -11.548 -6.052 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -4.336 -12.465 -7.400 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -4.347 -15.036 -7.221 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -3.388 -15.806 -5.934 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -4.935 -15.019 -5.541 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -6.138 -11.624 -5.975 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -6.095 -13.402 -5.942 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -5.443 -12.471 -4.573 1.00 0.00 H new ATOM 1771 N SER A 124 -2.197 -15.671 -3.507 1.00 0.00 N ATOM 1772 CA SER A 124 -1.261 -16.738 -3.172 1.00 0.00 C ATOM 1773 C SER A 124 -0.621 -17.315 -4.432 1.00 0.00 C ATOM 1774 O SER A 124 -1.245 -17.360 -5.492 1.00 0.00 O ATOM 1775 CB SER A 124 -1.974 -17.845 -2.395 1.00 0.00 C ATOM 1776 OG SER A 124 -1.175 -19.013 -2.322 1.00 0.00 O ATOM 0 H SER A 124 -3.152 -15.832 -3.187 1.00 0.00 H new ATOM 0 HA SER A 124 -0.474 -16.315 -2.547 1.00 0.00 H new ATOM 0 HB2 SER A 124 -2.206 -17.496 -1.389 1.00 0.00 H new ATOM 0 HB3 SER A 124 -2.923 -18.079 -2.878 1.00 0.00 H new ATOM 0 HG SER A 124 -1.653 -19.705 -1.819 1.00 0.00 H new ATOM 1782 N GLU A 125 0.627 -17.754 -4.306 1.00 0.00 N ATOM 1783 CA GLU A 125 1.351 -18.328 -5.434 1.00 0.00 C ATOM 1784 C GLU A 125 0.644 -19.574 -5.958 1.00 0.00 C ATOM 1785 O GLU A 125 0.317 -19.665 -7.142 1.00 0.00 O ATOM 1786 CB GLU A 125 2.784 -18.676 -5.025 1.00 0.00 C ATOM 1787 CG GLU A 125 3.760 -18.701 -6.188 1.00 0.00 C ATOM 1788 CD GLU A 125 5.206 -18.618 -5.739 1.00 0.00 C ATOM 1789 OE1 GLU A 125 5.631 -19.481 -4.943 1.00 0.00 O ATOM 1790 OE2 GLU A 125 5.913 -17.689 -6.184 1.00 0.00 O ATOM 0 H GLU A 125 1.157 -17.723 -3.435 1.00 0.00 H new ATOM 0 HA GLU A 125 1.378 -17.585 -6.231 1.00 0.00 H new ATOM 0 HB2 GLU A 125 3.129 -17.951 -4.288 1.00 0.00 H new ATOM 0 HB3 GLU A 125 2.787 -19.651 -4.538 1.00 0.00 H new ATOM 0 HG2 GLU A 125 3.613 -19.617 -6.761 1.00 0.00 H new ATOM 0 HG3 GLU A 125 3.543 -17.868 -6.857 1.00 0.00 H new ATOM 1797 N LYS A 126 0.410 -20.533 -5.069 1.00 0.00 N ATOM 1798 CA LYS A 126 -0.260 -21.774 -5.439 1.00 0.00 C ATOM 1799 C LYS A 126 -1.731 -21.525 -5.756 1.00 0.00 C ATOM 1800 O LYS A 126 -2.176 -21.733 -6.884 1.00 0.00 O ATOM 1801 CB LYS A 126 -0.136 -22.800 -4.311 1.00 0.00 C ATOM 1802 CG LYS A 126 1.248 -23.414 -4.196 1.00 0.00 C ATOM 1803 CD LYS A 126 1.371 -24.285 -2.956 1.00 0.00 C ATOM 1804 CE LYS A 126 1.444 -23.444 -1.690 1.00 0.00 C ATOM 1805 NZ LYS A 126 1.720 -24.277 -0.487 1.00 0.00 N ATOM 0 H LYS A 126 0.675 -20.474 -4.086 1.00 0.00 H new ATOM 0 HA LYS A 126 0.224 -22.166 -6.333 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -0.391 -22.321 -3.366 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -0.864 -23.595 -4.472 1.00 0.00 H new ATOM 0 HG2 LYS A 126 1.457 -24.011 -5.083 1.00 0.00 H new ATOM 0 HG3 LYS A 126 1.996 -22.622 -4.161 1.00 0.00 H new ATOM 0 HD2 LYS A 126 0.517 -24.959 -2.897 1.00 0.00 H new ATOM 0 HD3 LYS A 126 2.263 -24.906 -3.033 1.00 0.00 H new ATOM 0 HE2 LYS A 126 2.225 -22.692 -1.798 1.00 0.00 H new ATOM 0 HE3 LYS A 126 0.504 -22.910 -1.554 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 1.762 -23.668 0.355 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 0.961 -24.979 -0.369 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 2.630 -24.767 -0.605 1.00 0.00 H new ATOM 1819 N ASN A 127 -2.480 -21.078 -4.754 1.00 0.00 N ATOM 1820 CA ASN A 127 -3.901 -20.799 -4.927 1.00 0.00 C ATOM 1821 C ASN A 127 -4.112 -19.459 -5.624 1.00 0.00 C ATOM 1822 O ASN A 127 -3.430 -18.479 -5.326 1.00 0.00 O ATOM 1823 CB ASN A 127 -4.610 -20.799 -3.571 1.00 0.00 C ATOM 1824 CG ASN A 127 -4.666 -22.180 -2.947 1.00 0.00 C ATOM 1825 OD1 ASN A 127 -4.494 -23.189 -3.631 1.00 0.00 O ATOM 1826 ND2 ASN A 127 -4.909 -22.231 -1.643 1.00 0.00 N ATOM 0 H ASN A 127 -2.127 -20.901 -3.814 1.00 0.00 H new ATOM 0 HA ASN A 127 -4.326 -21.584 -5.552 1.00 0.00 H new ATOM 0 HB2 ASN A 127 -4.094 -20.118 -2.894 1.00 0.00 H new ATOM 0 HB3 ASN A 127 -5.624 -20.418 -3.694 1.00 0.00 H new ATOM 0 HD21 ASN A 127 -4.959 -23.133 -1.169 1.00 0.00 H new ATOM 0 HD22 ASN A 127 -5.045 -21.369 -1.116 1.00 0.00 H new ATOM 1833 N GLU A 128 -5.062 -19.425 -6.553 1.00 0.00 N ATOM 1834 CA GLU A 128 -5.362 -18.204 -7.293 1.00 0.00 C ATOM 1835 C GLU A 128 -6.558 -17.478 -6.682 1.00 0.00 C ATOM 1836 O GLU A 128 -6.608 -16.249 -6.669 1.00 0.00 O ATOM 1837 CB GLU A 128 -5.645 -18.528 -8.762 1.00 0.00 C ATOM 1838 CG GLU A 128 -5.968 -17.305 -9.603 1.00 0.00 C ATOM 1839 CD GLU A 128 -6.295 -17.656 -11.042 1.00 0.00 C ATOM 1840 OE1 GLU A 128 -7.058 -18.620 -11.259 1.00 0.00 O ATOM 1841 OE2 GLU A 128 -5.787 -16.966 -11.951 1.00 0.00 O ATOM 0 H GLU A 128 -5.636 -20.227 -6.811 1.00 0.00 H new ATOM 0 HA GLU A 128 -4.492 -17.550 -7.233 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -4.778 -19.033 -9.188 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -6.479 -19.227 -8.817 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -6.813 -16.777 -9.161 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -5.120 -16.621 -9.584 1.00 0.00 H new ATOM 1848 N GLU A 129 -7.517 -18.249 -6.179 1.00 0.00 N ATOM 1849 CA GLU A 129 -8.712 -17.679 -5.568 1.00 0.00 C ATOM 1850 C GLU A 129 -8.569 -17.615 -4.050 1.00 0.00 C ATOM 1851 O GLU A 129 -9.510 -17.914 -3.315 1.00 0.00 O ATOM 1852 CB GLU A 129 -9.945 -18.504 -5.941 1.00 0.00 C ATOM 1853 CG GLU A 129 -9.922 -19.918 -5.387 1.00 0.00 C ATOM 1854 CD GLU A 129 -10.981 -20.806 -6.011 1.00 0.00 C ATOM 1855 OE1 GLU A 129 -12.158 -20.701 -5.607 1.00 0.00 O ATOM 1856 OE2 GLU A 129 -10.632 -21.607 -6.904 1.00 0.00 O ATOM 0 H GLU A 129 -7.490 -19.269 -6.183 1.00 0.00 H new ATOM 0 HA GLU A 129 -8.834 -16.664 -5.947 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -10.837 -17.994 -5.576 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -10.026 -18.550 -7.027 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -8.939 -20.356 -5.559 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -10.071 -19.884 -4.308 1.00 0.00 H new ATOM 1863 N GLU A 130 -7.386 -17.224 -3.588 1.00 0.00 N ATOM 1864 CA GLU A 130 -7.120 -17.122 -2.158 1.00 0.00 C ATOM 1865 C GLU A 130 -7.236 -15.676 -1.684 1.00 0.00 C ATOM 1866 O GLU A 130 -7.636 -15.413 -0.550 1.00 0.00 O ATOM 1867 CB GLU A 130 -5.726 -17.665 -1.836 1.00 0.00 C ATOM 1868 CG GLU A 130 -5.299 -17.432 -0.396 1.00 0.00 C ATOM 1869 CD GLU A 130 -6.093 -18.268 0.590 1.00 0.00 C ATOM 1870 OE1 GLU A 130 -7.339 -18.200 0.556 1.00 0.00 O ATOM 1871 OE2 GLU A 130 -5.468 -18.990 1.394 1.00 0.00 O ATOM 0 H GLU A 130 -6.597 -16.973 -4.183 1.00 0.00 H new ATOM 0 HA GLU A 130 -7.865 -17.719 -1.633 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -5.705 -18.735 -2.044 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -5.000 -17.197 -2.501 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -4.239 -17.664 -0.293 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -5.419 -16.377 -0.151 1.00 0.00 H new ATOM 1878 N VAL A 131 -6.884 -14.742 -2.561 1.00 0.00 N ATOM 1879 CA VAL A 131 -6.949 -13.323 -2.234 1.00 0.00 C ATOM 1880 C VAL A 131 -6.594 -13.079 -0.772 1.00 0.00 C ATOM 1881 O VAL A 131 -7.301 -12.363 -0.061 1.00 0.00 O ATOM 1882 CB VAL A 131 -8.349 -12.746 -2.515 1.00 0.00 C ATOM 1883 CG1 VAL A 131 -9.402 -13.481 -1.700 1.00 0.00 C ATOM 1884 CG2 VAL A 131 -8.379 -11.254 -2.218 1.00 0.00 C ATOM 0 H VAL A 131 -6.551 -14.943 -3.504 1.00 0.00 H new ATOM 0 HA VAL A 131 -6.222 -12.818 -2.870 1.00 0.00 H new ATOM 0 HB VAL A 131 -8.577 -12.888 -3.571 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -10.385 -13.060 -1.911 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -9.395 -14.538 -1.966 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -9.181 -13.372 -0.638 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -9.376 -10.862 -2.422 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -8.131 -11.087 -1.170 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -7.652 -10.743 -2.849 1.00 0.00 H new ATOM 1894 N LEU A 132 -5.495 -13.678 -0.328 1.00 0.00 N ATOM 1895 CA LEU A 132 -5.045 -13.526 1.052 1.00 0.00 C ATOM 1896 C LEU A 132 -5.335 -12.120 1.567 1.00 0.00 C ATOM 1897 O LEU A 132 -5.814 -11.945 2.688 1.00 0.00 O ATOM 1898 CB LEU A 132 -3.547 -13.821 1.156 1.00 0.00 C ATOM 1899 CG LEU A 132 -3.143 -15.291 1.039 1.00 0.00 C ATOM 1900 CD1 LEU A 132 -1.632 -15.422 0.921 1.00 0.00 C ATOM 1901 CD2 LEU A 132 -3.657 -16.082 2.234 1.00 0.00 C ATOM 0 H LEU A 132 -4.899 -14.273 -0.903 1.00 0.00 H new ATOM 0 HA LEU A 132 -5.593 -14.239 1.668 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -3.032 -13.260 0.376 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -3.188 -13.441 2.112 1.00 0.00 H new ATOM 0 HG LEU A 132 -3.594 -15.701 0.135 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -1.363 -16.475 0.839 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -1.289 -14.890 0.034 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -1.160 -14.995 1.806 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -3.360 -17.126 2.134 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -3.235 -15.671 3.151 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -4.744 -16.016 2.274 1.00 0.00 H new ATOM 1913 N VAL A 133 -5.043 -11.120 0.741 1.00 0.00 N ATOM 1914 CA VAL A 133 -5.275 -9.730 1.112 1.00 0.00 C ATOM 1915 C VAL A 133 -5.865 -8.942 -0.052 1.00 0.00 C ATOM 1916 O VAL A 133 -5.471 -9.128 -1.203 1.00 0.00 O ATOM 1917 CB VAL A 133 -3.974 -9.047 1.573 1.00 0.00 C ATOM 1918 CG1 VAL A 133 -4.210 -7.567 1.833 1.00 0.00 C ATOM 1919 CG2 VAL A 133 -3.423 -9.733 2.814 1.00 0.00 C ATOM 0 H VAL A 133 -4.645 -11.247 -0.190 1.00 0.00 H new ATOM 0 HA VAL A 133 -5.985 -9.738 1.939 1.00 0.00 H new ATOM 0 HB VAL A 133 -3.235 -9.138 0.777 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -3.279 -7.102 2.158 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -4.555 -7.087 0.917 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -4.965 -7.450 2.611 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -2.504 -9.237 3.126 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -4.157 -9.675 3.618 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -3.213 -10.779 2.589 1.00 0.00 H new ATOM 1929 N GLU A 134 -6.811 -8.060 0.256 1.00 0.00 N ATOM 1930 CA GLU A 134 -7.456 -7.244 -0.766 1.00 0.00 C ATOM 1931 C GLU A 134 -7.358 -5.761 -0.419 1.00 0.00 C ATOM 1932 O GLU A 134 -8.009 -5.287 0.513 1.00 0.00 O ATOM 1933 CB GLU A 134 -8.923 -7.647 -0.923 1.00 0.00 C ATOM 1934 CG GLU A 134 -9.574 -7.102 -2.183 1.00 0.00 C ATOM 1935 CD GLU A 134 -11.010 -7.561 -2.344 1.00 0.00 C ATOM 1936 OE1 GLU A 134 -11.707 -7.698 -1.316 1.00 0.00 O ATOM 1937 OE2 GLU A 134 -11.437 -7.783 -3.496 1.00 0.00 O ATOM 0 H GLU A 134 -7.147 -7.892 1.204 1.00 0.00 H new ATOM 0 HA GLU A 134 -6.938 -7.414 -1.710 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -8.993 -8.735 -0.930 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -9.482 -7.297 -0.055 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -9.545 -6.013 -2.160 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -8.996 -7.418 -3.052 1.00 0.00 H new ATOM 1944 N CYS A 135 -6.542 -5.035 -1.175 1.00 0.00 N ATOM 1945 CA CYS A 135 -6.358 -3.606 -0.947 1.00 0.00 C ATOM 1946 C CYS A 135 -6.566 -2.819 -2.237 1.00 0.00 C ATOM 1947 O CYS A 135 -6.322 -3.326 -3.332 1.00 0.00 O ATOM 1948 CB CYS A 135 -4.960 -3.333 -0.389 1.00 0.00 C ATOM 1949 SG CYS A 135 -4.664 -1.604 0.045 1.00 0.00 S ATOM 0 H CYS A 135 -5.997 -5.412 -1.951 1.00 0.00 H new ATOM 0 HA CYS A 135 -7.102 -3.280 -0.220 1.00 0.00 H new ATOM 0 HB2 CYS A 135 -4.807 -3.950 0.496 1.00 0.00 H new ATOM 0 HB3 CYS A 135 -4.219 -3.643 -1.126 1.00 0.00 H new ATOM 0 HG CYS A 135 -4.665 -1.475 1.339 1.00 0.00 H new ATOM 1955 N ARG A 136 -7.021 -1.578 -2.099 1.00 0.00 N ATOM 1956 CA ARG A 136 -7.266 -0.721 -3.253 1.00 0.00 C ATOM 1957 C ARG A 136 -6.521 0.603 -3.115 1.00 0.00 C ATOM 1958 O ARG A 136 -6.722 1.343 -2.152 1.00 0.00 O ATOM 1959 CB ARG A 136 -8.765 -0.461 -3.414 1.00 0.00 C ATOM 1960 CG ARG A 136 -9.618 -1.712 -3.278 1.00 0.00 C ATOM 1961 CD ARG A 136 -11.065 -1.444 -3.662 1.00 0.00 C ATOM 1962 NE ARG A 136 -11.829 -2.679 -3.814 1.00 0.00 N ATOM 1963 CZ ARG A 136 -12.323 -3.367 -2.791 1.00 0.00 C ATOM 1964 NH1 ARG A 136 -12.135 -2.943 -1.549 1.00 0.00 N ATOM 1965 NH2 ARG A 136 -13.008 -4.483 -3.009 1.00 0.00 N ATOM 0 H ARG A 136 -7.227 -1.143 -1.200 1.00 0.00 H new ATOM 0 HA ARG A 136 -6.897 -1.235 -4.140 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -9.081 0.267 -2.667 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -8.945 -0.013 -4.391 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -9.212 -2.501 -3.911 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -9.574 -2.074 -2.251 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -11.532 -0.820 -2.900 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -11.094 -0.883 -4.596 1.00 0.00 H new ATOM 0 HE ARG A 136 -11.992 -3.032 -4.757 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -11.610 -2.086 -1.377 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -12.516 -3.474 -0.766 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -13.155 -4.813 -3.963 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -13.387 -5.011 -2.223 1.00 0.00 H new ATOM 1979 N VAL A 137 -5.659 0.895 -4.084 1.00 0.00 N ATOM 1980 CA VAL A 137 -4.884 2.130 -4.071 1.00 0.00 C ATOM 1981 C VAL A 137 -5.686 3.276 -3.464 1.00 0.00 C ATOM 1982 O VAL A 137 -5.184 4.021 -2.621 1.00 0.00 O ATOM 1983 CB VAL A 137 -4.436 2.527 -5.490 1.00 0.00 C ATOM 1984 CG1 VAL A 137 -3.592 3.792 -5.450 1.00 0.00 C ATOM 1985 CG2 VAL A 137 -3.673 1.387 -6.146 1.00 0.00 C ATOM 0 H VAL A 137 -5.480 0.293 -4.888 1.00 0.00 H new ATOM 0 HA VAL A 137 -4.002 1.943 -3.459 1.00 0.00 H new ATOM 0 HB VAL A 137 -5.324 2.731 -6.089 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -3.285 4.057 -6.462 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -4.177 4.607 -5.024 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -2.708 3.620 -4.836 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -3.364 1.685 -7.148 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -2.792 1.149 -5.550 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -4.315 0.509 -6.211 1.00 0.00 H new ATOM 1995 N ARG A 138 -6.935 3.411 -3.897 1.00 0.00 N ATOM 1996 CA ARG A 138 -7.807 4.467 -3.396 1.00 0.00 C ATOM 1997 C ARG A 138 -7.737 4.555 -1.875 1.00 0.00 C ATOM 1998 O ARG A 138 -7.557 5.635 -1.312 1.00 0.00 O ATOM 1999 CB ARG A 138 -9.251 4.217 -3.837 1.00 0.00 C ATOM 2000 CG ARG A 138 -9.439 4.234 -5.345 1.00 0.00 C ATOM 2001 CD ARG A 138 -9.337 5.645 -5.903 1.00 0.00 C ATOM 2002 NE ARG A 138 -9.108 5.648 -7.346 1.00 0.00 N ATOM 2003 CZ ARG A 138 -10.077 5.516 -8.244 1.00 0.00 C ATOM 2004 NH1 ARG A 138 -11.335 5.371 -7.850 1.00 0.00 N ATOM 2005 NH2 ARG A 138 -9.789 5.529 -9.539 1.00 0.00 N ATOM 0 H ARG A 138 -7.366 2.803 -4.593 1.00 0.00 H new ATOM 0 HA ARG A 138 -7.465 5.414 -3.813 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -9.578 3.252 -3.449 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -9.895 4.975 -3.391 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -8.686 3.601 -5.814 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -10.412 3.812 -5.596 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -10.254 6.190 -5.680 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -8.524 6.174 -5.406 1.00 0.00 H new ATOM 0 HE ARG A 138 -8.151 5.758 -7.682 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -11.560 5.361 -6.855 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -12.078 5.270 -8.542 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -8.823 5.640 -9.845 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -10.534 5.428 -10.228 1.00 0.00 H new ATOM 2019 N PHE A 139 -7.880 3.411 -1.214 1.00 0.00 N ATOM 2020 CA PHE A 139 -7.834 3.358 0.243 1.00 0.00 C ATOM 2021 C PHE A 139 -6.415 3.599 0.751 1.00 0.00 C ATOM 2022 O PHE A 139 -6.214 4.237 1.785 1.00 0.00 O ATOM 2023 CB PHE A 139 -8.344 2.005 0.742 1.00 0.00 C ATOM 2024 CG PHE A 139 -9.830 1.836 0.602 1.00 0.00 C ATOM 2025 CD1 PHE A 139 -10.698 2.815 1.056 1.00 0.00 C ATOM 2026 CD2 PHE A 139 -10.359 0.697 0.015 1.00 0.00 C ATOM 2027 CE1 PHE A 139 -12.065 2.662 0.929 1.00 0.00 C ATOM 2028 CE2 PHE A 139 -11.725 0.538 -0.115 1.00 0.00 C ATOM 2029 CZ PHE A 139 -12.580 1.522 0.342 1.00 0.00 C ATOM 0 H PHE A 139 -8.029 2.508 -1.664 1.00 0.00 H new ATOM 0 HA PHE A 139 -8.479 4.146 0.631 1.00 0.00 H new ATOM 0 HB2 PHE A 139 -7.842 1.210 0.190 1.00 0.00 H new ATOM 0 HB3 PHE A 139 -8.070 1.887 1.790 1.00 0.00 H new ATOM 0 HD1 PHE A 139 -10.301 3.709 1.515 1.00 0.00 H new ATOM 0 HD2 PHE A 139 -9.695 -0.075 -0.345 1.00 0.00 H new ATOM 0 HE1 PHE A 139 -12.731 3.433 1.288 1.00 0.00 H new ATOM 0 HE2 PHE A 139 -12.124 -0.355 -0.573 1.00 0.00 H new ATOM 0 HZ PHE A 139 -13.648 1.401 0.241 1.00 0.00 H new ATOM 2039 N LEU A 140 -5.435 3.083 0.018 1.00 0.00 N ATOM 2040 CA LEU A 140 -4.034 3.240 0.393 1.00 0.00 C ATOM 2041 C LEU A 140 -3.773 4.637 0.947 1.00 0.00 C ATOM 2042 O LEU A 140 -3.955 5.636 0.251 1.00 0.00 O ATOM 2043 CB LEU A 140 -3.130 2.979 -0.812 1.00 0.00 C ATOM 2044 CG LEU A 140 -1.645 2.780 -0.507 1.00 0.00 C ATOM 2045 CD1 LEU A 140 -0.981 1.958 -1.601 1.00 0.00 C ATOM 2046 CD2 LEU A 140 -0.948 4.123 -0.348 1.00 0.00 C ATOM 0 H LEU A 140 -5.585 2.552 -0.840 1.00 0.00 H new ATOM 0 HA LEU A 140 -3.808 2.512 1.172 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -3.496 2.092 -1.330 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -3.229 3.816 -1.503 1.00 0.00 H new ATOM 0 HG LEU A 140 -1.557 2.235 0.433 1.00 0.00 H new ATOM 0 HD11 LEU A 140 0.075 1.827 -1.367 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -1.462 0.982 -1.666 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -1.080 2.475 -2.555 1.00 0.00 H new ATOM 0 HD21 LEU A 140 0.108 3.961 -0.131 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -1.046 4.695 -1.271 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -1.406 4.676 0.472 1.00 0.00 H new ATOM 2058 N SER A 141 -3.342 4.700 2.203 1.00 0.00 N ATOM 2059 CA SER A 141 -3.056 5.975 2.850 1.00 0.00 C ATOM 2060 C SER A 141 -1.612 6.400 2.599 1.00 0.00 C ATOM 2061 O SER A 141 -1.350 7.527 2.178 1.00 0.00 O ATOM 2062 CB SER A 141 -3.315 5.876 4.355 1.00 0.00 C ATOM 2063 OG SER A 141 -2.518 4.864 4.945 1.00 0.00 O ATOM 0 H SER A 141 -3.183 3.883 2.793 1.00 0.00 H new ATOM 0 HA SER A 141 -3.718 6.728 2.422 1.00 0.00 H new ATOM 0 HB2 SER A 141 -3.100 6.834 4.828 1.00 0.00 H new ATOM 0 HB3 SER A 141 -4.369 5.663 4.532 1.00 0.00 H new ATOM 0 HG SER A 141 -2.722 4.001 4.527 1.00 0.00 H new ATOM 2069 N PHE A 142 -0.680 5.490 2.859 1.00 0.00 N ATOM 2070 CA PHE A 142 0.738 5.770 2.663 1.00 0.00 C ATOM 2071 C PHE A 142 1.506 4.490 2.348 1.00 0.00 C ATOM 2072 O PHE A 142 1.077 3.393 2.703 1.00 0.00 O ATOM 2073 CB PHE A 142 1.325 6.438 3.908 1.00 0.00 C ATOM 2074 CG PHE A 142 2.826 6.409 3.952 1.00 0.00 C ATOM 2075 CD1 PHE A 142 3.573 7.232 3.125 1.00 0.00 C ATOM 2076 CD2 PHE A 142 3.490 5.558 4.822 1.00 0.00 C ATOM 2077 CE1 PHE A 142 4.954 7.206 3.164 1.00 0.00 C ATOM 2078 CE2 PHE A 142 4.871 5.528 4.865 1.00 0.00 C ATOM 2079 CZ PHE A 142 5.604 6.354 4.036 1.00 0.00 C ATOM 0 H PHE A 142 -0.881 4.552 3.206 1.00 0.00 H new ATOM 0 HA PHE A 142 0.835 6.449 1.816 1.00 0.00 H new ATOM 0 HB2 PHE A 142 0.988 7.474 3.948 1.00 0.00 H new ATOM 0 HB3 PHE A 142 0.934 5.941 4.796 1.00 0.00 H new ATOM 0 HD1 PHE A 142 3.070 7.901 2.442 1.00 0.00 H new ATOM 0 HD2 PHE A 142 2.921 4.911 5.474 1.00 0.00 H new ATOM 0 HE1 PHE A 142 5.525 7.851 2.513 1.00 0.00 H new ATOM 0 HE2 PHE A 142 5.376 4.859 5.546 1.00 0.00 H new ATOM 0 HZ PHE A 142 6.683 6.334 4.069 1.00 0.00 H new ATOM 2089 N MET A 143 2.645 4.640 1.679 1.00 0.00 N ATOM 2090 CA MET A 143 3.474 3.496 1.317 1.00 0.00 C ATOM 2091 C MET A 143 4.954 3.863 1.359 1.00 0.00 C ATOM 2092 O MET A 143 5.335 4.986 1.031 1.00 0.00 O ATOM 2093 CB MET A 143 3.101 2.990 -0.078 1.00 0.00 C ATOM 2094 CG MET A 143 3.316 4.020 -1.175 1.00 0.00 C ATOM 2095 SD MET A 143 3.722 3.268 -2.763 1.00 0.00 S ATOM 2096 CE MET A 143 2.117 3.270 -3.559 1.00 0.00 C ATOM 0 H MET A 143 3.014 5.541 1.377 1.00 0.00 H new ATOM 0 HA MET A 143 3.294 2.703 2.043 1.00 0.00 H new ATOM 0 HB2 MET A 143 3.692 2.102 -0.304 1.00 0.00 H new ATOM 0 HB3 MET A 143 2.055 2.685 -0.077 1.00 0.00 H new ATOM 0 HG2 MET A 143 2.415 4.624 -1.283 1.00 0.00 H new ATOM 0 HG3 MET A 143 4.119 4.696 -0.881 1.00 0.00 H new ATOM 0 HE1 MET A 143 2.243 3.411 -4.632 1.00 0.00 H new ATOM 0 HE2 MET A 143 1.618 2.319 -3.374 1.00 0.00 H new ATOM 0 HE3 MET A 143 1.512 4.082 -3.155 1.00 0.00 H new ATOM 2106 N GLY A 144 5.785 2.908 1.765 1.00 0.00 N ATOM 2107 CA GLY A 144 7.214 3.151 1.842 1.00 0.00 C ATOM 2108 C GLY A 144 8.009 1.874 2.030 1.00 0.00 C ATOM 2109 O GLY A 144 7.440 0.805 2.248 1.00 0.00 O ATOM 0 H GLY A 144 5.494 1.970 2.042 1.00 0.00 H new ATOM 0 HA2 GLY A 144 7.544 3.650 0.931 1.00 0.00 H new ATOM 0 HA3 GLY A 144 7.420 3.829 2.670 1.00 0.00 H new ATOM 2113 N VAL A 145 9.331 1.985 1.943 1.00 0.00 N ATOM 2114 CA VAL A 145 10.207 0.831 2.104 1.00 0.00 C ATOM 2115 C VAL A 145 10.943 0.881 3.438 1.00 0.00 C ATOM 2116 O VAL A 145 11.108 1.948 4.028 1.00 0.00 O ATOM 2117 CB VAL A 145 11.239 0.746 0.964 1.00 0.00 C ATOM 2118 CG1 VAL A 145 10.540 0.707 -0.387 1.00 0.00 C ATOM 2119 CG2 VAL A 145 12.211 1.913 1.037 1.00 0.00 C ATOM 0 H VAL A 145 9.818 2.862 1.762 1.00 0.00 H new ATOM 0 HA VAL A 145 9.572 -0.054 2.076 1.00 0.00 H new ATOM 0 HB VAL A 145 11.807 -0.177 1.079 1.00 0.00 H new ATOM 0 HG11 VAL A 145 11.285 0.647 -1.180 1.00 0.00 H new ATOM 0 HG12 VAL A 145 9.888 -0.165 -0.434 1.00 0.00 H new ATOM 0 HG13 VAL A 145 9.945 1.611 -0.515 1.00 0.00 H new ATOM 0 HG21 VAL A 145 12.933 1.837 0.224 1.00 0.00 H new ATOM 0 HG22 VAL A 145 11.662 2.850 0.948 1.00 0.00 H new ATOM 0 HG23 VAL A 145 12.736 1.890 1.992 1.00 0.00 H new ATOM 2129 N GLY A 146 11.385 -0.282 3.908 1.00 0.00 N ATOM 2130 CA GLY A 146 12.099 -0.348 5.170 1.00 0.00 C ATOM 2131 C GLY A 146 13.595 -0.168 5.000 1.00 0.00 C ATOM 2132 O GLY A 146 14.079 0.049 3.889 1.00 0.00 O ATOM 0 H GLY A 146 11.261 -1.179 3.438 1.00 0.00 H new ATOM 0 HA2 GLY A 146 11.717 0.422 5.841 1.00 0.00 H new ATOM 0 HA3 GLY A 146 11.903 -1.310 5.645 1.00 0.00 H new ATOM 2136 N LYS A 147 14.329 -0.257 6.104 1.00 0.00 N ATOM 2137 CA LYS A 147 15.779 -0.102 6.073 1.00 0.00 C ATOM 2138 C LYS A 147 16.363 -0.700 4.798 1.00 0.00 C ATOM 2139 O LYS A 147 17.222 -0.097 4.154 1.00 0.00 O ATOM 2140 CB LYS A 147 16.409 -0.769 7.298 1.00 0.00 C ATOM 2141 CG LYS A 147 16.475 0.135 8.517 1.00 0.00 C ATOM 2142 CD LYS A 147 17.705 1.027 8.484 1.00 0.00 C ATOM 2143 CE LYS A 147 18.911 0.335 9.101 1.00 0.00 C ATOM 2144 NZ LYS A 147 18.823 0.287 10.587 1.00 0.00 N ATOM 0 H LYS A 147 13.944 -0.436 7.031 1.00 0.00 H new ATOM 0 HA LYS A 147 16.006 0.964 6.090 1.00 0.00 H new ATOM 0 HB2 LYS A 147 15.837 -1.662 7.549 1.00 0.00 H new ATOM 0 HB3 LYS A 147 17.417 -1.097 7.044 1.00 0.00 H new ATOM 0 HG2 LYS A 147 15.578 0.752 8.562 1.00 0.00 H new ATOM 0 HG3 LYS A 147 16.489 -0.473 9.422 1.00 0.00 H new ATOM 0 HD2 LYS A 147 17.929 1.301 7.453 1.00 0.00 H new ATOM 0 HD3 LYS A 147 17.500 1.952 9.023 1.00 0.00 H new ATOM 0 HE2 LYS A 147 18.988 -0.679 8.709 1.00 0.00 H new ATOM 0 HE3 LYS A 147 19.820 0.860 8.808 1.00 0.00 H new ATOM 0 HZ1 LYS A 147 19.746 0.014 10.981 1.00 0.00 H new ATOM 0 HZ2 LYS A 147 18.556 1.224 10.949 1.00 0.00 H new ATOM 0 HZ3 LYS A 147 18.106 -0.411 10.870 1.00 0.00 H new ATOM 2158 N ASP A 148 15.892 -1.889 4.437 1.00 0.00 N ATOM 2159 CA ASP A 148 16.366 -2.568 3.237 1.00 0.00 C ATOM 2160 C ASP A 148 15.364 -2.418 2.096 1.00 0.00 C ATOM 2161 O ASP A 148 14.218 -2.854 2.202 1.00 0.00 O ATOM 2162 CB ASP A 148 16.611 -4.050 3.526 1.00 0.00 C ATOM 2163 CG ASP A 148 17.965 -4.300 4.159 1.00 0.00 C ATOM 2164 OD1 ASP A 148 18.983 -4.196 3.443 1.00 0.00 O ATOM 2165 OD2 ASP A 148 18.008 -4.600 5.371 1.00 0.00 O ATOM 0 H ASP A 148 15.182 -2.403 4.959 1.00 0.00 H new ATOM 0 HA ASP A 148 17.305 -2.105 2.935 1.00 0.00 H new ATOM 0 HB2 ASP A 148 15.829 -4.422 4.188 1.00 0.00 H new ATOM 0 HB3 ASP A 148 16.538 -4.615 2.597 1.00 0.00 H new ATOM 2170 N VAL A 149 15.804 -1.798 1.006 1.00 0.00 N ATOM 2171 CA VAL A 149 14.947 -1.591 -0.154 1.00 0.00 C ATOM 2172 C VAL A 149 14.188 -2.864 -0.512 1.00 0.00 C ATOM 2173 O VAL A 149 13.134 -2.814 -1.147 1.00 0.00 O ATOM 2174 CB VAL A 149 15.760 -1.130 -1.378 1.00 0.00 C ATOM 2175 CG1 VAL A 149 16.362 0.245 -1.134 1.00 0.00 C ATOM 2176 CG2 VAL A 149 16.845 -2.144 -1.708 1.00 0.00 C ATOM 0 H VAL A 149 16.750 -1.430 0.902 1.00 0.00 H new ATOM 0 HA VAL A 149 14.235 -0.811 0.115 1.00 0.00 H new ATOM 0 HB VAL A 149 15.087 -1.059 -2.233 1.00 0.00 H new ATOM 0 HG11 VAL A 149 16.933 0.553 -2.010 1.00 0.00 H new ATOM 0 HG12 VAL A 149 15.564 0.964 -0.949 1.00 0.00 H new ATOM 0 HG13 VAL A 149 17.022 0.205 -0.267 1.00 0.00 H new ATOM 0 HG21 VAL A 149 17.410 -1.803 -2.575 1.00 0.00 H new ATOM 0 HG22 VAL A 149 17.516 -2.249 -0.856 1.00 0.00 H new ATOM 0 HG23 VAL A 149 16.387 -3.108 -1.930 1.00 0.00 H new ATOM 2186 N HIS A 150 14.731 -4.005 -0.099 1.00 0.00 N ATOM 2187 CA HIS A 150 14.104 -5.293 -0.375 1.00 0.00 C ATOM 2188 C HIS A 150 12.708 -5.360 0.237 1.00 0.00 C ATOM 2189 O HIS A 150 11.775 -5.882 -0.374 1.00 0.00 O ATOM 2190 CB HIS A 150 14.968 -6.431 0.170 1.00 0.00 C ATOM 2191 CG HIS A 150 16.325 -6.507 -0.458 1.00 0.00 C ATOM 2192 ND1 HIS A 150 17.358 -5.657 -0.123 1.00 0.00 N ATOM 2193 CD2 HIS A 150 16.817 -7.339 -1.405 1.00 0.00 C ATOM 2194 CE1 HIS A 150 18.426 -5.962 -0.838 1.00 0.00 C ATOM 2195 NE2 HIS A 150 18.125 -6.980 -1.624 1.00 0.00 N ATOM 0 H HIS A 150 15.603 -4.064 0.427 1.00 0.00 H new ATOM 0 HA HIS A 150 14.013 -5.401 -1.456 1.00 0.00 H new ATOM 0 HB2 HIS A 150 15.082 -6.306 1.247 1.00 0.00 H new ATOM 0 HB3 HIS A 150 14.450 -7.377 0.012 1.00 0.00 H new ATOM 0 HD2 HIS A 150 16.281 -8.137 -1.897 1.00 0.00 H new ATOM 0 HE1 HIS A 150 19.383 -5.464 -0.788 1.00 0.00 H new ATOM 0 HE2 HIS A 150 18.760 -7.427 -2.286 1.00 0.00 H new ATOM 2204 N THR A 151 12.572 -4.829 1.448 1.00 0.00 N ATOM 2205 CA THR A 151 11.291 -4.831 2.144 1.00 0.00 C ATOM 2206 C THR A 151 10.397 -3.698 1.652 1.00 0.00 C ATOM 2207 O THR A 151 10.817 -2.542 1.595 1.00 0.00 O ATOM 2208 CB THR A 151 11.479 -4.697 3.667 1.00 0.00 C ATOM 2209 OG1 THR A 151 12.250 -3.528 3.964 1.00 0.00 O ATOM 2210 CG2 THR A 151 12.170 -5.926 4.237 1.00 0.00 C ATOM 0 H THR A 151 13.333 -4.392 1.967 1.00 0.00 H new ATOM 0 HA THR A 151 10.814 -5.787 1.927 1.00 0.00 H new ATOM 0 HB THR A 151 10.495 -4.608 4.126 1.00 0.00 H new ATOM 0 HG1 THR A 151 12.833 -3.319 3.205 1.00 0.00 H new ATOM 0 HG21 THR A 151 12.292 -5.808 5.314 1.00 0.00 H new ATOM 0 HG22 THR A 151 11.565 -6.810 4.035 1.00 0.00 H new ATOM 0 HG23 THR A 151 13.149 -6.042 3.772 1.00 0.00 H new ATOM 2218 N PHE A 152 9.162 -4.037 1.297 1.00 0.00 N ATOM 2219 CA PHE A 152 8.208 -3.048 0.809 1.00 0.00 C ATOM 2220 C PHE A 152 6.839 -3.249 1.452 1.00 0.00 C ATOM 2221 O PHE A 152 6.181 -4.265 1.230 1.00 0.00 O ATOM 2222 CB PHE A 152 8.087 -3.133 -0.714 1.00 0.00 C ATOM 2223 CG PHE A 152 6.875 -2.433 -1.259 1.00 0.00 C ATOM 2224 CD1 PHE A 152 6.743 -1.058 -1.146 1.00 0.00 C ATOM 2225 CD2 PHE A 152 5.867 -3.150 -1.884 1.00 0.00 C ATOM 2226 CE1 PHE A 152 5.628 -0.412 -1.646 1.00 0.00 C ATOM 2227 CE2 PHE A 152 4.750 -2.509 -2.386 1.00 0.00 C ATOM 2228 CZ PHE A 152 4.631 -1.139 -2.268 1.00 0.00 C ATOM 0 H PHE A 152 8.798 -4.989 1.338 1.00 0.00 H new ATOM 0 HA PHE A 152 8.576 -2.059 1.082 1.00 0.00 H new ATOM 0 HB2 PHE A 152 8.980 -2.701 -1.166 1.00 0.00 H new ATOM 0 HB3 PHE A 152 8.055 -4.182 -1.010 1.00 0.00 H new ATOM 0 HD1 PHE A 152 7.520 -0.485 -0.662 1.00 0.00 H new ATOM 0 HD2 PHE A 152 5.955 -4.222 -1.980 1.00 0.00 H new ATOM 0 HE1 PHE A 152 5.536 0.660 -1.551 1.00 0.00 H new ATOM 0 HE2 PHE A 152 3.971 -3.080 -2.870 1.00 0.00 H new ATOM 0 HZ PHE A 152 3.760 -0.636 -2.661 1.00 0.00 H new ATOM 2238 N ALA A 153 6.417 -2.274 2.250 1.00 0.00 N ATOM 2239 CA ALA A 153 5.127 -2.342 2.923 1.00 0.00 C ATOM 2240 C ALA A 153 4.283 -1.109 2.620 1.00 0.00 C ATOM 2241 O ALA A 153 4.780 -0.122 2.078 1.00 0.00 O ATOM 2242 CB ALA A 153 5.323 -2.494 4.425 1.00 0.00 C ATOM 0 H ALA A 153 6.951 -1.427 2.446 1.00 0.00 H new ATOM 0 HA ALA A 153 4.594 -3.215 2.546 1.00 0.00 H new ATOM 0 HB1 ALA A 153 4.351 -2.544 4.916 1.00 0.00 H new ATOM 0 HB2 ALA A 153 5.879 -3.409 4.629 1.00 0.00 H new ATOM 0 HB3 ALA A 153 5.879 -1.638 4.808 1.00 0.00 H new ATOM 2248 N PHE A 154 3.003 -1.172 2.973 1.00 0.00 N ATOM 2249 CA PHE A 154 2.089 -0.061 2.737 1.00 0.00 C ATOM 2250 C PHE A 154 0.980 -0.036 3.785 1.00 0.00 C ATOM 2251 O PHE A 154 0.459 -1.081 4.176 1.00 0.00 O ATOM 2252 CB PHE A 154 1.481 -0.161 1.337 1.00 0.00 C ATOM 2253 CG PHE A 154 0.751 -1.451 1.091 1.00 0.00 C ATOM 2254 CD1 PHE A 154 -0.535 -1.637 1.572 1.00 0.00 C ATOM 2255 CD2 PHE A 154 1.352 -2.478 0.381 1.00 0.00 C ATOM 2256 CE1 PHE A 154 -1.209 -2.822 1.347 1.00 0.00 C ATOM 2257 CE2 PHE A 154 0.683 -3.665 0.153 1.00 0.00 C ATOM 2258 CZ PHE A 154 -0.599 -3.838 0.638 1.00 0.00 C ATOM 0 H PHE A 154 2.576 -1.981 3.424 1.00 0.00 H new ATOM 0 HA PHE A 154 2.657 0.866 2.813 1.00 0.00 H new ATOM 0 HB2 PHE A 154 0.793 0.671 1.188 1.00 0.00 H new ATOM 0 HB3 PHE A 154 2.274 -0.055 0.597 1.00 0.00 H new ATOM 0 HD1 PHE A 154 -1.016 -0.847 2.129 1.00 0.00 H new ATOM 0 HD2 PHE A 154 2.355 -2.349 0.002 1.00 0.00 H new ATOM 0 HE1 PHE A 154 -2.212 -2.954 1.725 1.00 0.00 H new ATOM 0 HE2 PHE A 154 1.162 -4.457 -0.404 1.00 0.00 H new ATOM 0 HZ PHE A 154 -1.123 -4.766 0.463 1.00 0.00 H new ATOM 2268 N ILE A 155 0.626 1.163 4.235 1.00 0.00 N ATOM 2269 CA ILE A 155 -0.420 1.324 5.236 1.00 0.00 C ATOM 2270 C ILE A 155 -1.762 1.638 4.584 1.00 0.00 C ATOM 2271 O ILE A 155 -1.900 2.632 3.872 1.00 0.00 O ATOM 2272 CB ILE A 155 -0.075 2.443 6.237 1.00 0.00 C ATOM 2273 CG1 ILE A 155 1.158 2.059 7.058 1.00 0.00 C ATOM 2274 CG2 ILE A 155 -1.260 2.722 7.149 1.00 0.00 C ATOM 2275 CD1 ILE A 155 1.723 3.204 7.870 1.00 0.00 C ATOM 0 H ILE A 155 1.049 2.037 3.922 1.00 0.00 H new ATOM 0 HA ILE A 155 -0.491 0.377 5.772 1.00 0.00 H new ATOM 0 HB ILE A 155 0.151 3.352 5.680 1.00 0.00 H new ATOM 0 HG12 ILE A 155 0.897 1.241 7.730 1.00 0.00 H new ATOM 0 HG13 ILE A 155 1.930 1.685 6.386 1.00 0.00 H new ATOM 0 HG21 ILE A 155 -1.000 3.515 7.850 1.00 0.00 H new ATOM 0 HG22 ILE A 155 -2.115 3.034 6.549 1.00 0.00 H new ATOM 0 HG23 ILE A 155 -1.515 1.818 7.702 1.00 0.00 H new ATOM 0 HD11 ILE A 155 2.595 2.860 8.427 1.00 0.00 H new ATOM 0 HD12 ILE A 155 2.015 4.014 7.202 1.00 0.00 H new ATOM 0 HD13 ILE A 155 0.966 3.564 8.567 1.00 0.00 H new ATOM 2287 N MET A 156 -2.749 0.783 4.833 1.00 0.00 N ATOM 2288 CA MET A 156 -4.082 0.971 4.272 1.00 0.00 C ATOM 2289 C MET A 156 -5.119 1.138 5.378 1.00 0.00 C ATOM 2290 O MET A 156 -4.840 0.877 6.548 1.00 0.00 O ATOM 2291 CB MET A 156 -4.456 -0.215 3.380 1.00 0.00 C ATOM 2292 CG MET A 156 -4.430 -1.551 4.105 1.00 0.00 C ATOM 2293 SD MET A 156 -4.665 -2.949 2.991 1.00 0.00 S ATOM 2294 CE MET A 156 -6.393 -3.324 3.277 1.00 0.00 C ATOM 0 H MET A 156 -2.651 -0.046 5.419 1.00 0.00 H new ATOM 0 HA MET A 156 -4.070 1.879 3.670 1.00 0.00 H new ATOM 0 HB2 MET A 156 -5.453 -0.052 2.971 1.00 0.00 H new ATOM 0 HB3 MET A 156 -3.768 -0.255 2.535 1.00 0.00 H new ATOM 0 HG2 MET A 156 -3.477 -1.660 4.623 1.00 0.00 H new ATOM 0 HG3 MET A 156 -5.210 -1.562 4.866 1.00 0.00 H new ATOM 0 HE1 MET A 156 -6.824 -3.761 2.376 1.00 0.00 H new ATOM 0 HE2 MET A 156 -6.480 -4.032 4.101 1.00 0.00 H new ATOM 0 HE3 MET A 156 -6.927 -2.408 3.528 1.00 0.00 H new ATOM 2304 N ASP A 157 -6.316 1.574 5.000 1.00 0.00 N ATOM 2305 CA ASP A 157 -7.395 1.774 5.960 1.00 0.00 C ATOM 2306 C ASP A 157 -8.446 0.676 5.833 1.00 0.00 C ATOM 2307 O ASP A 157 -9.236 0.663 4.889 1.00 0.00 O ATOM 2308 CB ASP A 157 -8.043 3.144 5.753 1.00 0.00 C ATOM 2309 CG ASP A 157 -7.033 4.274 5.793 1.00 0.00 C ATOM 2310 OD1 ASP A 157 -6.679 4.713 6.907 1.00 0.00 O ATOM 2311 OD2 ASP A 157 -6.598 4.720 4.710 1.00 0.00 O ATOM 0 H ASP A 157 -6.563 1.796 4.036 1.00 0.00 H new ATOM 0 HA ASP A 157 -6.969 1.730 6.962 1.00 0.00 H new ATOM 0 HB2 ASP A 157 -8.560 3.157 4.794 1.00 0.00 H new ATOM 0 HB3 ASP A 157 -8.796 3.307 6.524 1.00 0.00 H new ATOM 2316 N THR A 158 -8.450 -0.246 6.791 1.00 0.00 N ATOM 2317 CA THR A 158 -9.401 -1.350 6.786 1.00 0.00 C ATOM 2318 C THR A 158 -10.742 -0.923 7.373 1.00 0.00 C ATOM 2319 O THR A 158 -11.782 -1.056 6.730 1.00 0.00 O ATOM 2320 CB THR A 158 -8.867 -2.557 7.580 1.00 0.00 C ATOM 2321 OG1 THR A 158 -8.583 -2.168 8.929 1.00 0.00 O ATOM 2322 CG2 THR A 158 -7.609 -3.116 6.933 1.00 0.00 C ATOM 0 H THR A 158 -7.804 -0.250 7.581 1.00 0.00 H new ATOM 0 HA THR A 158 -9.539 -1.643 5.745 1.00 0.00 H new ATOM 0 HB THR A 158 -9.633 -3.333 7.579 1.00 0.00 H new ATOM 0 HG1 THR A 158 -8.246 -2.941 9.428 1.00 0.00 H new ATOM 0 HG21 THR A 158 -7.250 -3.968 7.511 1.00 0.00 H new ATOM 0 HG22 THR A 158 -7.835 -3.437 5.916 1.00 0.00 H new ATOM 0 HG23 THR A 158 -6.839 -2.345 6.908 1.00 0.00 H new ATOM 2368 N ARG A 162 -8.769 2.628 11.637 1.00 0.00 N ATOM 2369 CA ARG A 162 -7.780 1.569 11.801 1.00 0.00 C ATOM 2370 C ARG A 162 -6.722 1.639 10.704 1.00 0.00 C ATOM 2371 O ARG A 162 -7.006 2.045 9.577 1.00 0.00 O ATOM 2372 CB ARG A 162 -8.460 0.199 11.782 1.00 0.00 C ATOM 2373 CG ARG A 162 -9.284 -0.089 13.026 1.00 0.00 C ATOM 2374 CD ARG A 162 -10.526 0.787 13.087 1.00 0.00 C ATOM 2375 NE ARG A 162 -11.630 0.124 13.775 1.00 0.00 N ATOM 2376 CZ ARG A 162 -11.737 0.056 15.098 1.00 0.00 C ATOM 2377 NH1 ARG A 162 -10.811 0.608 15.870 1.00 0.00 N ATOM 2378 NH2 ARG A 162 -12.771 -0.565 15.650 1.00 0.00 N ATOM 0 HA ARG A 162 -7.290 1.710 12.764 1.00 0.00 H new ATOM 0 HB2 ARG A 162 -9.106 0.135 10.906 1.00 0.00 H new ATOM 0 HB3 ARG A 162 -7.699 -0.574 11.674 1.00 0.00 H new ATOM 0 HG2 ARG A 162 -9.577 -1.139 13.035 1.00 0.00 H new ATOM 0 HG3 ARG A 162 -8.675 0.079 13.914 1.00 0.00 H new ATOM 0 HD2 ARG A 162 -10.287 1.719 13.599 1.00 0.00 H new ATOM 0 HD3 ARG A 162 -10.835 1.049 12.075 1.00 0.00 H new ATOM 0 HE ARG A 162 -12.359 -0.311 13.209 1.00 0.00 H new ATOM 0 HH11 ARG A 162 -10.015 1.086 15.449 1.00 0.00 H new ATOM 0 HH12 ARG A 162 -10.895 0.555 16.885 1.00 0.00 H new ATOM 0 HH21 ARG A 162 -13.485 -0.991 15.059 1.00 0.00 H new ATOM 0 HH22 ARG A 162 -12.852 -0.617 16.665 1.00 0.00 H new ATOM 2392 N PHE A 163 -5.500 1.241 11.042 1.00 0.00 N ATOM 2393 CA PHE A 163 -4.398 1.259 10.086 1.00 0.00 C ATOM 2394 C PHE A 163 -3.548 -0.002 10.212 1.00 0.00 C ATOM 2395 O PHE A 163 -3.054 -0.324 11.293 1.00 0.00 O ATOM 2396 CB PHE A 163 -3.528 2.499 10.303 1.00 0.00 C ATOM 2397 CG PHE A 163 -4.317 3.738 10.614 1.00 0.00 C ATOM 2398 CD1 PHE A 163 -5.336 4.156 9.773 1.00 0.00 C ATOM 2399 CD2 PHE A 163 -4.040 4.486 11.747 1.00 0.00 C ATOM 2400 CE1 PHE A 163 -6.064 5.296 10.056 1.00 0.00 C ATOM 2401 CE2 PHE A 163 -4.766 5.626 12.036 1.00 0.00 C ATOM 2402 CZ PHE A 163 -5.778 6.032 11.189 1.00 0.00 C ATOM 0 H PHE A 163 -5.247 0.902 11.970 1.00 0.00 H new ATOM 0 HA PHE A 163 -4.821 1.291 9.082 1.00 0.00 H new ATOM 0 HB2 PHE A 163 -2.832 2.306 11.120 1.00 0.00 H new ATOM 0 HB3 PHE A 163 -2.929 2.674 9.409 1.00 0.00 H new ATOM 0 HD1 PHE A 163 -5.564 3.584 8.886 1.00 0.00 H new ATOM 0 HD2 PHE A 163 -3.248 4.175 12.412 1.00 0.00 H new ATOM 0 HE1 PHE A 163 -6.855 5.611 9.392 1.00 0.00 H new ATOM 0 HE2 PHE A 163 -4.542 6.199 12.924 1.00 0.00 H new ATOM 0 HZ PHE A 163 -6.345 6.924 11.412 1.00 0.00 H new ATOM 2412 N GLU A 164 -3.382 -0.710 9.100 1.00 0.00 N ATOM 2413 CA GLU A 164 -2.592 -1.936 9.086 1.00 0.00 C ATOM 2414 C GLU A 164 -1.375 -1.789 8.179 1.00 0.00 C ATOM 2415 O GLU A 164 -1.423 -1.090 7.166 1.00 0.00 O ATOM 2416 CB GLU A 164 -3.449 -3.116 8.622 1.00 0.00 C ATOM 2417 CG GLU A 164 -4.382 -3.650 9.696 1.00 0.00 C ATOM 2418 CD GLU A 164 -3.655 -3.998 10.980 1.00 0.00 C ATOM 2419 OE1 GLU A 164 -2.496 -4.458 10.901 1.00 0.00 O ATOM 2420 OE2 GLU A 164 -4.245 -3.811 12.065 1.00 0.00 O ATOM 0 H GLU A 164 -3.784 -0.456 8.197 1.00 0.00 H new ATOM 0 HA GLU A 164 -2.245 -2.126 10.102 1.00 0.00 H new ATOM 0 HB2 GLU A 164 -4.040 -2.808 7.760 1.00 0.00 H new ATOM 0 HB3 GLU A 164 -2.794 -3.921 8.289 1.00 0.00 H new ATOM 0 HG2 GLU A 164 -5.150 -2.906 9.908 1.00 0.00 H new ATOM 0 HG3 GLU A 164 -4.893 -4.537 9.320 1.00 0.00 H new ATOM 2427 N CYS A 165 -0.285 -2.452 8.549 1.00 0.00 N ATOM 2428 CA CYS A 165 0.947 -2.395 7.769 1.00 0.00 C ATOM 2429 C CYS A 165 1.286 -3.763 7.187 1.00 0.00 C ATOM 2430 O CYS A 165 1.716 -4.666 7.906 1.00 0.00 O ATOM 2431 CB CYS A 165 2.102 -1.896 8.638 1.00 0.00 C ATOM 2432 SG CYS A 165 3.685 -1.788 7.771 1.00 0.00 S ATOM 0 H CYS A 165 -0.229 -3.035 9.384 1.00 0.00 H new ATOM 0 HA CYS A 165 0.795 -1.698 6.945 1.00 0.00 H new ATOM 0 HB2 CYS A 165 1.848 -0.912 9.031 1.00 0.00 H new ATOM 0 HB3 CYS A 165 2.213 -2.562 9.493 1.00 0.00 H new ATOM 0 HG CYS A 165 4.399 -0.833 8.288 1.00 0.00 H new ATOM 2438 N HIS A 166 1.088 -3.910 5.881 1.00 0.00 N ATOM 2439 CA HIS A 166 1.372 -5.170 5.202 1.00 0.00 C ATOM 2440 C HIS A 166 2.751 -5.136 4.549 1.00 0.00 C ATOM 2441 O HIS A 166 2.954 -4.460 3.540 1.00 0.00 O ATOM 2442 CB HIS A 166 0.302 -5.458 4.148 1.00 0.00 C ATOM 2443 CG HIS A 166 -1.067 -5.654 4.723 1.00 0.00 C ATOM 2444 ND1 HIS A 166 -1.495 -6.852 5.255 1.00 0.00 N ATOM 2445 CD2 HIS A 166 -2.105 -4.795 4.849 1.00 0.00 C ATOM 2446 CE1 HIS A 166 -2.739 -6.722 5.682 1.00 0.00 C ATOM 2447 NE2 HIS A 166 -3.132 -5.483 5.447 1.00 0.00 N ATOM 0 H HIS A 166 0.732 -3.173 5.272 1.00 0.00 H new ATOM 0 HA HIS A 166 1.361 -5.966 5.946 1.00 0.00 H new ATOM 0 HB2 HIS A 166 0.274 -4.633 3.436 1.00 0.00 H new ATOM 0 HB3 HIS A 166 0.584 -6.351 3.590 1.00 0.00 H new ATOM 0 HD2 HIS A 166 -2.122 -3.761 4.537 1.00 0.00 H new ATOM 0 HE1 HIS A 166 -3.333 -7.497 6.144 1.00 0.00 H new ATOM 0 HE2 HIS A 166 -4.050 -5.099 5.673 1.00 0.00 H new ATOM 2455 N VAL A 167 3.694 -5.869 5.131 1.00 0.00 N ATOM 2456 CA VAL A 167 5.053 -5.923 4.605 1.00 0.00 C ATOM 2457 C VAL A 167 5.201 -7.039 3.577 1.00 0.00 C ATOM 2458 O VAL A 167 4.539 -8.073 3.668 1.00 0.00 O ATOM 2459 CB VAL A 167 6.082 -6.139 5.731 1.00 0.00 C ATOM 2460 CG1 VAL A 167 7.494 -5.903 5.216 1.00 0.00 C ATOM 2461 CG2 VAL A 167 5.778 -5.229 6.912 1.00 0.00 C ATOM 0 H VAL A 167 3.542 -6.434 5.967 1.00 0.00 H new ATOM 0 HA VAL A 167 5.245 -4.963 4.125 1.00 0.00 H new ATOM 0 HB VAL A 167 6.012 -7.173 6.070 1.00 0.00 H new ATOM 0 HG11 VAL A 167 8.207 -6.060 6.025 1.00 0.00 H new ATOM 0 HG12 VAL A 167 7.706 -6.599 4.405 1.00 0.00 H new ATOM 0 HG13 VAL A 167 7.581 -4.880 4.849 1.00 0.00 H new ATOM 0 HG21 VAL A 167 6.515 -5.395 7.698 1.00 0.00 H new ATOM 0 HG22 VAL A 167 5.819 -4.189 6.590 1.00 0.00 H new ATOM 0 HG23 VAL A 167 4.782 -5.451 7.295 1.00 0.00 H new ATOM 2471 N PHE A 168 6.073 -6.822 2.598 1.00 0.00 N ATOM 2472 CA PHE A 168 6.308 -7.810 1.551 1.00 0.00 C ATOM 2473 C PHE A 168 7.748 -7.741 1.052 1.00 0.00 C ATOM 2474 O PHE A 168 8.289 -6.657 0.832 1.00 0.00 O ATOM 2475 CB PHE A 168 5.341 -7.588 0.386 1.00 0.00 C ATOM 2476 CG PHE A 168 3.895 -7.642 0.788 1.00 0.00 C ATOM 2477 CD1 PHE A 168 3.217 -8.850 0.824 1.00 0.00 C ATOM 2478 CD2 PHE A 168 3.213 -6.485 1.129 1.00 0.00 C ATOM 2479 CE1 PHE A 168 1.886 -8.902 1.193 1.00 0.00 C ATOM 2480 CE2 PHE A 168 1.882 -6.531 1.499 1.00 0.00 C ATOM 2481 CZ PHE A 168 1.218 -7.742 1.532 1.00 0.00 C ATOM 0 H PHE A 168 6.628 -5.971 2.508 1.00 0.00 H new ATOM 0 HA PHE A 168 6.136 -8.800 1.974 1.00 0.00 H new ATOM 0 HB2 PHE A 168 5.548 -6.619 -0.067 1.00 0.00 H new ATOM 0 HB3 PHE A 168 5.526 -8.343 -0.378 1.00 0.00 H new ATOM 0 HD1 PHE A 168 3.734 -9.761 0.561 1.00 0.00 H new ATOM 0 HD2 PHE A 168 3.728 -5.536 1.105 1.00 0.00 H new ATOM 0 HE1 PHE A 168 1.369 -9.850 1.216 1.00 0.00 H new ATOM 0 HE2 PHE A 168 1.362 -5.622 1.762 1.00 0.00 H new ATOM 0 HZ PHE A 168 0.179 -7.781 1.822 1.00 0.00 H new ATOM 2491 N TRP A 169 8.363 -8.905 0.876 1.00 0.00 N ATOM 2492 CA TRP A 169 9.741 -8.978 0.404 1.00 0.00 C ATOM 2493 C TRP A 169 9.792 -9.023 -1.119 1.00 0.00 C ATOM 2494 O TRP A 169 8.979 -9.691 -1.758 1.00 0.00 O ATOM 2495 CB TRP A 169 10.436 -10.210 0.986 1.00 0.00 C ATOM 2496 CG TRP A 169 11.917 -10.219 0.757 1.00 0.00 C ATOM 2497 CD1 TRP A 169 12.575 -10.718 -0.331 1.00 0.00 C ATOM 2498 CD2 TRP A 169 12.924 -9.708 1.638 1.00 0.00 C ATOM 2499 NE1 TRP A 169 13.930 -10.547 -0.180 1.00 0.00 N ATOM 2500 CE2 TRP A 169 14.170 -9.929 1.019 1.00 0.00 C ATOM 2501 CE3 TRP A 169 12.894 -9.083 2.887 1.00 0.00 C ATOM 2502 CZ2 TRP A 169 15.372 -9.549 1.610 1.00 0.00 C ATOM 2503 CZ3 TRP A 169 14.088 -8.706 3.472 1.00 0.00 C ATOM 2504 CH2 TRP A 169 15.313 -8.939 2.833 1.00 0.00 C ATOM 0 H TRP A 169 7.929 -9.811 1.053 1.00 0.00 H new ATOM 0 HA TRP A 169 10.263 -8.082 0.741 1.00 0.00 H new ATOM 0 HB2 TRP A 169 10.241 -10.256 2.057 1.00 0.00 H new ATOM 0 HB3 TRP A 169 10.002 -11.106 0.544 1.00 0.00 H new ATOM 0 HD1 TRP A 169 12.100 -11.179 -1.184 1.00 0.00 H new ATOM 0 HE1 TRP A 169 14.642 -10.834 -0.852 1.00 0.00 H new ATOM 0 HE3 TRP A 169 11.955 -8.898 3.387 1.00 0.00 H new ATOM 0 HZ2 TRP A 169 16.317 -9.729 1.120 1.00 0.00 H new ATOM 0 HZ3 TRP A 169 14.077 -8.224 4.438 1.00 0.00 H new ATOM 0 HH2 TRP A 169 16.229 -8.631 3.316 1.00 0.00 H new ATOM 2515 N CYS A 170 10.752 -8.308 -1.695 1.00 0.00 N ATOM 2516 CA CYS A 170 10.909 -8.266 -3.145 1.00 0.00 C ATOM 2517 C CYS A 170 12.296 -8.748 -3.556 1.00 0.00 C ATOM 2518 O CYS A 170 13.216 -8.790 -2.740 1.00 0.00 O ATOM 2519 CB CYS A 170 10.675 -6.846 -3.663 1.00 0.00 C ATOM 2520 SG CYS A 170 8.949 -6.311 -3.599 1.00 0.00 S ATOM 0 H CYS A 170 11.433 -7.750 -1.181 1.00 0.00 H new ATOM 0 HA CYS A 170 10.168 -8.933 -3.585 1.00 0.00 H new ATOM 0 HB2 CYS A 170 11.281 -6.153 -3.079 1.00 0.00 H new ATOM 0 HB3 CYS A 170 11.025 -6.784 -4.693 1.00 0.00 H new ATOM 0 HG CYS A 170 8.844 -5.122 -4.114 1.00 0.00 H new ATOM 2526 N GLU A 171 12.438 -9.113 -4.826 1.00 0.00 N ATOM 2527 CA GLU A 171 13.712 -9.595 -5.344 1.00 0.00 C ATOM 2528 C GLU A 171 13.865 -9.250 -6.823 1.00 0.00 C ATOM 2529 O GLU A 171 12.967 -9.474 -7.635 1.00 0.00 O ATOM 2530 CB GLU A 171 13.828 -11.108 -5.149 1.00 0.00 C ATOM 2531 CG GLU A 171 13.963 -11.525 -3.694 1.00 0.00 C ATOM 2532 CD GLU A 171 14.715 -12.831 -3.528 1.00 0.00 C ATOM 2533 OE1 GLU A 171 14.297 -13.837 -4.139 1.00 0.00 O ATOM 2534 OE2 GLU A 171 15.721 -12.848 -2.789 1.00 0.00 O ATOM 0 H GLU A 171 11.686 -9.084 -5.515 1.00 0.00 H new ATOM 0 HA GLU A 171 14.510 -9.101 -4.789 1.00 0.00 H new ATOM 0 HB2 GLU A 171 12.948 -11.590 -5.576 1.00 0.00 H new ATOM 0 HB3 GLU A 171 14.692 -11.472 -5.704 1.00 0.00 H new ATOM 0 HG2 GLU A 171 14.480 -10.740 -3.142 1.00 0.00 H new ATOM 0 HG3 GLU A 171 12.970 -11.623 -3.255 1.00 0.00 H new ATOM 2541 N PRO A 172 15.029 -8.689 -7.182 1.00 0.00 N ATOM 2542 CA PRO A 172 16.105 -8.416 -6.225 1.00 0.00 C ATOM 2543 C PRO A 172 15.750 -7.292 -5.258 1.00 0.00 C ATOM 2544 O PRO A 172 15.899 -7.434 -4.045 1.00 0.00 O ATOM 2545 CB PRO A 172 17.278 -8.003 -7.118 1.00 0.00 C ATOM 2546 CG PRO A 172 16.643 -7.477 -8.358 1.00 0.00 C ATOM 2547 CD PRO A 172 15.385 -8.278 -8.551 1.00 0.00 C ATOM 0 HA PRO A 172 16.316 -9.278 -5.593 1.00 0.00 H new ATOM 0 HB2 PRO A 172 17.894 -7.244 -6.636 1.00 0.00 H new ATOM 0 HB3 PRO A 172 17.928 -8.851 -7.335 1.00 0.00 H new ATOM 0 HG2 PRO A 172 16.418 -6.415 -8.261 1.00 0.00 H new ATOM 0 HG3 PRO A 172 17.309 -7.585 -9.214 1.00 0.00 H new ATOM 0 HD2 PRO A 172 14.596 -7.682 -9.010 1.00 0.00 H new ATOM 0 HD3 PRO A 172 15.552 -9.139 -9.198 1.00 0.00 H new ATOM 2555 N ASN A 173 15.279 -6.175 -5.804 1.00 0.00 N ATOM 2556 CA ASN A 173 14.902 -5.026 -4.989 1.00 0.00 C ATOM 2557 C ASN A 173 13.432 -4.673 -5.193 1.00 0.00 C ATOM 2558 O ASN A 173 12.765 -5.229 -6.064 1.00 0.00 O ATOM 2559 CB ASN A 173 15.780 -3.821 -5.332 1.00 0.00 C ATOM 2560 CG ASN A 173 15.814 -3.536 -6.821 1.00 0.00 C ATOM 2561 OD1 ASN A 173 15.000 -4.058 -7.583 1.00 0.00 O ATOM 2562 ND2 ASN A 173 16.760 -2.705 -7.243 1.00 0.00 N ATOM 0 H ASN A 173 15.149 -6.041 -6.807 1.00 0.00 H new ATOM 0 HA ASN A 173 15.052 -5.290 -3.942 1.00 0.00 H new ATOM 0 HB2 ASN A 173 15.408 -2.942 -4.805 1.00 0.00 H new ATOM 0 HB3 ASN A 173 16.794 -4.001 -4.976 1.00 0.00 H new ATOM 0 HD21 ASN A 173 16.833 -2.476 -8.234 1.00 0.00 H new ATOM 0 HD22 ASN A 173 17.414 -2.295 -6.576 1.00 0.00 H new ATOM 2569 N ALA A 174 12.934 -3.744 -4.383 1.00 0.00 N ATOM 2570 CA ALA A 174 11.545 -3.315 -4.476 1.00 0.00 C ATOM 2571 C ALA A 174 11.408 -2.088 -5.372 1.00 0.00 C ATOM 2572 O ALA A 174 10.653 -1.166 -5.066 1.00 0.00 O ATOM 2573 CB ALA A 174 10.988 -3.023 -3.090 1.00 0.00 C ATOM 0 H ALA A 174 13.473 -3.274 -3.655 1.00 0.00 H new ATOM 0 HA ALA A 174 10.970 -4.126 -4.923 1.00 0.00 H new ATOM 0 HB1 ALA A 174 9.949 -2.704 -3.175 1.00 0.00 H new ATOM 0 HB2 ALA A 174 11.042 -3.924 -2.479 1.00 0.00 H new ATOM 0 HB3 ALA A 174 11.574 -2.232 -2.622 1.00 0.00 H new ATOM 2579 N ALA A 175 12.144 -2.084 -6.478 1.00 0.00 N ATOM 2580 CA ALA A 175 12.104 -0.971 -7.419 1.00 0.00 C ATOM 2581 C ALA A 175 10.936 -1.114 -8.388 1.00 0.00 C ATOM 2582 O ALA A 175 10.091 -0.226 -8.492 1.00 0.00 O ATOM 2583 CB ALA A 175 13.417 -0.877 -8.181 1.00 0.00 C ATOM 0 H ALA A 175 12.776 -2.839 -6.745 1.00 0.00 H new ATOM 0 HA ALA A 175 11.960 -0.052 -6.851 1.00 0.00 H new ATOM 0 HB1 ALA A 175 13.373 -0.042 -8.880 1.00 0.00 H new ATOM 0 HB2 ALA A 175 14.235 -0.719 -7.478 1.00 0.00 H new ATOM 0 HB3 ALA A 175 13.585 -1.802 -8.732 1.00 0.00 H new ATOM 2589 N ASN A 176 10.895 -2.238 -9.097 1.00 0.00 N ATOM 2590 CA ASN A 176 9.830 -2.496 -10.060 1.00 0.00 C ATOM 2591 C ASN A 176 8.470 -2.535 -9.370 1.00 0.00 C ATOM 2592 O ASN A 176 7.480 -2.029 -9.897 1.00 0.00 O ATOM 2593 CB ASN A 176 10.083 -3.817 -10.790 1.00 0.00 C ATOM 2594 CG ASN A 176 11.222 -3.718 -11.786 1.00 0.00 C ATOM 2595 OD1 ASN A 176 11.012 -3.392 -12.955 1.00 0.00 O ATOM 2596 ND2 ASN A 176 12.436 -3.999 -11.328 1.00 0.00 N ATOM 0 H ASN A 176 11.586 -2.984 -9.023 1.00 0.00 H new ATOM 0 HA ASN A 176 9.826 -1.683 -10.786 1.00 0.00 H new ATOM 0 HB2 ASN A 176 10.309 -4.595 -10.060 1.00 0.00 H new ATOM 0 HB3 ASN A 176 9.175 -4.121 -11.310 1.00 0.00 H new ATOM 0 HD21 ASN A 176 13.241 -3.949 -11.953 1.00 0.00 H new ATOM 0 HD22 ASN A 176 12.564 -4.265 -10.352 1.00 0.00 H new ATOM 2603 N VAL A 177 8.431 -3.140 -8.187 1.00 0.00 N ATOM 2604 CA VAL A 177 7.194 -3.245 -7.423 1.00 0.00 C ATOM 2605 C VAL A 177 6.684 -1.868 -7.010 1.00 0.00 C ATOM 2606 O VAL A 177 5.577 -1.471 -7.372 1.00 0.00 O ATOM 2607 CB VAL A 177 7.384 -4.109 -6.162 1.00 0.00 C ATOM 2608 CG1 VAL A 177 6.096 -4.167 -5.355 1.00 0.00 C ATOM 2609 CG2 VAL A 177 7.850 -5.507 -6.539 1.00 0.00 C ATOM 0 H VAL A 177 9.242 -3.565 -7.737 1.00 0.00 H new ATOM 0 HA VAL A 177 6.460 -3.721 -8.073 1.00 0.00 H new ATOM 0 HB VAL A 177 8.153 -3.650 -5.541 1.00 0.00 H new ATOM 0 HG11 VAL A 177 6.250 -4.782 -4.468 1.00 0.00 H new ATOM 0 HG12 VAL A 177 5.810 -3.159 -5.053 1.00 0.00 H new ATOM 0 HG13 VAL A 177 5.304 -4.601 -5.965 1.00 0.00 H new ATOM 0 HG21 VAL A 177 7.979 -6.103 -5.636 1.00 0.00 H new ATOM 0 HG22 VAL A 177 7.106 -5.978 -7.181 1.00 0.00 H new ATOM 0 HG23 VAL A 177 8.800 -5.443 -7.070 1.00 0.00 H new ATOM 2619 N SER A 178 7.500 -1.145 -6.251 1.00 0.00 N ATOM 2620 CA SER A 178 7.131 0.187 -5.786 1.00 0.00 C ATOM 2621 C SER A 178 6.773 1.093 -6.960 1.00 0.00 C ATOM 2622 O SER A 178 5.802 1.847 -6.902 1.00 0.00 O ATOM 2623 CB SER A 178 8.277 0.805 -4.981 1.00 0.00 C ATOM 2624 OG SER A 178 8.306 0.294 -3.660 1.00 0.00 O ATOM 0 H SER A 178 8.421 -1.459 -5.945 1.00 0.00 H new ATOM 0 HA SER A 178 6.255 0.091 -5.144 1.00 0.00 H new ATOM 0 HB2 SER A 178 9.226 0.597 -5.475 1.00 0.00 H new ATOM 0 HB3 SER A 178 8.163 1.889 -4.953 1.00 0.00 H new ATOM 0 HG SER A 178 7.389 0.147 -3.346 1.00 0.00 H new ATOM 2630 N GLU A 179 7.564 1.011 -8.025 1.00 0.00 N ATOM 2631 CA GLU A 179 7.331 1.824 -9.213 1.00 0.00 C ATOM 2632 C GLU A 179 5.987 1.483 -9.850 1.00 0.00 C ATOM 2633 O GLU A 179 5.179 2.368 -10.130 1.00 0.00 O ATOM 2634 CB GLU A 179 8.456 1.617 -10.229 1.00 0.00 C ATOM 2635 CG GLU A 179 8.177 2.245 -11.584 1.00 0.00 C ATOM 2636 CD GLU A 179 8.242 3.760 -11.549 1.00 0.00 C ATOM 2637 OE1 GLU A 179 7.270 4.385 -11.077 1.00 0.00 O ATOM 2638 OE2 GLU A 179 9.267 4.319 -11.994 1.00 0.00 O ATOM 0 H GLU A 179 8.371 0.391 -8.090 1.00 0.00 H new ATOM 0 HA GLU A 179 7.315 2.870 -8.908 1.00 0.00 H new ATOM 0 HB2 GLU A 179 9.378 2.036 -9.827 1.00 0.00 H new ATOM 0 HB3 GLU A 179 8.622 0.548 -10.361 1.00 0.00 H new ATOM 0 HG2 GLU A 179 8.899 1.871 -12.309 1.00 0.00 H new ATOM 0 HG3 GLU A 179 7.190 1.935 -11.928 1.00 0.00 H new ATOM 2645 N ALA A 180 5.756 0.194 -10.077 1.00 0.00 N ATOM 2646 CA ALA A 180 4.510 -0.264 -10.679 1.00 0.00 C ATOM 2647 C ALA A 180 3.302 0.322 -9.956 1.00 0.00 C ATOM 2648 O ALA A 180 2.491 1.029 -10.553 1.00 0.00 O ATOM 2649 CB ALA A 180 4.448 -1.785 -10.669 1.00 0.00 C ATOM 0 H ALA A 180 6.415 -0.551 -9.853 1.00 0.00 H new ATOM 0 HA ALA A 180 4.485 0.083 -11.712 1.00 0.00 H new ATOM 0 HB1 ALA A 180 3.512 -2.114 -11.121 1.00 0.00 H new ATOM 0 HB2 ALA A 180 5.287 -2.187 -11.237 1.00 0.00 H new ATOM 0 HB3 ALA A 180 4.500 -2.145 -9.641 1.00 0.00 H new ATOM 2655 N VAL A 181 3.189 0.023 -8.665 1.00 0.00 N ATOM 2656 CA VAL A 181 2.080 0.520 -7.860 1.00 0.00 C ATOM 2657 C VAL A 181 1.969 2.038 -7.956 1.00 0.00 C ATOM 2658 O VAL A 181 0.872 2.583 -8.078 1.00 0.00 O ATOM 2659 CB VAL A 181 2.236 0.120 -6.381 1.00 0.00 C ATOM 2660 CG1 VAL A 181 3.578 0.589 -5.840 1.00 0.00 C ATOM 2661 CG2 VAL A 181 1.091 0.684 -5.553 1.00 0.00 C ATOM 0 H VAL A 181 3.852 -0.561 -8.155 1.00 0.00 H new ATOM 0 HA VAL A 181 1.172 0.066 -8.257 1.00 0.00 H new ATOM 0 HB VAL A 181 2.203 -0.967 -6.311 1.00 0.00 H new ATOM 0 HG11 VAL A 181 3.670 0.298 -4.794 1.00 0.00 H new ATOM 0 HG12 VAL A 181 4.382 0.132 -6.416 1.00 0.00 H new ATOM 0 HG13 VAL A 181 3.644 1.674 -5.922 1.00 0.00 H new ATOM 0 HG21 VAL A 181 1.217 0.392 -4.511 1.00 0.00 H new ATOM 0 HG22 VAL A 181 1.090 1.771 -5.627 1.00 0.00 H new ATOM 0 HG23 VAL A 181 0.145 0.294 -5.927 1.00 0.00 H new ATOM 2671 N GLN A 182 3.112 2.714 -7.901 1.00 0.00 N ATOM 2672 CA GLN A 182 3.142 4.169 -7.981 1.00 0.00 C ATOM 2673 C GLN A 182 2.272 4.670 -9.129 1.00 0.00 C ATOM 2674 O GLN A 182 1.508 5.622 -8.972 1.00 0.00 O ATOM 2675 CB GLN A 182 4.579 4.661 -8.163 1.00 0.00 C ATOM 2676 CG GLN A 182 4.812 6.068 -7.637 1.00 0.00 C ATOM 2677 CD GLN A 182 5.339 6.080 -6.216 1.00 0.00 C ATOM 2678 OE1 GLN A 182 4.531 5.594 -5.281 1.00 0.00 O flip ATOM 2679 NE2 GLN A 182 6.459 6.522 -5.960 1.00 0.00 N flip ATOM 0 H GLN A 182 4.029 2.278 -7.801 1.00 0.00 H new ATOM 0 HA GLN A 182 2.744 4.567 -7.048 1.00 0.00 H new ATOM 0 HB2 GLN A 182 5.256 3.975 -7.654 1.00 0.00 H new ATOM 0 HB3 GLN A 182 4.833 4.632 -9.223 1.00 0.00 H new ATOM 0 HG2 GLN A 182 5.520 6.582 -8.287 1.00 0.00 H new ATOM 0 HG3 GLN A 182 3.877 6.627 -7.678 1.00 0.00 H new ATOM 0 HE21 GLN A 182 7.047 6.886 -6.710 1.00 0.00 H new ATOM 0 HE22 GLN A 182 6.799 6.524 -4.998 1.00 0.00 H new ATOM 2688 N ALA A 183 2.392 4.022 -10.283 1.00 0.00 N ATOM 2689 CA ALA A 183 1.615 4.400 -11.456 1.00 0.00 C ATOM 2690 C ALA A 183 0.119 4.316 -11.174 1.00 0.00 C ATOM 2691 O ALA A 183 -0.636 5.232 -11.499 1.00 0.00 O ATOM 2692 CB ALA A 183 1.982 3.516 -12.639 1.00 0.00 C ATOM 0 H ALA A 183 3.020 3.232 -10.430 1.00 0.00 H new ATOM 0 HA ALA A 183 1.854 5.435 -11.702 1.00 0.00 H new ATOM 0 HB1 ALA A 183 1.394 3.809 -13.509 1.00 0.00 H new ATOM 0 HB2 ALA A 183 3.043 3.630 -12.863 1.00 0.00 H new ATOM 0 HB3 ALA A 183 1.773 2.475 -12.394 1.00 0.00 H new ATOM 2698 N ALA A 184 -0.303 3.211 -10.568 1.00 0.00 N ATOM 2699 CA ALA A 184 -1.709 3.009 -10.242 1.00 0.00 C ATOM 2700 C ALA A 184 -2.273 4.202 -9.477 1.00 0.00 C ATOM 2701 O ALA A 184 -3.372 4.675 -9.768 1.00 0.00 O ATOM 2702 CB ALA A 184 -1.885 1.731 -9.434 1.00 0.00 C ATOM 0 H ALA A 184 0.309 2.442 -10.293 1.00 0.00 H new ATOM 0 HA ALA A 184 -2.263 2.915 -11.176 1.00 0.00 H new ATOM 0 HB1 ALA A 184 -2.940 1.593 -9.197 1.00 0.00 H new ATOM 0 HB2 ALA A 184 -1.529 0.881 -10.016 1.00 0.00 H new ATOM 0 HB3 ALA A 184 -1.312 1.803 -8.509 1.00 0.00 H new ATOM 2708 N CYS A 185 -1.514 4.683 -8.499 1.00 0.00 N ATOM 2709 CA CYS A 185 -1.938 5.821 -7.691 1.00 0.00 C ATOM 2710 C CYS A 185 -2.375 6.984 -8.576 1.00 0.00 C ATOM 2711 O CYS A 185 -3.554 7.333 -8.622 1.00 0.00 O ATOM 2712 CB CYS A 185 -0.806 6.267 -6.765 1.00 0.00 C ATOM 2713 SG CYS A 185 -0.313 5.022 -5.550 1.00 0.00 S ATOM 0 H CYS A 185 -0.602 4.303 -8.246 1.00 0.00 H new ATOM 0 HA CYS A 185 -2.789 5.508 -7.087 1.00 0.00 H new ATOM 0 HB2 CYS A 185 0.061 6.532 -7.370 1.00 0.00 H new ATOM 0 HB3 CYS A 185 -1.116 7.170 -6.239 1.00 0.00 H new ATOM 0 HG CYS A 185 0.711 5.455 -4.876 1.00 0.00 H new