USER MOD reduce.3.24.130724 H: found=0, std=0, add=912, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 914 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: B 131 CYS SG : rot -170:sc= -1.75 USER MOD Set 1.2: B 135 MET CE :methyl -144:sc= -2.53 (180deg=-1.45) USER MOD Set 2.1: B 127 ASN : amide:sc= -0.178 X(o=-2.6,f=-2.3) USER MOD Set 2.2: B 130 ASN : amide:sc= -0.625 K(o=-2.6,f=-11!) USER MOD Set 2.3: B 161 ASN : amide:sc= -1.83 K(o=-2.6,f=-11) USER MOD Set 3.1: A 39 LYS NZ :NH3+ 175:sc= 1.18 (180deg=-0.0341) USER MOD Set 3.2: B 172 SER OG : rot -160:sc= 0.375 USER MOD Set 4.1: A 31 CYS SG : rot -170:sc= -0.609 USER MOD Set 4.2: A 35 MET CE :methyl -174:sc= -2.98! (180deg=-3.1!) USER MOD Set 5.1: A 27 ASN :FLIP amide:sc=-0.00142 F(o=-3,f=-2.3) USER MOD Set 5.2: A 30 ASN : amide:sc= -1.02! C(o=-2.3!,f=-12!) USER MOD Set 5.3: A 61 ASN : amide:sc= -1.26 K(o=-2.3,f=-9!) USER MOD Single : A 17 GLN : amide:sc= 0 K(o=0,f=-0.84) USER MOD Single : A 22 LYS NZ :NH3+ -170:sc= -1.06! (180deg=-1.58!) USER MOD Single : A 23 MET CE :methyl 155:sc= -0.337 (180deg=-1.72) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 SER OG : rot 89:sc= 0.646 USER MOD Single : A 36 HIS : no HD1:sc= -0.0305 X(o=-0.031,f=-0.0039) USER MOD Single : A 37 HIS :FLIP no HE2:sc= -0.209 F(o=-1.3,f=-0.21) USER MOD Single : A 40 ASN : amide:sc= -2.6! C(o=-2.6!,f=-6.2!) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= -0.0766 K(o=-0.077,f=-2.8!) USER MOD Single : A 53 THR OG1 : rot 69:sc= 0.898 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 58 ASN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : A 63 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0451) USER MOD Single : A 64 GLN : amide:sc= -0.473 X(o=-0.47,f=0) USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 HIS : no HE2:sc= 0.336 K(o=0.34,f=-1.2) USER MOD Single : A 71 THR OG1 : rot 87:sc= 1.26 USER MOD Single : A 72 SER OG : rot 40:sc= 0.0175 USER MOD Single : B 117 GLN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : B 122 LYS NZ :NH3+ 176:sc= 0.661 (180deg=0.63) USER MOD Single : B 123 MET CE :methyl 153:sc= -0.095 (180deg=-1.51) USER MOD Single : B 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 133 SER OG : rot -155:sc= 0.89 USER MOD Single : B 136 HIS :FLIP no HD1:sc= 0 F(o=-0.58,f=0) USER MOD Single : B 137 HIS :FLIP no HE2:sc= -0.182 F(o=-1,f=-0.18) USER MOD Single : B 139 LYS NZ :NH3+ 150:sc=-0.00151 (180deg=-0.316) USER MOD Single : B 140 ASN : amide:sc= -2.53! C(o=-2.5!,f=-12!) USER MOD Single : B 148 SER OG : rot 180:sc= 0 USER MOD Single : B 149 GLN : amide:sc= -0.0247 X(o=-0.025,f=-0.35) USER MOD Single : B 153 THR OG1 : rot 72:sc= 0.829 USER MOD Single : B 154 SER OG : rot 180:sc= 0 USER MOD Single : B 158 ASN :FLIP amide:sc= 0 F(o=-0.8,f=0) USER MOD Single : B 163 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0109) USER MOD Single : B 164 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 166 TYR OH : rot 180:sc= 0 USER MOD Single : B 170 HIS : no HE2:sc= 0.12 K(o=0.12,f=-0.56) USER MOD Single : B 171 THR OG1 : rot 59:sc= 1.24 USER MOD ----------------------------------------------------------------- ATOM 217 N GLY A 15 9.574 2.236 8.697 1.00 0.00 N ATOM 218 CA GLY A 15 8.368 2.773 8.069 1.00 0.00 C ATOM 219 C GLY A 15 7.794 1.880 6.970 1.00 0.00 C ATOM 220 O GLY A 15 6.739 1.273 7.157 1.00 0.00 O ATOM 0 HA2 GLY A 15 7.608 2.924 8.835 1.00 0.00 H new ATOM 0 HA3 GLY A 15 8.595 3.752 7.647 1.00 0.00 H new ATOM 224 N PRO A 16 8.462 1.773 5.822 1.00 0.00 N ATOM 225 CA PRO A 16 7.992 0.936 4.721 1.00 0.00 C ATOM 226 C PRO A 16 8.173 -0.598 4.997 1.00 0.00 C ATOM 227 O PRO A 16 7.339 -1.421 4.582 1.00 0.00 O ATOM 228 CB PRO A 16 8.855 1.435 3.543 1.00 0.00 C ATOM 229 CG PRO A 16 10.118 1.869 4.180 1.00 0.00 C ATOM 230 CD PRO A 16 9.707 2.495 5.477 1.00 0.00 C ATOM 0 HA PRO A 16 6.920 1.023 4.542 1.00 0.00 H new ATOM 0 HB2 PRO A 16 9.028 0.645 2.813 1.00 0.00 H new ATOM 0 HB3 PRO A 16 8.372 2.257 3.015 1.00 0.00 H new ATOM 0 HG2 PRO A 16 10.787 1.024 4.345 1.00 0.00 H new ATOM 0 HG3 PRO A 16 10.652 2.581 3.551 1.00 0.00 H new ATOM 0 HD2 PRO A 16 10.471 2.370 6.244 1.00 0.00 H new ATOM 0 HD3 PRO A 16 9.535 3.566 5.370 1.00 0.00 H new ATOM 238 N GLN A 17 9.219 -0.960 5.743 1.00 0.00 N ATOM 239 CA GLN A 17 9.521 -2.374 6.058 1.00 0.00 C ATOM 240 C GLN A 17 8.420 -2.985 6.934 1.00 0.00 C ATOM 241 O GLN A 17 7.822 -4.022 6.603 1.00 0.00 O ATOM 242 CB GLN A 17 10.873 -2.464 6.766 1.00 0.00 C ATOM 243 CG GLN A 17 11.253 -3.863 7.241 1.00 0.00 C ATOM 244 CD GLN A 17 12.546 -3.878 8.034 1.00 0.00 C ATOM 245 OE1 GLN A 17 12.887 -2.907 8.697 1.00 0.00 O ATOM 246 NE2 GLN A 17 13.264 -4.968 7.982 1.00 0.00 N ATOM 0 H GLN A 17 9.879 -0.295 6.146 1.00 0.00 H new ATOM 0 HA GLN A 17 9.564 -2.939 5.127 1.00 0.00 H new ATOM 0 HB2 GLN A 17 11.647 -2.102 6.089 1.00 0.00 H new ATOM 0 HB3 GLN A 17 10.863 -1.794 7.625 1.00 0.00 H new ATOM 0 HG2 GLN A 17 10.448 -4.265 7.857 1.00 0.00 H new ATOM 0 HG3 GLN A 17 11.353 -4.521 6.378 1.00 0.00 H new ATOM 0 HE21 GLN A 17 12.950 -5.759 7.419 1.00 0.00 H new ATOM 0 HE22 GLN A 17 14.138 -5.028 8.504 1.00 0.00 H new ATOM 255 N ASP A 18 8.136 -2.307 8.022 1.00 0.00 N ATOM 256 CA ASP A 18 7.102 -2.698 8.975 1.00 0.00 C ATOM 257 C ASP A 18 5.745 -2.608 8.317 1.00 0.00 C ATOM 258 O ASP A 18 4.807 -3.323 8.689 1.00 0.00 O ATOM 259 CB ASP A 18 7.177 -1.847 10.254 1.00 0.00 C ATOM 260 CG ASP A 18 6.092 -2.125 11.254 1.00 0.00 C ATOM 261 OD1 ASP A 18 6.181 -3.136 11.988 1.00 0.00 O ATOM 262 OD2 ASP A 18 5.155 -1.317 11.357 1.00 0.00 O ATOM 0 H ASP A 18 8.623 -1.449 8.282 1.00 0.00 H new ATOM 0 HA ASP A 18 7.268 -3.732 9.277 1.00 0.00 H new ATOM 0 HB2 ASP A 18 8.143 -2.014 10.730 1.00 0.00 H new ATOM 0 HB3 ASP A 18 7.136 -0.794 9.977 1.00 0.00 H new ATOM 267 N PHE A 19 5.644 -1.720 7.314 1.00 0.00 N ATOM 268 CA PHE A 19 4.401 -1.516 6.599 1.00 0.00 C ATOM 269 C PHE A 19 4.013 -2.797 5.890 1.00 0.00 C ATOM 270 O PHE A 19 2.845 -3.138 5.807 1.00 0.00 O ATOM 271 CB PHE A 19 4.539 -0.384 5.595 1.00 0.00 C ATOM 272 CG PHE A 19 3.234 0.159 5.135 1.00 0.00 C ATOM 273 CD1 PHE A 19 2.414 0.800 6.044 1.00 0.00 C ATOM 274 CD2 PHE A 19 2.830 0.066 3.807 1.00 0.00 C ATOM 275 CE1 PHE A 19 1.217 1.339 5.660 1.00 0.00 C ATOM 276 CE2 PHE A 19 1.620 0.607 3.424 1.00 0.00 C ATOM 277 CZ PHE A 19 0.818 1.245 4.355 1.00 0.00 C ATOM 0 H PHE A 19 6.416 -1.138 6.990 1.00 0.00 H new ATOM 0 HA PHE A 19 3.623 -1.245 7.312 1.00 0.00 H new ATOM 0 HB2 PHE A 19 5.121 0.421 6.044 1.00 0.00 H new ATOM 0 HB3 PHE A 19 5.101 -0.740 4.731 1.00 0.00 H new ATOM 0 HD1 PHE A 19 2.724 0.877 7.076 1.00 0.00 H new ATOM 0 HD2 PHE A 19 3.459 -0.426 3.081 1.00 0.00 H new ATOM 0 HE1 PHE A 19 0.589 1.837 6.384 1.00 0.00 H new ATOM 0 HE2 PHE A 19 1.298 0.533 2.396 1.00 0.00 H new ATOM 0 HZ PHE A 19 -0.127 1.670 4.050 1.00 0.00 H new ATOM 287 N LEU A 20 5.010 -3.502 5.400 1.00 0.00 N ATOM 288 CA LEU A 20 4.801 -4.792 4.781 1.00 0.00 C ATOM 289 C LEU A 20 4.388 -5.809 5.809 1.00 0.00 C ATOM 290 O LEU A 20 3.397 -6.480 5.652 1.00 0.00 O ATOM 291 CB LEU A 20 6.074 -5.291 4.132 1.00 0.00 C ATOM 292 CG LEU A 20 6.642 -4.456 3.024 1.00 0.00 C ATOM 293 CD1 LEU A 20 7.936 -5.074 2.547 1.00 0.00 C ATOM 294 CD2 LEU A 20 5.646 -4.335 1.886 1.00 0.00 C ATOM 0 H LEU A 20 5.984 -3.198 5.419 1.00 0.00 H new ATOM 0 HA LEU A 20 4.020 -4.667 4.031 1.00 0.00 H new ATOM 0 HB2 LEU A 20 6.834 -5.389 4.907 1.00 0.00 H new ATOM 0 HB3 LEU A 20 5.886 -6.291 3.741 1.00 0.00 H new ATOM 0 HG LEU A 20 6.845 -3.451 3.394 1.00 0.00 H new ATOM 0 HD11 LEU A 20 8.352 -4.470 1.741 1.00 0.00 H new ATOM 0 HD12 LEU A 20 8.646 -5.116 3.373 1.00 0.00 H new ATOM 0 HD13 LEU A 20 7.744 -6.083 2.182 1.00 0.00 H new ATOM 0 HD21 LEU A 20 6.075 -3.726 1.090 1.00 0.00 H new ATOM 0 HD22 LEU A 20 5.414 -5.327 1.498 1.00 0.00 H new ATOM 0 HD23 LEU A 20 4.732 -3.865 2.250 1.00 0.00 H new ATOM 306 N LEU A 21 5.138 -5.876 6.892 1.00 0.00 N ATOM 307 CA LEU A 21 4.957 -6.911 7.925 1.00 0.00 C ATOM 308 C LEU A 21 3.579 -6.926 8.578 1.00 0.00 C ATOM 309 O LEU A 21 3.207 -7.911 9.208 1.00 0.00 O ATOM 310 CB LEU A 21 6.042 -6.812 8.980 1.00 0.00 C ATOM 311 CG LEU A 21 7.459 -7.044 8.478 1.00 0.00 C ATOM 312 CD1 LEU A 21 8.471 -6.742 9.564 1.00 0.00 C ATOM 313 CD2 LEU A 21 7.618 -8.480 8.023 1.00 0.00 C ATOM 0 H LEU A 21 5.893 -5.221 7.093 1.00 0.00 H new ATOM 0 HA LEU A 21 5.039 -7.860 7.395 1.00 0.00 H new ATOM 0 HB2 LEU A 21 5.993 -5.823 9.436 1.00 0.00 H new ATOM 0 HB3 LEU A 21 5.829 -7.537 9.766 1.00 0.00 H new ATOM 0 HG LEU A 21 7.637 -6.373 7.638 1.00 0.00 H new ATOM 0 HD11 LEU A 21 9.477 -6.915 9.182 1.00 0.00 H new ATOM 0 HD12 LEU A 21 8.374 -5.701 9.872 1.00 0.00 H new ATOM 0 HD13 LEU A 21 8.291 -7.392 10.420 1.00 0.00 H new ATOM 0 HD21 LEU A 21 8.635 -8.638 7.665 1.00 0.00 H new ATOM 0 HD22 LEU A 21 7.419 -9.151 8.859 1.00 0.00 H new ATOM 0 HD23 LEU A 21 6.914 -8.686 7.217 1.00 0.00 H new ATOM 325 N LYS A 22 2.833 -5.874 8.417 1.00 0.00 N ATOM 326 CA LYS A 22 1.512 -5.808 8.997 1.00 0.00 C ATOM 327 C LYS A 22 0.441 -6.174 7.992 1.00 0.00 C ATOM 328 O LYS A 22 -0.743 -6.301 8.342 1.00 0.00 O ATOM 329 CB LYS A 22 1.246 -4.446 9.550 1.00 0.00 C ATOM 330 CG LYS A 22 1.312 -3.352 8.525 1.00 0.00 C ATOM 331 CD LYS A 22 0.983 -2.021 9.126 1.00 0.00 C ATOM 332 CE LYS A 22 2.187 -1.363 9.842 1.00 0.00 C ATOM 333 NZ LYS A 22 2.744 -2.162 10.966 1.00 0.00 N ATOM 0 H LYS A 22 3.111 -5.046 7.890 1.00 0.00 H new ATOM 0 HA LYS A 22 1.478 -6.536 9.808 1.00 0.00 H new ATOM 0 HB2 LYS A 22 0.259 -4.438 10.013 1.00 0.00 H new ATOM 0 HB3 LYS A 22 1.969 -4.237 10.338 1.00 0.00 H new ATOM 0 HG2 LYS A 22 2.310 -3.319 8.089 1.00 0.00 H new ATOM 0 HG3 LYS A 22 0.617 -3.569 7.714 1.00 0.00 H new ATOM 0 HD2 LYS A 22 0.625 -1.354 8.342 1.00 0.00 H new ATOM 0 HD3 LYS A 22 0.167 -2.142 9.838 1.00 0.00 H new ATOM 0 HE2 LYS A 22 2.976 -1.186 9.112 1.00 0.00 H new ATOM 0 HE3 LYS A 22 1.880 -0.388 10.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 3.428 -1.585 11.496 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 1.973 -2.454 11.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 3.221 -3.006 10.589 1.00 0.00 H new ATOM 347 N MET A 23 0.844 -6.346 6.753 1.00 0.00 N ATOM 348 CA MET A 23 -0.082 -6.672 5.701 1.00 0.00 C ATOM 349 C MET A 23 -0.411 -8.162 5.796 1.00 0.00 C ATOM 350 O MET A 23 0.489 -8.973 6.070 1.00 0.00 O ATOM 351 CB MET A 23 0.521 -6.404 4.318 1.00 0.00 C ATOM 352 CG MET A 23 0.996 -4.987 4.045 1.00 0.00 C ATOM 353 SD MET A 23 1.629 -4.843 2.352 1.00 0.00 S ATOM 354 CE MET A 23 2.087 -3.121 2.253 1.00 0.00 C ATOM 0 H MET A 23 1.815 -6.264 6.452 1.00 0.00 H new ATOM 0 HA MET A 23 -0.971 -6.052 5.819 1.00 0.00 H new ATOM 0 HB2 MET A 23 1.365 -7.079 4.178 1.00 0.00 H new ATOM 0 HB3 MET A 23 -0.223 -6.664 3.566 1.00 0.00 H new ATOM 0 HG2 MET A 23 0.174 -4.287 4.193 1.00 0.00 H new ATOM 0 HG3 MET A 23 1.777 -4.716 4.756 1.00 0.00 H new ATOM 0 HE1 MET A 23 2.859 -2.993 1.494 1.00 0.00 H new ATOM 0 HE2 MET A 23 1.213 -2.527 1.986 1.00 0.00 H new ATOM 0 HE3 MET A 23 2.469 -2.790 3.219 1.00 0.00 H new ATOM 364 N PRO A 24 -1.673 -8.556 5.601 1.00 0.00 N ATOM 365 CA PRO A 24 -2.066 -9.965 5.644 1.00 0.00 C ATOM 366 C PRO A 24 -1.394 -10.763 4.529 1.00 0.00 C ATOM 367 O PRO A 24 -1.579 -10.476 3.357 1.00 0.00 O ATOM 368 CB PRO A 24 -3.579 -9.943 5.426 1.00 0.00 C ATOM 369 CG PRO A 24 -3.874 -8.611 4.823 1.00 0.00 C ATOM 370 CD PRO A 24 -2.816 -7.670 5.326 1.00 0.00 C ATOM 0 HA PRO A 24 -1.774 -10.438 6.582 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -3.892 -10.751 4.765 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -4.113 -10.075 6.367 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -3.858 -8.666 3.735 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -4.867 -8.267 5.110 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -2.567 -6.912 4.584 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -3.141 -7.143 6.223 1.00 0.00 H new ATOM 378 N GLY A 25 -0.595 -11.729 4.898 1.00 0.00 N ATOM 379 CA GLY A 25 0.081 -12.521 3.915 1.00 0.00 C ATOM 380 C GLY A 25 1.581 -12.353 4.042 1.00 0.00 C ATOM 381 O GLY A 25 2.358 -13.189 3.604 1.00 0.00 O ATOM 0 H GLY A 25 -0.400 -11.982 5.866 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -0.186 -13.571 4.038 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -0.241 -12.226 2.916 1.00 0.00 H new ATOM 385 N VAL A 26 1.981 -11.277 4.665 1.00 0.00 N ATOM 386 CA VAL A 26 3.381 -10.950 4.798 1.00 0.00 C ATOM 387 C VAL A 26 3.975 -11.465 6.103 1.00 0.00 C ATOM 388 O VAL A 26 3.403 -11.295 7.194 1.00 0.00 O ATOM 389 CB VAL A 26 3.629 -9.429 4.668 1.00 0.00 C ATOM 390 CG1 VAL A 26 5.110 -9.083 4.849 1.00 0.00 C ATOM 391 CG2 VAL A 26 3.129 -8.930 3.321 1.00 0.00 C ATOM 0 H VAL A 26 1.349 -10.601 5.095 1.00 0.00 H new ATOM 0 HA VAL A 26 3.888 -11.456 3.976 1.00 0.00 H new ATOM 0 HB VAL A 26 3.074 -8.930 5.462 1.00 0.00 H new ATOM 0 HG11 VAL A 26 5.247 -8.006 4.751 1.00 0.00 H new ATOM 0 HG12 VAL A 26 5.440 -9.402 5.838 1.00 0.00 H new ATOM 0 HG13 VAL A 26 5.699 -9.594 4.087 1.00 0.00 H new ATOM 0 HG21 VAL A 26 3.309 -7.858 3.241 1.00 0.00 H new ATOM 0 HG22 VAL A 26 3.659 -9.448 2.522 1.00 0.00 H new ATOM 0 HG23 VAL A 26 2.060 -9.126 3.234 1.00 0.00 H new ATOM 401 N ASN A 27 5.124 -12.071 5.971 1.00 0.00 N ATOM 402 CA ASN A 27 5.906 -12.598 7.069 1.00 0.00 C ATOM 403 C ASN A 27 7.303 -12.115 6.878 1.00 0.00 C ATOM 404 O ASN A 27 7.650 -11.697 5.782 1.00 0.00 O ATOM 405 CB ASN A 27 5.912 -14.126 7.098 1.00 0.00 C ATOM 406 CG ASN A 27 4.533 -14.729 7.228 1.00 0.00 C ATOM 407 OD1 ASN A 27 3.979 -15.143 6.134 1.00 0.00 O flip ATOM 408 ND2 ASN A 27 4.000 -14.869 8.328 1.00 0.00 N flip ATOM 0 H ASN A 27 5.563 -12.220 5.062 1.00 0.00 H new ATOM 0 HA ASN A 27 5.471 -12.260 8.010 1.00 0.00 H new ATOM 0 HB2 ASN A 27 6.378 -14.497 6.186 1.00 0.00 H new ATOM 0 HB3 ASN A 27 6.528 -14.464 7.931 1.00 0.00 H new ATOM 0 HD21 ASN A 27 4.468 -14.529 9.168 1.00 0.00 H new ATOM 0 HD22 ASN A 27 3.090 -15.325 8.400 1.00 0.00 H new ATOM 415 N ALA A 28 8.116 -12.207 7.898 1.00 0.00 N ATOM 416 CA ALA A 28 9.482 -11.706 7.862 1.00 0.00 C ATOM 417 C ALA A 28 10.304 -12.325 6.735 1.00 0.00 C ATOM 418 O ALA A 28 11.127 -11.642 6.111 1.00 0.00 O ATOM 419 CB ALA A 28 10.157 -11.922 9.204 1.00 0.00 C ATOM 0 H ALA A 28 7.855 -12.633 8.787 1.00 0.00 H new ATOM 0 HA ALA A 28 9.428 -10.637 7.658 1.00 0.00 H new ATOM 0 HB1 ALA A 28 11.178 -11.543 9.163 1.00 0.00 H new ATOM 0 HB2 ALA A 28 9.604 -11.392 9.979 1.00 0.00 H new ATOM 0 HB3 ALA A 28 10.175 -12.987 9.435 1.00 0.00 H new ATOM 425 N LYS A 29 10.017 -13.575 6.400 1.00 0.00 N ATOM 426 CA LYS A 29 10.832 -14.262 5.401 1.00 0.00 C ATOM 427 C LYS A 29 10.482 -13.751 4.010 1.00 0.00 C ATOM 428 O LYS A 29 11.353 -13.474 3.154 1.00 0.00 O ATOM 429 CB LYS A 29 10.659 -15.798 5.474 1.00 0.00 C ATOM 430 CG LYS A 29 9.259 -16.308 5.101 1.00 0.00 C ATOM 431 CD LYS A 29 9.211 -17.819 4.943 1.00 0.00 C ATOM 432 CE LYS A 29 9.522 -18.554 6.234 1.00 0.00 C ATOM 433 NZ LYS A 29 9.438 -20.012 6.050 1.00 0.00 N ATOM 0 H LYS A 29 9.250 -14.123 6.790 1.00 0.00 H new ATOM 0 HA LYS A 29 11.879 -14.045 5.613 1.00 0.00 H new ATOM 0 HB2 LYS A 29 11.388 -16.263 4.811 1.00 0.00 H new ATOM 0 HB3 LYS A 29 10.893 -16.128 6.486 1.00 0.00 H new ATOM 0 HG2 LYS A 29 8.549 -16.004 5.870 1.00 0.00 H new ATOM 0 HG3 LYS A 29 8.941 -15.839 4.170 1.00 0.00 H new ATOM 0 HD2 LYS A 29 8.221 -18.112 4.592 1.00 0.00 H new ATOM 0 HD3 LYS A 29 9.924 -18.123 4.176 1.00 0.00 H new ATOM 0 HE2 LYS A 29 10.521 -18.285 6.577 1.00 0.00 H new ATOM 0 HE3 LYS A 29 8.824 -18.242 7.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 9.655 -20.488 6.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 8.477 -20.269 5.746 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 10.122 -20.310 5.326 1.00 0.00 H new ATOM 447 N ASN A 30 9.223 -13.528 3.807 1.00 0.00 N ATOM 448 CA ASN A 30 8.778 -13.158 2.519 1.00 0.00 C ATOM 449 C ASN A 30 8.865 -11.679 2.340 1.00 0.00 C ATOM 450 O ASN A 30 8.882 -11.203 1.250 1.00 0.00 O ATOM 451 CB ASN A 30 7.388 -13.734 2.171 1.00 0.00 C ATOM 452 CG ASN A 30 6.187 -13.189 2.965 1.00 0.00 C ATOM 453 OD1 ASN A 30 6.157 -12.055 3.397 1.00 0.00 O ATOM 454 ND2 ASN A 30 5.187 -14.010 3.149 1.00 0.00 N ATOM 0 H ASN A 30 8.495 -13.597 4.518 1.00 0.00 H new ATOM 0 HA ASN A 30 9.452 -13.614 1.794 1.00 0.00 H new ATOM 0 HB2 ASN A 30 7.203 -13.556 1.112 1.00 0.00 H new ATOM 0 HB3 ASN A 30 7.424 -14.814 2.311 1.00 0.00 H new ATOM 0 HD21 ASN A 30 4.362 -13.702 3.664 1.00 0.00 H new ATOM 0 HD22 ASN A 30 5.231 -14.959 2.778 1.00 0.00 H new ATOM 461 N CYS A 31 8.952 -10.976 3.440 1.00 0.00 N ATOM 462 CA CYS A 31 9.119 -9.539 3.443 1.00 0.00 C ATOM 463 C CYS A 31 10.485 -9.173 2.926 1.00 0.00 C ATOM 464 O CYS A 31 10.607 -8.295 2.102 1.00 0.00 O ATOM 465 CB CYS A 31 8.949 -8.987 4.844 1.00 0.00 C ATOM 466 SG CYS A 31 9.213 -7.209 5.021 1.00 0.00 S ATOM 0 H CYS A 31 8.909 -11.387 4.372 1.00 0.00 H new ATOM 0 HA CYS A 31 8.357 -9.106 2.794 1.00 0.00 H new ATOM 0 HB2 CYS A 31 7.942 -9.222 5.188 1.00 0.00 H new ATOM 0 HB3 CYS A 31 9.642 -9.507 5.506 1.00 0.00 H new ATOM 0 HG CYS A 31 9.246 -6.899 6.283 1.00 0.00 H new ATOM 472 N ARG A 32 11.512 -9.858 3.406 1.00 0.00 N ATOM 473 CA ARG A 32 12.868 -9.574 2.963 1.00 0.00 C ATOM 474 C ARG A 32 13.013 -9.928 1.484 1.00 0.00 C ATOM 475 O ARG A 32 13.600 -9.171 0.684 1.00 0.00 O ATOM 476 CB ARG A 32 13.886 -10.308 3.844 1.00 0.00 C ATOM 477 CG ARG A 32 13.810 -11.824 3.814 1.00 0.00 C ATOM 478 CD ARG A 32 14.885 -12.402 2.901 1.00 0.00 C ATOM 479 NE ARG A 32 14.956 -13.856 2.976 1.00 0.00 N ATOM 480 CZ ARG A 32 15.449 -14.650 2.023 1.00 0.00 C ATOM 481 NH1 ARG A 32 15.836 -14.138 0.864 1.00 0.00 N ATOM 482 NH2 ARG A 32 15.547 -15.956 2.238 1.00 0.00 N ATOM 0 H ARG A 32 11.434 -10.606 4.095 1.00 0.00 H new ATOM 0 HA ARG A 32 13.072 -8.508 3.068 1.00 0.00 H new ATOM 0 HB2 ARG A 32 14.888 -10.007 3.538 1.00 0.00 H new ATOM 0 HB3 ARG A 32 13.754 -9.976 4.874 1.00 0.00 H new ATOM 0 HG2 ARG A 32 13.932 -12.219 4.823 1.00 0.00 H new ATOM 0 HG3 ARG A 32 12.825 -12.136 3.467 1.00 0.00 H new ATOM 0 HD2 ARG A 32 14.683 -12.104 1.872 1.00 0.00 H new ATOM 0 HD3 ARG A 32 15.853 -11.979 3.171 1.00 0.00 H new ATOM 0 HE ARG A 32 14.601 -14.301 3.822 1.00 0.00 H new ATOM 0 HH11 ARG A 32 15.758 -13.135 0.698 1.00 0.00 H new ATOM 0 HH12 ARG A 32 16.212 -14.747 0.138 1.00 0.00 H new ATOM 0 HH21 ARG A 32 15.246 -16.350 3.129 1.00 0.00 H new ATOM 0 HH22 ARG A 32 15.923 -16.566 1.512 1.00 0.00 H new ATOM 496 N SER A 33 12.437 -11.054 1.122 1.00 0.00 N ATOM 497 CA SER A 33 12.411 -11.486 -0.246 1.00 0.00 C ATOM 498 C SER A 33 11.630 -10.477 -1.109 1.00 0.00 C ATOM 499 O SER A 33 12.045 -10.110 -2.219 1.00 0.00 O ATOM 500 CB SER A 33 11.774 -12.861 -0.291 1.00 0.00 C ATOM 501 OG SER A 33 12.527 -13.778 0.491 1.00 0.00 O ATOM 0 H SER A 33 11.976 -11.691 1.772 1.00 0.00 H new ATOM 0 HA SER A 33 13.422 -11.541 -0.650 1.00 0.00 H new ATOM 0 HB2 SER A 33 10.751 -12.808 0.082 1.00 0.00 H new ATOM 0 HB3 SER A 33 11.719 -13.211 -1.322 1.00 0.00 H new ATOM 0 HG SER A 33 12.200 -13.766 1.415 1.00 0.00 H new ATOM 507 N LEU A 34 10.547 -9.978 -0.552 1.00 0.00 N ATOM 508 CA LEU A 34 9.669 -9.031 -1.226 1.00 0.00 C ATOM 509 C LEU A 34 10.417 -7.763 -1.459 1.00 0.00 C ATOM 510 O LEU A 34 10.389 -7.210 -2.513 1.00 0.00 O ATOM 511 CB LEU A 34 8.466 -8.702 -0.362 1.00 0.00 C ATOM 512 CG LEU A 34 7.325 -7.992 -1.075 1.00 0.00 C ATOM 513 CD1 LEU A 34 6.519 -8.930 -1.947 1.00 0.00 C ATOM 514 CD2 LEU A 34 6.469 -7.236 -0.119 1.00 0.00 C ATOM 0 H LEU A 34 10.244 -10.218 0.392 1.00 0.00 H new ATOM 0 HA LEU A 34 9.336 -9.478 -2.163 1.00 0.00 H new ATOM 0 HB2 LEU A 34 8.084 -9.628 0.067 1.00 0.00 H new ATOM 0 HB3 LEU A 34 8.796 -8.079 0.469 1.00 0.00 H new ATOM 0 HG LEU A 34 7.775 -7.263 -1.748 1.00 0.00 H new ATOM 0 HD11 LEU A 34 5.717 -8.375 -2.434 1.00 0.00 H new ATOM 0 HD12 LEU A 34 7.168 -9.370 -2.704 1.00 0.00 H new ATOM 0 HD13 LEU A 34 6.091 -9.721 -1.332 1.00 0.00 H new ATOM 0 HD21 LEU A 34 5.664 -6.742 -0.663 1.00 0.00 H new ATOM 0 HD22 LEU A 34 6.043 -7.924 0.611 1.00 0.00 H new ATOM 0 HD23 LEU A 34 7.072 -6.488 0.396 1.00 0.00 H new ATOM 526 N MET A 35 11.130 -7.383 -0.456 1.00 0.00 N ATOM 527 CA MET A 35 11.927 -6.180 -0.394 1.00 0.00 C ATOM 528 C MET A 35 12.957 -6.161 -1.512 1.00 0.00 C ATOM 529 O MET A 35 13.387 -5.109 -1.967 1.00 0.00 O ATOM 530 CB MET A 35 12.583 -6.184 0.962 1.00 0.00 C ATOM 531 CG MET A 35 13.230 -4.913 1.406 1.00 0.00 C ATOM 532 SD MET A 35 13.718 -5.028 3.139 1.00 0.00 S ATOM 533 CE MET A 35 12.129 -5.425 3.910 1.00 0.00 C ATOM 0 H MET A 35 11.184 -7.930 0.403 1.00 0.00 H new ATOM 0 HA MET A 35 11.317 -5.286 -0.526 1.00 0.00 H new ATOM 0 HB2 MET A 35 11.830 -6.457 1.702 1.00 0.00 H new ATOM 0 HB3 MET A 35 13.338 -6.970 0.971 1.00 0.00 H new ATOM 0 HG2 MET A 35 14.104 -4.707 0.788 1.00 0.00 H new ATOM 0 HG3 MET A 35 12.541 -4.080 1.270 1.00 0.00 H new ATOM 0 HE1 MET A 35 12.240 -5.424 4.994 1.00 0.00 H new ATOM 0 HE2 MET A 35 11.388 -4.680 3.621 1.00 0.00 H new ATOM 0 HE3 MET A 35 11.801 -6.411 3.580 1.00 0.00 H new ATOM 543 N HIS A 36 13.388 -7.337 -1.912 1.00 0.00 N ATOM 544 CA HIS A 36 14.296 -7.448 -3.030 1.00 0.00 C ATOM 545 C HIS A 36 13.588 -7.716 -4.360 1.00 0.00 C ATOM 546 O HIS A 36 14.204 -7.620 -5.409 1.00 0.00 O ATOM 547 CB HIS A 36 15.393 -8.468 -2.769 1.00 0.00 C ATOM 548 CG HIS A 36 16.401 -8.002 -1.759 1.00 0.00 C ATOM 549 ND1 HIS A 36 17.750 -7.922 -2.014 1.00 0.00 N ATOM 550 CD2 HIS A 36 16.243 -7.578 -0.483 1.00 0.00 C ATOM 551 CE1 HIS A 36 18.370 -7.474 -0.947 1.00 0.00 C ATOM 552 NE2 HIS A 36 17.480 -7.256 -0.004 1.00 0.00 N ATOM 0 H HIS A 36 13.126 -8.224 -1.482 1.00 0.00 H new ATOM 0 HA HIS A 36 14.766 -6.470 -3.127 1.00 0.00 H new ATOM 0 HB2 HIS A 36 14.942 -9.397 -2.421 1.00 0.00 H new ATOM 0 HB3 HIS A 36 15.903 -8.692 -3.706 1.00 0.00 H new ATOM 0 HD2 HIS A 36 15.310 -7.508 0.057 1.00 0.00 H new ATOM 0 HE1 HIS A 36 19.434 -7.312 -0.859 1.00 0.00 H new ATOM 0 HE2 HIS A 36 17.681 -6.904 0.932 1.00 0.00 H new ATOM 561 N HIS A 37 12.305 -8.049 -4.329 1.00 0.00 N ATOM 562 CA HIS A 37 11.555 -8.313 -5.580 1.00 0.00 C ATOM 563 C HIS A 37 10.581 -7.194 -5.936 1.00 0.00 C ATOM 564 O HIS A 37 10.002 -7.189 -7.028 1.00 0.00 O ATOM 565 CB HIS A 37 10.792 -9.640 -5.545 1.00 0.00 C ATOM 566 CG HIS A 37 11.619 -10.878 -5.719 1.00 0.00 C ATOM 567 ND1 HIS A 37 12.426 -11.522 -4.868 1.00 0.00 N flip ATOM 568 CD2 HIS A 37 11.625 -11.622 -6.873 1.00 0.00 C flip ATOM 569 CE1 HIS A 37 12.906 -12.629 -5.510 1.00 0.00 C flip ATOM 570 NE2 HIS A 37 12.402 -12.664 -6.721 1.00 0.00 N flip ATOM 0 H HIS A 37 11.757 -8.145 -3.474 1.00 0.00 H new ATOM 0 HA HIS A 37 12.323 -8.368 -6.351 1.00 0.00 H new ATOM 0 HB2 HIS A 37 10.266 -9.709 -4.593 1.00 0.00 H new ATOM 0 HB3 HIS A 37 10.033 -9.621 -6.327 1.00 0.00 H new ATOM 0 HD1 HIS A 37 12.644 -11.238 -3.913 1.00 0.00 H new ATOM 0 HD2 HIS A 37 11.072 -11.384 -7.770 1.00 0.00 H new ATOM 0 HE1 HIS A 37 13.587 -13.355 -5.090 1.00 0.00 H new ATOM 579 N VAL A 38 10.384 -6.274 -5.036 1.00 0.00 N ATOM 580 CA VAL A 38 9.481 -5.178 -5.275 1.00 0.00 C ATOM 581 C VAL A 38 10.104 -3.889 -4.747 1.00 0.00 C ATOM 582 O VAL A 38 11.015 -3.931 -3.927 1.00 0.00 O ATOM 583 CB VAL A 38 8.076 -5.431 -4.628 1.00 0.00 C ATOM 584 CG1 VAL A 38 8.061 -5.246 -3.133 1.00 0.00 C ATOM 585 CG2 VAL A 38 7.021 -4.605 -5.287 1.00 0.00 C ATOM 0 H VAL A 38 10.839 -6.259 -4.123 1.00 0.00 H new ATOM 0 HA VAL A 38 9.320 -5.088 -6.349 1.00 0.00 H new ATOM 0 HB VAL A 38 7.850 -6.483 -4.802 1.00 0.00 H new ATOM 0 HG11 VAL A 38 7.057 -5.437 -2.753 1.00 0.00 H new ATOM 0 HG12 VAL A 38 8.762 -5.943 -2.673 1.00 0.00 H new ATOM 0 HG13 VAL A 38 8.353 -4.224 -2.890 1.00 0.00 H new ATOM 0 HG21 VAL A 38 6.058 -4.802 -4.817 1.00 0.00 H new ATOM 0 HG22 VAL A 38 7.267 -3.548 -5.181 1.00 0.00 H new ATOM 0 HG23 VAL A 38 6.967 -4.860 -6.345 1.00 0.00 H new ATOM 595 N LYS A 39 9.632 -2.767 -5.237 1.00 0.00 N ATOM 596 CA LYS A 39 10.146 -1.474 -4.841 1.00 0.00 C ATOM 597 C LYS A 39 9.551 -1.034 -3.514 1.00 0.00 C ATOM 598 O LYS A 39 10.258 -0.873 -2.524 1.00 0.00 O ATOM 599 CB LYS A 39 9.822 -0.455 -5.927 1.00 0.00 C ATOM 600 CG LYS A 39 10.224 0.963 -5.599 1.00 0.00 C ATOM 601 CD LYS A 39 9.884 1.899 -6.730 1.00 0.00 C ATOM 602 CE LYS A 39 10.101 3.341 -6.338 1.00 0.00 C ATOM 603 NZ LYS A 39 11.516 3.641 -5.991 1.00 0.00 N ATOM 0 H LYS A 39 8.879 -2.723 -5.923 1.00 0.00 H new ATOM 0 HA LYS A 39 11.226 -1.547 -4.714 1.00 0.00 H new ATOM 0 HB2 LYS A 39 10.320 -0.756 -6.849 1.00 0.00 H new ATOM 0 HB3 LYS A 39 8.750 -0.479 -6.121 1.00 0.00 H new ATOM 0 HG2 LYS A 39 9.717 1.287 -4.690 1.00 0.00 H new ATOM 0 HG3 LYS A 39 11.295 1.004 -5.399 1.00 0.00 H new ATOM 0 HD2 LYS A 39 10.498 1.660 -7.598 1.00 0.00 H new ATOM 0 HD3 LYS A 39 8.845 1.753 -7.025 1.00 0.00 H new ATOM 0 HE2 LYS A 39 9.789 3.986 -7.159 1.00 0.00 H new ATOM 0 HE3 LYS A 39 9.465 3.580 -5.486 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 11.621 4.660 -5.813 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 11.784 3.111 -5.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 12.134 3.362 -6.780 1.00 0.00 H new ATOM 617 N ASN A 40 8.260 -0.819 -3.520 1.00 0.00 N ATOM 618 CA ASN A 40 7.512 -0.414 -2.379 1.00 0.00 C ATOM 619 C ASN A 40 6.041 -0.638 -2.745 1.00 0.00 C ATOM 620 O ASN A 40 5.775 -1.340 -3.745 1.00 0.00 O ATOM 621 CB ASN A 40 7.850 1.074 -1.997 1.00 0.00 C ATOM 622 CG ASN A 40 7.175 1.557 -0.716 1.00 0.00 C ATOM 623 OD1 ASN A 40 6.119 2.119 -0.754 1.00 0.00 O ATOM 624 ND2 ASN A 40 7.759 1.292 0.407 1.00 0.00 N ATOM 0 H ASN A 40 7.688 -0.928 -4.357 1.00 0.00 H new ATOM 0 HA ASN A 40 7.757 -0.990 -1.487 1.00 0.00 H new ATOM 0 HB2 ASN A 40 8.930 1.173 -1.886 1.00 0.00 H new ATOM 0 HB3 ASN A 40 7.553 1.725 -2.819 1.00 0.00 H new ATOM 0 HD21 ASN A 40 7.320 1.563 1.287 1.00 0.00 H new ATOM 0 HD22 ASN A 40 8.659 0.812 0.413 1.00 0.00 H new ATOM 631 N ILE A 41 5.137 -0.038 -1.996 1.00 0.00 N ATOM 632 CA ILE A 41 3.691 -0.146 -2.107 1.00 0.00 C ATOM 633 C ILE A 41 3.213 -0.119 -3.565 1.00 0.00 C ATOM 634 O ILE A 41 2.450 -0.982 -3.979 1.00 0.00 O ATOM 635 CB ILE A 41 3.067 1.066 -1.398 1.00 0.00 C ATOM 636 CG1 ILE A 41 3.405 1.074 0.095 1.00 0.00 C ATOM 637 CG2 ILE A 41 1.543 1.123 -1.605 1.00 0.00 C ATOM 638 CD1 ILE A 41 2.946 2.327 0.805 1.00 0.00 C ATOM 0 H ILE A 41 5.412 0.585 -1.237 1.00 0.00 H new ATOM 0 HA ILE A 41 3.393 -1.095 -1.662 1.00 0.00 H new ATOM 0 HB ILE A 41 3.501 1.957 -1.851 1.00 0.00 H new ATOM 0 HG12 ILE A 41 2.945 0.207 0.569 1.00 0.00 H new ATOM 0 HG13 ILE A 41 4.483 0.970 0.217 1.00 0.00 H new ATOM 0 HG21 ILE A 41 1.138 1.993 -1.089 1.00 0.00 H new ATOM 0 HG22 ILE A 41 1.323 1.198 -2.670 1.00 0.00 H new ATOM 0 HG23 ILE A 41 1.087 0.218 -1.203 1.00 0.00 H new ATOM 0 HD11 ILE A 41 3.217 2.268 1.859 1.00 0.00 H new ATOM 0 HD12 ILE A 41 3.426 3.196 0.355 1.00 0.00 H new ATOM 0 HD13 ILE A 41 1.864 2.422 0.713 1.00 0.00 H new ATOM 650 N ALA A 42 3.685 0.884 -4.332 1.00 0.00 N ATOM 651 CA ALA A 42 3.255 1.062 -5.732 1.00 0.00 C ATOM 652 C ALA A 42 3.431 -0.190 -6.573 1.00 0.00 C ATOM 653 O ALA A 42 2.468 -0.698 -7.143 1.00 0.00 O ATOM 654 CB ALA A 42 3.977 2.231 -6.364 1.00 0.00 C ATOM 0 H ALA A 42 4.359 1.578 -4.008 1.00 0.00 H new ATOM 0 HA ALA A 42 2.185 1.270 -5.704 1.00 0.00 H new ATOM 0 HB1 ALA A 42 3.647 2.347 -7.396 1.00 0.00 H new ATOM 0 HB2 ALA A 42 3.753 3.141 -5.807 1.00 0.00 H new ATOM 0 HB3 ALA A 42 5.051 2.049 -6.345 1.00 0.00 H new ATOM 660 N GLU A 43 4.626 -0.729 -6.581 1.00 0.00 N ATOM 661 CA GLU A 43 4.921 -1.887 -7.389 1.00 0.00 C ATOM 662 C GLU A 43 4.298 -3.123 -6.779 1.00 0.00 C ATOM 663 O GLU A 43 3.888 -4.015 -7.488 1.00 0.00 O ATOM 664 CB GLU A 43 6.428 -2.048 -7.557 1.00 0.00 C ATOM 665 CG GLU A 43 7.097 -0.848 -8.192 1.00 0.00 C ATOM 666 CD GLU A 43 6.571 -0.550 -9.571 1.00 0.00 C ATOM 667 OE1 GLU A 43 7.056 -1.157 -10.540 1.00 0.00 O ATOM 668 OE2 GLU A 43 5.702 0.334 -9.706 1.00 0.00 O ATOM 0 H GLU A 43 5.414 -0.382 -6.034 1.00 0.00 H new ATOM 0 HA GLU A 43 4.489 -1.748 -8.380 1.00 0.00 H new ATOM 0 HB2 GLU A 43 6.877 -2.230 -6.581 1.00 0.00 H new ATOM 0 HB3 GLU A 43 6.625 -2.929 -8.167 1.00 0.00 H new ATOM 0 HG2 GLU A 43 6.949 0.024 -7.555 1.00 0.00 H new ATOM 0 HG3 GLU A 43 8.171 -1.024 -8.248 1.00 0.00 H new ATOM 675 N LEU A 44 4.213 -3.148 -5.456 1.00 0.00 N ATOM 676 CA LEU A 44 3.586 -4.241 -4.730 1.00 0.00 C ATOM 677 C LEU A 44 2.107 -4.364 -5.100 1.00 0.00 C ATOM 678 O LEU A 44 1.575 -5.444 -5.222 1.00 0.00 O ATOM 679 CB LEU A 44 3.741 -4.018 -3.218 1.00 0.00 C ATOM 680 CG LEU A 44 3.056 -5.032 -2.305 1.00 0.00 C ATOM 681 CD1 LEU A 44 3.556 -6.436 -2.595 1.00 0.00 C ATOM 682 CD2 LEU A 44 3.298 -4.675 -0.856 1.00 0.00 C ATOM 0 H LEU A 44 4.578 -2.409 -4.856 1.00 0.00 H new ATOM 0 HA LEU A 44 4.082 -5.171 -5.007 1.00 0.00 H new ATOM 0 HB2 LEU A 44 4.805 -4.011 -2.982 1.00 0.00 H new ATOM 0 HB3 LEU A 44 3.354 -3.027 -2.978 1.00 0.00 H new ATOM 0 HG LEU A 44 1.984 -5.004 -2.499 1.00 0.00 H new ATOM 0 HD11 LEU A 44 3.056 -7.144 -1.934 1.00 0.00 H new ATOM 0 HD12 LEU A 44 3.339 -6.692 -3.632 1.00 0.00 H new ATOM 0 HD13 LEU A 44 4.632 -6.481 -2.427 1.00 0.00 H new ATOM 0 HD21 LEU A 44 2.805 -5.405 -0.214 1.00 0.00 H new ATOM 0 HD22 LEU A 44 4.369 -4.679 -0.654 1.00 0.00 H new ATOM 0 HD23 LEU A 44 2.895 -3.683 -0.653 1.00 0.00 H new ATOM 694 N ALA A 45 1.464 -3.253 -5.271 1.00 0.00 N ATOM 695 CA ALA A 45 0.084 -3.247 -5.625 1.00 0.00 C ATOM 696 C ALA A 45 -0.119 -3.366 -7.131 1.00 0.00 C ATOM 697 O ALA A 45 -1.223 -3.644 -7.603 1.00 0.00 O ATOM 698 CB ALA A 45 -0.568 -2.017 -5.070 1.00 0.00 C ATOM 0 H ALA A 45 1.881 -2.328 -5.169 1.00 0.00 H new ATOM 0 HA ALA A 45 -0.392 -4.124 -5.186 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -1.624 -2.011 -5.340 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -0.471 -2.012 -3.984 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -0.084 -1.131 -5.481 1.00 0.00 H new ATOM 704 N ALA A 46 0.952 -3.145 -7.870 1.00 0.00 N ATOM 705 CA ALA A 46 0.922 -3.188 -9.326 1.00 0.00 C ATOM 706 C ALA A 46 1.248 -4.576 -9.860 1.00 0.00 C ATOM 707 O ALA A 46 0.903 -4.914 -11.013 1.00 0.00 O ATOM 708 CB ALA A 46 1.916 -2.194 -9.885 1.00 0.00 C ATOM 0 H ALA A 46 1.870 -2.930 -7.480 1.00 0.00 H new ATOM 0 HA ALA A 46 -0.089 -2.933 -9.643 1.00 0.00 H new ATOM 0 HB1 ALA A 46 1.891 -2.228 -10.974 1.00 0.00 H new ATOM 0 HB2 ALA A 46 1.656 -1.191 -9.548 1.00 0.00 H new ATOM 0 HB3 ALA A 46 2.918 -2.446 -9.537 1.00 0.00 H new ATOM 714 N LEU A 47 1.920 -5.371 -9.058 1.00 0.00 N ATOM 715 CA LEU A 47 2.319 -6.684 -9.475 1.00 0.00 C ATOM 716 C LEU A 47 1.154 -7.687 -9.552 1.00 0.00 C ATOM 717 O LEU A 47 -0.001 -7.366 -9.218 1.00 0.00 O ATOM 718 CB LEU A 47 3.547 -7.203 -8.688 1.00 0.00 C ATOM 719 CG LEU A 47 3.481 -7.147 -7.182 1.00 0.00 C ATOM 720 CD1 LEU A 47 2.378 -8.024 -6.702 1.00 0.00 C ATOM 721 CD2 LEU A 47 4.805 -7.566 -6.590 1.00 0.00 C ATOM 0 H LEU A 47 2.200 -5.123 -8.109 1.00 0.00 H new ATOM 0 HA LEU A 47 2.653 -6.586 -10.508 1.00 0.00 H new ATOM 0 HB2 LEU A 47 3.720 -8.239 -8.979 1.00 0.00 H new ATOM 0 HB3 LEU A 47 4.418 -6.632 -9.008 1.00 0.00 H new ATOM 0 HG LEU A 47 3.278 -6.125 -6.861 1.00 0.00 H new ATOM 0 HD11 LEU A 47 2.329 -7.985 -5.614 1.00 0.00 H new ATOM 0 HD12 LEU A 47 1.432 -7.681 -7.120 1.00 0.00 H new ATOM 0 HD13 LEU A 47 2.564 -9.050 -7.020 1.00 0.00 H new ATOM 0 HD21 LEU A 47 4.747 -7.522 -5.502 1.00 0.00 H new ATOM 0 HD22 LEU A 47 5.036 -8.585 -6.900 1.00 0.00 H new ATOM 0 HD23 LEU A 47 5.589 -6.894 -6.939 1.00 0.00 H new ATOM 733 N SER A 48 1.449 -8.868 -10.007 1.00 0.00 N ATOM 734 CA SER A 48 0.466 -9.906 -10.110 1.00 0.00 C ATOM 735 C SER A 48 0.597 -10.864 -8.914 1.00 0.00 C ATOM 736 O SER A 48 1.630 -10.889 -8.239 1.00 0.00 O ATOM 737 CB SER A 48 0.679 -10.652 -11.422 1.00 0.00 C ATOM 738 OG SER A 48 0.698 -9.750 -12.517 1.00 0.00 O ATOM 0 H SER A 48 2.381 -9.140 -10.318 1.00 0.00 H new ATOM 0 HA SER A 48 -0.537 -9.479 -10.098 1.00 0.00 H new ATOM 0 HB2 SER A 48 1.618 -11.204 -11.383 1.00 0.00 H new ATOM 0 HB3 SER A 48 -0.116 -11.385 -11.562 1.00 0.00 H new ATOM 0 HG SER A 48 0.838 -10.249 -13.349 1.00 0.00 H new ATOM 744 N GLN A 49 -0.425 -11.667 -8.672 1.00 0.00 N ATOM 745 CA GLN A 49 -0.418 -12.632 -7.579 1.00 0.00 C ATOM 746 C GLN A 49 0.615 -13.723 -7.875 1.00 0.00 C ATOM 747 O GLN A 49 1.181 -14.345 -6.960 1.00 0.00 O ATOM 748 CB GLN A 49 -1.841 -13.187 -7.386 1.00 0.00 C ATOM 749 CG GLN A 49 -2.028 -14.177 -6.244 1.00 0.00 C ATOM 750 CD GLN A 49 -1.997 -15.635 -6.680 1.00 0.00 C ATOM 751 OE1 GLN A 49 -1.342 -16.011 -7.655 1.00 0.00 O ATOM 752 NE2 GLN A 49 -2.722 -16.450 -5.978 1.00 0.00 N ATOM 0 H GLN A 49 -1.282 -11.671 -9.225 1.00 0.00 H new ATOM 0 HA GLN A 49 -0.126 -12.160 -6.641 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -2.517 -12.347 -7.226 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -2.148 -13.671 -8.313 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -1.246 -14.013 -5.502 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -2.980 -13.975 -5.753 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -3.250 -16.102 -5.178 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -2.764 -17.438 -6.226 1.00 0.00 H new ATOM 761 N ASP A 50 0.878 -13.911 -9.169 1.00 0.00 N ATOM 762 CA ASP A 50 1.932 -14.810 -9.669 1.00 0.00 C ATOM 763 C ASP A 50 3.241 -14.452 -9.034 1.00 0.00 C ATOM 764 O ASP A 50 3.967 -15.321 -8.528 1.00 0.00 O ATOM 765 CB ASP A 50 2.117 -14.640 -11.175 1.00 0.00 C ATOM 766 CG ASP A 50 1.023 -15.215 -12.013 1.00 0.00 C ATOM 767 OD1 ASP A 50 -0.107 -14.708 -11.983 1.00 0.00 O ATOM 768 OD2 ASP A 50 1.276 -16.183 -12.742 1.00 0.00 O ATOM 0 H ASP A 50 0.362 -13.440 -9.912 1.00 0.00 H new ATOM 0 HA ASP A 50 1.635 -15.832 -9.432 1.00 0.00 H new ATOM 0 HB2 ASP A 50 2.204 -13.577 -11.398 1.00 0.00 H new ATOM 0 HB3 ASP A 50 3.059 -15.105 -11.465 1.00 0.00 H new ATOM 773 N GLU A 51 3.507 -13.152 -9.020 1.00 0.00 N ATOM 774 CA GLU A 51 4.733 -12.602 -8.490 1.00 0.00 C ATOM 775 C GLU A 51 4.811 -12.904 -7.026 1.00 0.00 C ATOM 776 O GLU A 51 5.799 -13.428 -6.552 1.00 0.00 O ATOM 777 CB GLU A 51 4.778 -11.089 -8.697 1.00 0.00 C ATOM 778 CG GLU A 51 4.568 -10.651 -10.132 1.00 0.00 C ATOM 779 CD GLU A 51 5.573 -11.242 -11.070 1.00 0.00 C ATOM 780 OE1 GLU A 51 6.735 -10.792 -11.086 1.00 0.00 O ATOM 781 OE2 GLU A 51 5.235 -12.181 -11.791 1.00 0.00 O ATOM 0 H GLU A 51 2.865 -12.447 -9.383 1.00 0.00 H new ATOM 0 HA GLU A 51 5.577 -13.051 -9.013 1.00 0.00 H new ATOM 0 HB2 GLU A 51 4.015 -10.625 -8.072 1.00 0.00 H new ATOM 0 HB3 GLU A 51 5.742 -10.715 -8.352 1.00 0.00 H new ATOM 0 HG2 GLU A 51 3.566 -10.938 -10.452 1.00 0.00 H new ATOM 0 HG3 GLU A 51 4.621 -9.564 -10.187 1.00 0.00 H new ATOM 788 N LEU A 52 3.729 -12.633 -6.324 1.00 0.00 N ATOM 789 CA LEU A 52 3.667 -12.862 -4.896 1.00 0.00 C ATOM 790 C LEU A 52 3.882 -14.327 -4.552 1.00 0.00 C ATOM 791 O LEU A 52 4.533 -14.636 -3.582 1.00 0.00 O ATOM 792 CB LEU A 52 2.352 -12.366 -4.302 1.00 0.00 C ATOM 793 CG LEU A 52 2.063 -10.876 -4.429 1.00 0.00 C ATOM 794 CD1 LEU A 52 0.750 -10.535 -3.756 1.00 0.00 C ATOM 795 CD2 LEU A 52 3.200 -10.049 -3.848 1.00 0.00 C ATOM 0 H LEU A 52 2.873 -12.250 -6.725 1.00 0.00 H new ATOM 0 HA LEU A 52 4.479 -12.286 -4.452 1.00 0.00 H new ATOM 0 HB2 LEU A 52 1.537 -12.912 -4.776 1.00 0.00 H new ATOM 0 HB3 LEU A 52 2.337 -12.627 -3.244 1.00 0.00 H new ATOM 0 HG LEU A 52 1.981 -10.632 -5.488 1.00 0.00 H new ATOM 0 HD11 LEU A 52 0.557 -9.467 -3.855 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -0.057 -11.095 -4.228 1.00 0.00 H new ATOM 0 HD13 LEU A 52 0.804 -10.798 -2.699 1.00 0.00 H new ATOM 0 HD21 LEU A 52 2.969 -8.989 -3.951 1.00 0.00 H new ATOM 0 HD22 LEU A 52 3.324 -10.292 -2.793 1.00 0.00 H new ATOM 0 HD23 LEU A 52 4.123 -10.273 -4.383 1.00 0.00 H new ATOM 807 N THR A 53 3.378 -15.225 -5.364 1.00 0.00 N ATOM 808 CA THR A 53 3.565 -16.636 -5.094 1.00 0.00 C ATOM 809 C THR A 53 5.043 -17.007 -5.286 1.00 0.00 C ATOM 810 O THR A 53 5.572 -17.833 -4.584 1.00 0.00 O ATOM 811 CB THR A 53 2.704 -17.506 -6.011 1.00 0.00 C ATOM 812 OG1 THR A 53 1.355 -16.994 -6.044 1.00 0.00 O ATOM 813 CG2 THR A 53 2.665 -18.939 -5.493 1.00 0.00 C ATOM 0 H THR A 53 2.843 -15.012 -6.206 1.00 0.00 H new ATOM 0 HA THR A 53 3.259 -16.821 -4.064 1.00 0.00 H new ATOM 0 HB THR A 53 3.137 -17.488 -7.011 1.00 0.00 H new ATOM 0 HG1 THR A 53 1.343 -16.135 -6.515 1.00 0.00 H new ATOM 0 HG21 THR A 53 2.049 -19.548 -6.154 1.00 0.00 H new ATOM 0 HG22 THR A 53 3.677 -19.343 -5.465 1.00 0.00 H new ATOM 0 HG23 THR A 53 2.241 -18.951 -4.489 1.00 0.00 H new ATOM 821 N SER A 54 5.684 -16.351 -6.221 1.00 0.00 N ATOM 822 CA SER A 54 7.091 -16.596 -6.506 1.00 0.00 C ATOM 823 C SER A 54 7.978 -15.996 -5.394 1.00 0.00 C ATOM 824 O SER A 54 8.994 -16.582 -4.988 1.00 0.00 O ATOM 825 CB SER A 54 7.469 -16.014 -7.887 1.00 0.00 C ATOM 826 OG SER A 54 8.810 -16.324 -8.247 1.00 0.00 O ATOM 0 H SER A 54 5.256 -15.635 -6.807 1.00 0.00 H new ATOM 0 HA SER A 54 7.261 -17.672 -6.532 1.00 0.00 H new ATOM 0 HB2 SER A 54 6.790 -16.407 -8.644 1.00 0.00 H new ATOM 0 HB3 SER A 54 7.338 -14.932 -7.872 1.00 0.00 H new ATOM 0 HG SER A 54 9.010 -15.940 -9.126 1.00 0.00 H new ATOM 832 N ILE A 55 7.585 -14.831 -4.917 1.00 0.00 N ATOM 833 CA ILE A 55 8.329 -14.106 -3.902 1.00 0.00 C ATOM 834 C ILE A 55 8.131 -14.723 -2.528 1.00 0.00 C ATOM 835 O ILE A 55 9.093 -15.053 -1.835 1.00 0.00 O ATOM 836 CB ILE A 55 7.868 -12.629 -3.838 1.00 0.00 C ATOM 837 CG1 ILE A 55 8.096 -11.929 -5.179 1.00 0.00 C ATOM 838 CG2 ILE A 55 8.599 -11.892 -2.725 1.00 0.00 C ATOM 839 CD1 ILE A 55 7.453 -10.553 -5.277 1.00 0.00 C ATOM 0 H ILE A 55 6.736 -14.357 -5.224 1.00 0.00 H new ATOM 0 HA ILE A 55 9.382 -14.160 -4.179 1.00 0.00 H new ATOM 0 HB ILE A 55 6.800 -12.615 -3.623 1.00 0.00 H new ATOM 0 HG12 ILE A 55 9.168 -11.830 -5.348 1.00 0.00 H new ATOM 0 HG13 ILE A 55 7.704 -12.559 -5.977 1.00 0.00 H new ATOM 0 HG21 ILE A 55 8.264 -10.855 -2.694 1.00 0.00 H new ATOM 0 HG22 ILE A 55 8.386 -12.372 -1.770 1.00 0.00 H new ATOM 0 HG23 ILE A 55 9.672 -11.920 -2.914 1.00 0.00 H new ATOM 0 HD11 ILE A 55 7.660 -10.123 -6.257 1.00 0.00 H new ATOM 0 HD12 ILE A 55 6.375 -10.645 -5.142 1.00 0.00 H new ATOM 0 HD13 ILE A 55 7.862 -9.904 -4.503 1.00 0.00 H new ATOM 851 N LEU A 56 6.882 -14.871 -2.143 1.00 0.00 N ATOM 852 CA LEU A 56 6.549 -15.340 -0.821 1.00 0.00 C ATOM 853 C LEU A 56 6.722 -16.841 -0.770 1.00 0.00 C ATOM 854 O LEU A 56 6.979 -17.413 0.275 1.00 0.00 O ATOM 855 CB LEU A 56 5.102 -14.962 -0.440 1.00 0.00 C ATOM 856 CG LEU A 56 4.599 -13.541 -0.823 1.00 0.00 C ATOM 857 CD1 LEU A 56 3.233 -13.309 -0.256 1.00 0.00 C ATOM 858 CD2 LEU A 56 5.535 -12.433 -0.385 1.00 0.00 C ATOM 0 H LEU A 56 6.076 -14.671 -2.735 1.00 0.00 H new ATOM 0 HA LEU A 56 7.217 -14.863 -0.103 1.00 0.00 H new ATOM 0 HB2 LEU A 56 4.433 -15.689 -0.901 1.00 0.00 H new ATOM 0 HB3 LEU A 56 5.000 -15.074 0.639 1.00 0.00 H new ATOM 0 HG LEU A 56 4.565 -13.508 -1.912 1.00 0.00 H new ATOM 0 HD11 LEU A 56 2.890 -12.311 -0.530 1.00 0.00 H new ATOM 0 HD12 LEU A 56 2.543 -14.052 -0.655 1.00 0.00 H new ATOM 0 HD13 LEU A 56 3.271 -13.394 0.830 1.00 0.00 H new ATOM 0 HD21 LEU A 56 5.123 -11.469 -0.684 1.00 0.00 H new ATOM 0 HD22 LEU A 56 5.648 -12.459 0.699 1.00 0.00 H new ATOM 0 HD23 LEU A 56 6.509 -12.573 -0.854 1.00 0.00 H new ATOM 870 N GLY A 57 6.541 -17.460 -1.917 1.00 0.00 N ATOM 871 CA GLY A 57 6.731 -18.881 -2.064 1.00 0.00 C ATOM 872 C GLY A 57 5.517 -19.684 -1.691 1.00 0.00 C ATOM 873 O GLY A 57 5.521 -20.910 -1.812 1.00 0.00 O ATOM 0 H GLY A 57 6.257 -16.987 -2.775 1.00 0.00 H new ATOM 0 HA2 GLY A 57 6.999 -19.100 -3.098 1.00 0.00 H new ATOM 0 HA3 GLY A 57 7.570 -19.195 -1.443 1.00 0.00 H new ATOM 877 N ASN A 58 4.474 -19.011 -1.252 1.00 0.00 N ATOM 878 CA ASN A 58 3.245 -19.677 -0.858 1.00 0.00 C ATOM 879 C ASN A 58 2.079 -18.887 -1.387 1.00 0.00 C ATOM 880 O ASN A 58 1.970 -17.669 -1.128 1.00 0.00 O ATOM 881 CB ASN A 58 3.100 -19.814 0.687 1.00 0.00 C ATOM 882 CG ASN A 58 4.352 -19.470 1.475 1.00 0.00 C ATOM 883 OD1 ASN A 58 4.425 -18.253 1.928 1.00 0.00 O flip ATOM 884 ND2 ASN A 58 5.218 -20.303 1.701 1.00 0.00 N flip ATOM 0 H ASN A 58 4.451 -17.996 -1.158 1.00 0.00 H new ATOM 0 HA ASN A 58 3.270 -20.685 -1.273 1.00 0.00 H new ATOM 0 HB2 ASN A 58 2.288 -19.168 1.021 1.00 0.00 H new ATOM 0 HB3 ASN A 58 2.809 -20.838 0.922 1.00 0.00 H new ATOM 0 HD21 ASN A 58 5.126 -21.248 1.329 1.00 0.00 H new ATOM 0 HD22 ASN A 58 6.032 -20.053 2.262 1.00 0.00 H new ATOM 891 N ALA A 59 1.199 -19.562 -2.093 1.00 0.00 N ATOM 892 CA ALA A 59 0.035 -18.948 -2.710 1.00 0.00 C ATOM 893 C ALA A 59 -0.962 -18.479 -1.679 1.00 0.00 C ATOM 894 O ALA A 59 -1.783 -17.629 -1.965 1.00 0.00 O ATOM 895 CB ALA A 59 -0.640 -19.895 -3.678 1.00 0.00 C ATOM 0 H ALA A 59 1.269 -20.566 -2.259 1.00 0.00 H new ATOM 0 HA ALA A 59 0.395 -18.079 -3.261 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -1.507 -19.405 -4.122 1.00 0.00 H new ATOM 0 HB2 ALA A 59 0.062 -20.173 -4.464 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -0.962 -20.790 -3.146 1.00 0.00 H new ATOM 901 N ALA A 60 -0.893 -19.036 -0.481 1.00 0.00 N ATOM 902 CA ALA A 60 -1.766 -18.617 0.605 1.00 0.00 C ATOM 903 C ALA A 60 -1.459 -17.185 0.951 1.00 0.00 C ATOM 904 O ALA A 60 -2.330 -16.339 0.995 1.00 0.00 O ATOM 905 CB ALA A 60 -1.542 -19.468 1.829 1.00 0.00 C ATOM 0 H ALA A 60 -0.241 -19.781 -0.235 1.00 0.00 H new ATOM 0 HA ALA A 60 -2.802 -18.725 0.284 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -2.205 -19.137 2.628 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -1.753 -20.511 1.591 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -0.506 -19.372 2.154 1.00 0.00 H new ATOM 911 N ASN A 61 -0.187 -16.923 1.134 1.00 0.00 N ATOM 912 CA ASN A 61 0.299 -15.598 1.487 1.00 0.00 C ATOM 913 C ASN A 61 0.037 -14.641 0.341 1.00 0.00 C ATOM 914 O ASN A 61 -0.417 -13.520 0.543 1.00 0.00 O ATOM 915 CB ASN A 61 1.800 -15.650 1.770 1.00 0.00 C ATOM 916 CG ASN A 61 2.220 -16.326 3.074 1.00 0.00 C ATOM 917 OD1 ASN A 61 3.265 -16.028 3.594 1.00 0.00 O ATOM 918 ND2 ASN A 61 1.437 -17.211 3.603 1.00 0.00 N ATOM 0 H ASN A 61 0.549 -17.623 1.043 1.00 0.00 H new ATOM 0 HA ASN A 61 -0.223 -15.254 2.380 1.00 0.00 H new ATOM 0 HB2 ASN A 61 2.286 -16.169 0.944 1.00 0.00 H new ATOM 0 HB3 ASN A 61 2.183 -14.629 1.775 1.00 0.00 H new ATOM 0 HD21 ASN A 61 1.701 -17.669 4.475 1.00 0.00 H new ATOM 0 HD22 ASN A 61 0.556 -17.450 3.148 1.00 0.00 H new ATOM 925 N ALA A 62 0.282 -15.132 -0.871 1.00 0.00 N ATOM 926 CA ALA A 62 0.100 -14.363 -2.096 1.00 0.00 C ATOM 927 C ALA A 62 -1.358 -13.964 -2.286 1.00 0.00 C ATOM 928 O ALA A 62 -1.655 -12.840 -2.676 1.00 0.00 O ATOM 929 CB ALA A 62 0.578 -15.182 -3.288 1.00 0.00 C ATOM 0 H ALA A 62 0.615 -16.083 -1.030 1.00 0.00 H new ATOM 0 HA ALA A 62 0.690 -13.449 -2.020 1.00 0.00 H new ATOM 0 HB1 ALA A 62 0.441 -14.606 -4.203 1.00 0.00 H new ATOM 0 HB2 ALA A 62 1.634 -15.422 -3.164 1.00 0.00 H new ATOM 0 HB3 ALA A 62 0.001 -16.105 -3.350 1.00 0.00 H new ATOM 935 N LYS A 63 -2.258 -14.875 -1.958 1.00 0.00 N ATOM 936 CA LYS A 63 -3.666 -14.662 -2.147 1.00 0.00 C ATOM 937 C LYS A 63 -4.180 -13.680 -1.120 1.00 0.00 C ATOM 938 O LYS A 63 -4.962 -12.803 -1.445 1.00 0.00 O ATOM 939 CB LYS A 63 -4.410 -16.012 -2.080 1.00 0.00 C ATOM 940 CG LYS A 63 -5.925 -15.935 -2.169 1.00 0.00 C ATOM 941 CD LYS A 63 -6.542 -17.321 -2.051 1.00 0.00 C ATOM 942 CE LYS A 63 -8.061 -17.285 -2.163 1.00 0.00 C ATOM 943 NZ LYS A 63 -8.700 -16.564 -1.044 1.00 0.00 N ATOM 0 H LYS A 63 -2.024 -15.781 -1.553 1.00 0.00 H new ATOM 0 HA LYS A 63 -3.848 -14.232 -3.132 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -4.049 -16.646 -2.890 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -4.144 -16.506 -1.146 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -6.309 -15.292 -1.377 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -6.216 -15.481 -3.116 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -6.137 -17.965 -2.831 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -6.260 -17.762 -1.095 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -8.340 -16.809 -3.103 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -8.443 -18.305 -2.197 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -9.734 -16.643 -1.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -8.391 -16.979 -0.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -8.426 -15.561 -1.075 1.00 0.00 H new ATOM 957 N GLN A 64 -3.669 -13.797 0.100 1.00 0.00 N ATOM 958 CA GLN A 64 -4.070 -12.931 1.199 1.00 0.00 C ATOM 959 C GLN A 64 -3.745 -11.479 0.919 1.00 0.00 C ATOM 960 O GLN A 64 -4.607 -10.594 1.048 1.00 0.00 O ATOM 961 CB GLN A 64 -3.413 -13.376 2.494 1.00 0.00 C ATOM 962 CG GLN A 64 -3.901 -14.697 2.992 1.00 0.00 C ATOM 963 CD GLN A 64 -3.319 -15.031 4.331 1.00 0.00 C ATOM 964 OE1 GLN A 64 -3.882 -14.725 5.378 1.00 0.00 O ATOM 965 NE2 GLN A 64 -2.162 -15.602 4.310 1.00 0.00 N ATOM 0 H GLN A 64 -2.967 -14.493 0.353 1.00 0.00 H new ATOM 0 HA GLN A 64 -5.152 -13.014 1.301 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -2.335 -13.430 2.344 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -3.591 -12.621 3.260 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -4.989 -14.681 3.061 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -3.639 -15.476 2.276 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -1.727 -15.841 3.419 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -1.682 -15.815 5.185 1.00 0.00 H new ATOM 974 N LEU A 65 -2.526 -11.250 0.494 1.00 0.00 N ATOM 975 CA LEU A 65 -2.052 -9.919 0.239 1.00 0.00 C ATOM 976 C LEU A 65 -2.715 -9.317 -0.993 1.00 0.00 C ATOM 977 O LEU A 65 -3.248 -8.204 -0.937 1.00 0.00 O ATOM 978 CB LEU A 65 -0.527 -9.924 0.100 1.00 0.00 C ATOM 979 CG LEU A 65 0.135 -8.569 -0.139 1.00 0.00 C ATOM 980 CD1 LEU A 65 -0.235 -7.592 0.961 1.00 0.00 C ATOM 981 CD2 LEU A 65 1.640 -8.731 -0.216 1.00 0.00 C ATOM 0 H LEU A 65 -1.839 -11.982 0.317 1.00 0.00 H new ATOM 0 HA LEU A 65 -2.323 -9.290 1.087 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -0.102 -10.357 1.006 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -0.261 -10.585 -0.725 1.00 0.00 H new ATOM 0 HG LEU A 65 -0.225 -8.169 -1.087 1.00 0.00 H new ATOM 0 HD11 LEU A 65 0.247 -6.632 0.773 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -1.317 -7.458 0.980 1.00 0.00 H new ATOM 0 HD13 LEU A 65 0.099 -7.983 1.922 1.00 0.00 H new ATOM 0 HD21 LEU A 65 2.102 -7.759 -0.387 1.00 0.00 H new ATOM 0 HD22 LEU A 65 2.009 -9.149 0.720 1.00 0.00 H new ATOM 0 HD23 LEU A 65 1.892 -9.402 -1.037 1.00 0.00 H new ATOM 993 N TYR A 66 -2.734 -10.075 -2.080 1.00 0.00 N ATOM 994 CA TYR A 66 -3.267 -9.599 -3.352 1.00 0.00 C ATOM 995 C TYR A 66 -4.748 -9.228 -3.223 1.00 0.00 C ATOM 996 O TYR A 66 -5.214 -8.198 -3.791 1.00 0.00 O ATOM 997 CB TYR A 66 -3.066 -10.663 -4.436 1.00 0.00 C ATOM 998 CG TYR A 66 -3.330 -10.174 -5.831 1.00 0.00 C ATOM 999 CD1 TYR A 66 -2.382 -9.408 -6.491 1.00 0.00 C ATOM 1000 CD2 TYR A 66 -4.515 -10.468 -6.488 1.00 0.00 C ATOM 1001 CE1 TYR A 66 -2.604 -8.947 -7.762 1.00 0.00 C ATOM 1002 CE2 TYR A 66 -4.743 -10.012 -7.765 1.00 0.00 C ATOM 1003 CZ TYR A 66 -3.783 -9.250 -8.394 1.00 0.00 C ATOM 1004 OH TYR A 66 -4.015 -8.774 -9.649 1.00 0.00 O ATOM 0 H TYR A 66 -2.383 -11.032 -2.107 1.00 0.00 H new ATOM 0 HA TYR A 66 -2.724 -8.699 -3.639 1.00 0.00 H new ATOM 0 HB2 TYR A 66 -2.043 -11.034 -4.380 1.00 0.00 H new ATOM 0 HB3 TYR A 66 -3.723 -11.507 -4.228 1.00 0.00 H new ATOM 0 HD1 TYR A 66 -1.453 -9.170 -5.995 1.00 0.00 H new ATOM 0 HD2 TYR A 66 -5.268 -11.062 -5.991 1.00 0.00 H new ATOM 0 HE1 TYR A 66 -1.856 -8.350 -8.262 1.00 0.00 H new ATOM 0 HE2 TYR A 66 -5.667 -10.249 -8.271 1.00 0.00 H new ATOM 0 HH TYR A 66 -4.894 -9.078 -9.957 1.00 0.00 H new ATOM 1014 N ASP A 67 -5.467 -10.040 -2.466 1.00 0.00 N ATOM 1015 CA ASP A 67 -6.882 -9.829 -2.202 1.00 0.00 C ATOM 1016 C ASP A 67 -7.103 -8.557 -1.410 1.00 0.00 C ATOM 1017 O ASP A 67 -7.968 -7.765 -1.752 1.00 0.00 O ATOM 1018 CB ASP A 67 -7.489 -11.037 -1.477 1.00 0.00 C ATOM 1019 CG ASP A 67 -8.929 -10.838 -1.052 1.00 0.00 C ATOM 1020 OD1 ASP A 67 -9.810 -10.675 -1.925 1.00 0.00 O ATOM 1021 OD2 ASP A 67 -9.210 -10.893 0.160 1.00 0.00 O ATOM 0 H ASP A 67 -5.083 -10.870 -2.014 1.00 0.00 H new ATOM 0 HA ASP A 67 -7.390 -9.720 -3.160 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -7.430 -11.908 -2.130 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -6.888 -11.259 -0.595 1.00 0.00 H new ATOM 1026 N PHE A 68 -6.275 -8.331 -0.393 1.00 0.00 N ATOM 1027 CA PHE A 68 -6.379 -7.134 0.445 1.00 0.00 C ATOM 1028 C PHE A 68 -6.123 -5.873 -0.391 1.00 0.00 C ATOM 1029 O PHE A 68 -6.834 -4.884 -0.278 1.00 0.00 O ATOM 1030 CB PHE A 68 -5.393 -7.232 1.622 1.00 0.00 C ATOM 1031 CG PHE A 68 -5.417 -6.070 2.582 1.00 0.00 C ATOM 1032 CD1 PHE A 68 -6.545 -5.797 3.338 1.00 0.00 C ATOM 1033 CD2 PHE A 68 -4.306 -5.258 2.735 1.00 0.00 C ATOM 1034 CE1 PHE A 68 -6.564 -4.736 4.222 1.00 0.00 C ATOM 1035 CE2 PHE A 68 -4.320 -4.198 3.619 1.00 0.00 C ATOM 1036 CZ PHE A 68 -5.450 -3.937 4.363 1.00 0.00 C ATOM 0 H PHE A 68 -5.520 -8.963 -0.127 1.00 0.00 H new ATOM 0 HA PHE A 68 -7.389 -7.066 0.849 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -5.606 -8.145 2.178 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -4.384 -7.330 1.222 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -7.420 -6.421 3.235 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -3.417 -5.457 2.155 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -7.452 -4.533 4.803 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -3.446 -3.573 3.727 1.00 0.00 H new ATOM 0 HZ PHE A 68 -5.463 -3.108 5.055 1.00 0.00 H new ATOM 1046 N ILE A 69 -5.133 -5.959 -1.264 1.00 0.00 N ATOM 1047 CA ILE A 69 -4.753 -4.876 -2.186 1.00 0.00 C ATOM 1048 C ILE A 69 -5.916 -4.489 -3.130 1.00 0.00 C ATOM 1049 O ILE A 69 -6.054 -3.299 -3.553 1.00 0.00 O ATOM 1050 CB ILE A 69 -3.517 -5.318 -3.029 1.00 0.00 C ATOM 1051 CG1 ILE A 69 -2.291 -5.509 -2.133 1.00 0.00 C ATOM 1052 CG2 ILE A 69 -3.214 -4.346 -4.154 1.00 0.00 C ATOM 1053 CD1 ILE A 69 -1.099 -6.082 -2.863 1.00 0.00 C ATOM 0 H ILE A 69 -4.555 -6.793 -1.362 1.00 0.00 H new ATOM 0 HA ILE A 69 -4.505 -3.999 -1.588 1.00 0.00 H new ATOM 0 HB ILE A 69 -3.766 -6.274 -3.489 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -2.014 -4.548 -1.698 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -2.553 -6.169 -1.306 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -2.346 -4.695 -4.713 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -4.074 -4.282 -4.821 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -3.005 -3.361 -3.737 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -0.266 -6.191 -2.169 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -1.359 -7.057 -3.275 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -0.811 -5.411 -3.673 1.00 0.00 H new ATOM 1065 N HIS A 70 -6.727 -5.493 -3.471 1.00 0.00 N ATOM 1066 CA HIS A 70 -7.858 -5.323 -4.396 1.00 0.00 C ATOM 1067 C HIS A 70 -9.239 -5.452 -3.723 1.00 0.00 C ATOM 1068 O HIS A 70 -10.217 -5.750 -4.386 1.00 0.00 O ATOM 1069 CB HIS A 70 -7.745 -6.299 -5.571 1.00 0.00 C ATOM 1070 CG HIS A 70 -6.606 -5.992 -6.491 1.00 0.00 C ATOM 1071 ND1 HIS A 70 -5.343 -6.518 -6.326 1.00 0.00 N ATOM 1072 CD2 HIS A 70 -6.537 -5.186 -7.575 1.00 0.00 C ATOM 1073 CE1 HIS A 70 -4.547 -6.036 -7.270 1.00 0.00 C ATOM 1074 NE2 HIS A 70 -5.249 -5.230 -8.035 1.00 0.00 N ATOM 0 H HIS A 70 -6.622 -6.444 -3.117 1.00 0.00 H new ATOM 0 HA HIS A 70 -7.793 -4.298 -4.761 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -7.627 -7.311 -5.183 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -8.675 -6.282 -6.139 1.00 0.00 H new ATOM 0 HD1 HIS A 70 -5.065 -7.173 -5.595 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -7.349 -4.613 -7.999 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -3.499 -6.267 -7.390 1.00 0.00 H new ATOM 1083 N THR A 71 -9.312 -5.213 -2.450 1.00 0.00 N ATOM 1084 CA THR A 71 -10.583 -5.176 -1.739 1.00 0.00 C ATOM 1085 C THR A 71 -10.871 -3.733 -1.368 1.00 0.00 C ATOM 1086 O THR A 71 -10.137 -3.173 -0.620 1.00 0.00 O ATOM 1087 CB THR A 71 -10.513 -6.054 -0.452 1.00 0.00 C ATOM 1088 OG1 THR A 71 -10.461 -7.437 -0.810 1.00 0.00 O ATOM 1089 CG2 THR A 71 -11.679 -5.793 0.514 1.00 0.00 C ATOM 0 H THR A 71 -8.499 -5.036 -1.860 1.00 0.00 H new ATOM 0 HA THR A 71 -11.376 -5.571 -2.373 1.00 0.00 H new ATOM 0 HB THR A 71 -9.602 -5.776 0.078 1.00 0.00 H new ATOM 0 HG1 THR A 71 -9.529 -7.702 -0.956 1.00 0.00 H new ATOM 0 HG21 THR A 71 -11.576 -6.433 1.390 1.00 0.00 H new ATOM 0 HG22 THR A 71 -11.668 -4.748 0.824 1.00 0.00 H new ATOM 0 HG23 THR A 71 -12.622 -6.013 0.014 1.00 0.00 H new ATOM 1097 N SER A 72 -11.899 -3.132 -1.924 1.00 0.00 N ATOM 1098 CA SER A 72 -12.214 -1.738 -1.617 1.00 0.00 C ATOM 1099 C SER A 72 -12.533 -1.574 -0.131 1.00 0.00 C ATOM 1100 O SER A 72 -13.115 -2.490 0.500 1.00 0.00 O ATOM 1101 CB SER A 72 -13.410 -1.239 -2.450 1.00 0.00 C ATOM 1102 OG SER A 72 -13.731 0.113 -2.133 1.00 0.00 O ATOM 0 H SER A 72 -12.533 -3.576 -2.588 1.00 0.00 H new ATOM 0 HA SER A 72 -11.337 -1.142 -1.869 1.00 0.00 H new ATOM 0 HB2 SER A 72 -13.176 -1.321 -3.512 1.00 0.00 H new ATOM 0 HB3 SER A 72 -14.276 -1.874 -2.264 1.00 0.00 H new ATOM 0 HG SER A 72 -12.905 0.625 -2.007 1.00 0.00 H new ATOM 1108 N PHE A 73 -12.189 -0.403 0.419 1.00 0.00 N ATOM 1109 CA PHE A 73 -12.472 -0.071 1.814 1.00 0.00 C ATOM 1110 C PHE A 73 -13.984 -0.109 2.002 1.00 0.00 C ATOM 1111 O PHE A 73 -14.497 -0.425 3.082 1.00 0.00 O ATOM 1112 CB PHE A 73 -12.005 1.358 2.147 1.00 0.00 C ATOM 1113 CG PHE A 73 -10.706 1.791 1.518 1.00 0.00 C ATOM 1114 CD1 PHE A 73 -9.482 1.416 2.037 1.00 0.00 C ATOM 1115 CD2 PHE A 73 -10.727 2.586 0.380 1.00 0.00 C ATOM 1116 CE1 PHE A 73 -8.319 1.814 1.429 1.00 0.00 C ATOM 1117 CE2 PHE A 73 -9.562 2.995 -0.222 1.00 0.00 C ATOM 1118 CZ PHE A 73 -8.359 2.607 0.298 1.00 0.00 C ATOM 0 H PHE A 73 -11.708 0.337 -0.092 1.00 0.00 H new ATOM 0 HA PHE A 73 -11.953 -0.780 2.459 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -12.785 2.055 1.840 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -11.909 1.445 3.229 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -9.441 0.806 2.927 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -11.675 2.888 -0.039 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -7.367 1.506 1.836 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -9.596 3.620 -1.102 1.00 0.00 H new ATOM 0 HZ PHE A 73 -7.440 2.920 -0.175 1.00 0.00 H new ATOM 1516 N GLY B 115 -10.129 -2.648 8.576 1.00 0.00 N ATOM 1517 CA GLY B 115 -8.878 -3.184 8.011 1.00 0.00 C ATOM 1518 C GLY B 115 -8.179 -2.273 6.982 1.00 0.00 C ATOM 1519 O GLY B 115 -7.105 -1.723 7.266 1.00 0.00 O ATOM 0 HA2 GLY B 115 -8.184 -3.381 8.828 1.00 0.00 H new ATOM 0 HA3 GLY B 115 -9.093 -4.142 7.537 1.00 0.00 H new ATOM 1523 N PRO B 116 -8.752 -2.084 5.793 1.00 0.00 N ATOM 1524 CA PRO B 116 -8.143 -1.263 4.754 1.00 0.00 C ATOM 1525 C PRO B 116 -8.235 0.265 5.073 1.00 0.00 C ATOM 1526 O PRO B 116 -7.334 1.048 4.724 1.00 0.00 O ATOM 1527 CB PRO B 116 -8.942 -1.682 3.505 1.00 0.00 C ATOM 1528 CG PRO B 116 -10.282 -2.001 4.037 1.00 0.00 C ATOM 1529 CD PRO B 116 -10.026 -2.677 5.345 1.00 0.00 C ATOM 0 HA PRO B 116 -7.070 -1.416 4.639 1.00 0.00 H new ATOM 0 HB2 PRO B 116 -8.984 -0.879 2.769 1.00 0.00 H new ATOM 0 HB3 PRO B 116 -8.492 -2.543 3.012 1.00 0.00 H new ATOM 0 HG2 PRO B 116 -10.880 -1.099 4.169 1.00 0.00 H new ATOM 0 HG3 PRO B 116 -10.832 -2.651 3.357 1.00 0.00 H new ATOM 0 HD2 PRO B 116 -10.829 -2.490 6.058 1.00 0.00 H new ATOM 0 HD3 PRO B 116 -9.948 -3.758 5.230 1.00 0.00 H new ATOM 1537 N GLN B 117 -9.280 0.662 5.796 1.00 0.00 N ATOM 1538 CA GLN B 117 -9.476 2.059 6.202 1.00 0.00 C ATOM 1539 C GLN B 117 -8.349 2.489 7.154 1.00 0.00 C ATOM 1540 O GLN B 117 -7.711 3.535 6.976 1.00 0.00 O ATOM 1541 CB GLN B 117 -10.842 2.204 6.877 1.00 0.00 C ATOM 1542 CG GLN B 117 -11.145 3.603 7.404 1.00 0.00 C ATOM 1543 CD GLN B 117 -12.521 3.706 8.028 1.00 0.00 C ATOM 1544 OE1 GLN B 117 -13.043 2.739 8.577 1.00 0.00 O ATOM 1545 NE2 GLN B 117 -13.116 4.871 7.956 1.00 0.00 N ATOM 0 H GLN B 117 -10.014 0.031 6.118 1.00 0.00 H new ATOM 0 HA GLN B 117 -9.447 2.705 5.324 1.00 0.00 H new ATOM 0 HB2 GLN B 117 -11.617 1.923 6.164 1.00 0.00 H new ATOM 0 HB3 GLN B 117 -10.900 1.498 7.705 1.00 0.00 H new ATOM 0 HG2 GLN B 117 -10.393 3.879 8.144 1.00 0.00 H new ATOM 0 HG3 GLN B 117 -11.066 4.320 6.587 1.00 0.00 H new ATOM 0 HE21 GLN B 117 -12.653 5.653 7.492 1.00 0.00 H new ATOM 0 HE22 GLN B 117 -14.043 4.996 8.364 1.00 0.00 H new ATOM 1554 N ASP B 118 -8.084 1.643 8.132 1.00 0.00 N ATOM 1555 CA ASP B 118 -7.010 1.832 9.104 1.00 0.00 C ATOM 1556 C ASP B 118 -5.667 1.826 8.410 1.00 0.00 C ATOM 1557 O ASP B 118 -4.696 2.463 8.868 1.00 0.00 O ATOM 1558 CB ASP B 118 -7.050 0.729 10.175 1.00 0.00 C ATOM 1559 CG ASP B 118 -5.883 0.768 11.124 1.00 0.00 C ATOM 1560 OD1 ASP B 118 -5.839 1.655 11.992 1.00 0.00 O ATOM 1561 OD2 ASP B 118 -4.971 -0.078 10.993 1.00 0.00 O ATOM 0 H ASP B 118 -8.617 0.786 8.281 1.00 0.00 H new ATOM 0 HA ASP B 118 -7.154 2.797 9.590 1.00 0.00 H new ATOM 0 HB2 ASP B 118 -7.974 0.821 10.745 1.00 0.00 H new ATOM 0 HB3 ASP B 118 -7.075 -0.243 9.683 1.00 0.00 H new ATOM 1566 N PHE B 119 -5.596 1.105 7.302 1.00 0.00 N ATOM 1567 CA PHE B 119 -4.368 0.970 6.564 1.00 0.00 C ATOM 1568 C PHE B 119 -3.967 2.323 5.988 1.00 0.00 C ATOM 1569 O PHE B 119 -2.803 2.678 5.984 1.00 0.00 O ATOM 1570 CB PHE B 119 -4.526 -0.073 5.466 1.00 0.00 C ATOM 1571 CG PHE B 119 -3.238 -0.616 4.963 1.00 0.00 C ATOM 1572 CD1 PHE B 119 -2.414 -1.305 5.826 1.00 0.00 C ATOM 1573 CD2 PHE B 119 -2.858 -0.478 3.641 1.00 0.00 C ATOM 1574 CE1 PHE B 119 -1.235 -1.850 5.397 1.00 0.00 C ATOM 1575 CE2 PHE B 119 -1.667 -1.021 3.205 1.00 0.00 C ATOM 1576 CZ PHE B 119 -0.859 -1.710 4.090 1.00 0.00 C ATOM 0 H PHE B 119 -6.387 0.603 6.898 1.00 0.00 H new ATOM 0 HA PHE B 119 -3.576 0.632 7.233 1.00 0.00 H new ATOM 0 HB2 PHE B 119 -5.133 -0.896 5.844 1.00 0.00 H new ATOM 0 HB3 PHE B 119 -5.072 0.370 4.633 1.00 0.00 H new ATOM 0 HD1 PHE B 119 -2.704 -1.417 6.860 1.00 0.00 H new ATOM 0 HD2 PHE B 119 -3.494 0.055 2.949 1.00 0.00 H new ATOM 0 HE1 PHE B 119 -0.604 -2.389 6.088 1.00 0.00 H new ATOM 0 HE2 PHE B 119 -1.366 -0.908 2.174 1.00 0.00 H new ATOM 0 HZ PHE B 119 0.071 -2.139 3.748 1.00 0.00 H new ATOM 1586 N LEU B 120 -4.956 3.076 5.565 1.00 0.00 N ATOM 1587 CA LEU B 120 -4.752 4.417 5.034 1.00 0.00 C ATOM 1588 C LEU B 120 -4.349 5.377 6.119 1.00 0.00 C ATOM 1589 O LEU B 120 -3.349 6.038 6.019 1.00 0.00 O ATOM 1590 CB LEU B 120 -6.031 4.937 4.434 1.00 0.00 C ATOM 1591 CG LEU B 120 -6.640 4.118 3.347 1.00 0.00 C ATOM 1592 CD1 LEU B 120 -7.952 4.737 2.939 1.00 0.00 C ATOM 1593 CD2 LEU B 120 -5.692 4.021 2.169 1.00 0.00 C ATOM 0 H LEU B 120 -5.932 2.780 5.577 1.00 0.00 H new ATOM 0 HA LEU B 120 -3.964 4.348 4.284 1.00 0.00 H new ATOM 0 HB2 LEU B 120 -6.765 5.041 5.233 1.00 0.00 H new ATOM 0 HB3 LEU B 120 -5.842 5.936 4.042 1.00 0.00 H new ATOM 0 HG LEU B 120 -6.825 3.106 3.707 1.00 0.00 H new ATOM 0 HD11 LEU B 120 -8.403 4.143 2.144 1.00 0.00 H new ATOM 0 HD12 LEU B 120 -8.624 4.765 3.797 1.00 0.00 H new ATOM 0 HD13 LEU B 120 -7.780 5.752 2.580 1.00 0.00 H new ATOM 0 HD21 LEU B 120 -6.149 3.420 1.383 1.00 0.00 H new ATOM 0 HD22 LEU B 120 -5.483 5.020 1.787 1.00 0.00 H new ATOM 0 HD23 LEU B 120 -4.761 3.553 2.489 1.00 0.00 H new ATOM 1605 N LEU B 121 -5.133 5.421 7.172 1.00 0.00 N ATOM 1606 CA LEU B 121 -4.963 6.403 8.254 1.00 0.00 C ATOM 1607 C LEU B 121 -3.589 6.355 8.936 1.00 0.00 C ATOM 1608 O LEU B 121 -3.172 7.321 9.578 1.00 0.00 O ATOM 1609 CB LEU B 121 -6.071 6.238 9.270 1.00 0.00 C ATOM 1610 CG LEU B 121 -7.483 6.447 8.734 1.00 0.00 C ATOM 1611 CD1 LEU B 121 -8.494 6.000 9.751 1.00 0.00 C ATOM 1612 CD2 LEU B 121 -7.710 7.910 8.395 1.00 0.00 C ATOM 0 H LEU B 121 -5.914 4.780 7.316 1.00 0.00 H new ATOM 0 HA LEU B 121 -5.020 7.388 7.790 1.00 0.00 H new ATOM 0 HB2 LEU B 121 -6.006 5.236 9.695 1.00 0.00 H new ATOM 0 HB3 LEU B 121 -5.902 6.941 10.085 1.00 0.00 H new ATOM 0 HG LEU B 121 -7.599 5.852 7.828 1.00 0.00 H new ATOM 0 HD11 LEU B 121 -9.499 6.154 9.357 1.00 0.00 H new ATOM 0 HD12 LEU B 121 -8.348 4.942 9.969 1.00 0.00 H new ATOM 0 HD13 LEU B 121 -8.370 6.579 10.666 1.00 0.00 H new ATOM 0 HD21 LEU B 121 -8.723 8.042 8.014 1.00 0.00 H new ATOM 0 HD22 LEU B 121 -7.578 8.516 9.291 1.00 0.00 H new ATOM 0 HD23 LEU B 121 -6.993 8.223 7.636 1.00 0.00 H new ATOM 1624 N LYS B 122 -2.884 5.255 8.783 1.00 0.00 N ATOM 1625 CA LYS B 122 -1.563 5.131 9.381 1.00 0.00 C ATOM 1626 C LYS B 122 -0.481 5.615 8.422 1.00 0.00 C ATOM 1627 O LYS B 122 0.694 5.744 8.799 1.00 0.00 O ATOM 1628 CB LYS B 122 -1.269 3.707 9.806 1.00 0.00 C ATOM 1629 CG LYS B 122 -1.200 2.732 8.669 1.00 0.00 C ATOM 1630 CD LYS B 122 -0.651 1.416 9.127 1.00 0.00 C ATOM 1631 CE LYS B 122 -1.579 0.700 10.111 1.00 0.00 C ATOM 1632 NZ LYS B 122 -2.881 0.375 9.509 1.00 0.00 N ATOM 0 H LYS B 122 -3.195 4.439 8.256 1.00 0.00 H new ATOM 0 HA LYS B 122 -1.558 5.761 10.271 1.00 0.00 H new ATOM 0 HB2 LYS B 122 -0.322 3.688 10.345 1.00 0.00 H new ATOM 0 HB3 LYS B 122 -2.040 3.381 10.504 1.00 0.00 H new ATOM 0 HG2 LYS B 122 -2.195 2.589 8.247 1.00 0.00 H new ATOM 0 HG3 LYS B 122 -0.572 3.136 7.875 1.00 0.00 H new ATOM 0 HD2 LYS B 122 -0.483 0.776 8.261 1.00 0.00 H new ATOM 0 HD3 LYS B 122 0.319 1.576 9.599 1.00 0.00 H new ATOM 0 HE2 LYS B 122 -1.101 -0.217 10.457 1.00 0.00 H new ATOM 0 HE3 LYS B 122 -1.733 1.330 10.987 1.00 0.00 H new ATOM 0 HZ1 LYS B 122 -3.452 -0.168 10.188 1.00 0.00 H new ATOM 0 HZ2 LYS B 122 -3.379 1.254 9.263 1.00 0.00 H new ATOM 0 HZ3 LYS B 122 -2.734 -0.191 8.649 1.00 0.00 H new ATOM 1646 N MET B 123 -0.868 5.902 7.198 1.00 0.00 N ATOM 1647 CA MET B 123 0.069 6.346 6.196 1.00 0.00 C ATOM 1648 C MET B 123 0.340 7.840 6.418 1.00 0.00 C ATOM 1649 O MET B 123 -0.557 8.573 6.879 1.00 0.00 O ATOM 1650 CB MET B 123 -0.493 6.159 4.777 1.00 0.00 C ATOM 1651 CG MET B 123 -0.946 4.752 4.411 1.00 0.00 C ATOM 1652 SD MET B 123 -1.493 4.669 2.689 1.00 0.00 S ATOM 1653 CE MET B 123 -1.946 2.952 2.513 1.00 0.00 C ATOM 0 H MET B 123 -1.833 5.834 6.874 1.00 0.00 H new ATOM 0 HA MET B 123 0.980 5.755 6.286 1.00 0.00 H new ATOM 0 HB2 MET B 123 -1.340 6.834 4.653 1.00 0.00 H new ATOM 0 HB3 MET B 123 0.270 6.469 4.063 1.00 0.00 H new ATOM 0 HG2 MET B 123 -0.127 4.051 4.569 1.00 0.00 H new ATOM 0 HG3 MET B 123 -1.759 4.446 5.069 1.00 0.00 H new ATOM 0 HE1 MET B 123 -2.706 2.854 1.738 1.00 0.00 H new ATOM 0 HE2 MET B 123 -1.067 2.370 2.235 1.00 0.00 H new ATOM 0 HE3 MET B 123 -2.342 2.581 3.458 1.00 0.00 H new ATOM 1663 N PRO B 124 1.565 8.316 6.182 1.00 0.00 N ATOM 1664 CA PRO B 124 1.872 9.738 6.302 1.00 0.00 C ATOM 1665 C PRO B 124 1.157 10.541 5.215 1.00 0.00 C ATOM 1666 O PRO B 124 1.268 10.229 4.034 1.00 0.00 O ATOM 1667 CB PRO B 124 3.395 9.812 6.113 1.00 0.00 C ATOM 1668 CG PRO B 124 3.760 8.557 5.395 1.00 0.00 C ATOM 1669 CD PRO B 124 2.745 7.520 5.799 1.00 0.00 C ATOM 0 HA PRO B 124 1.546 10.155 7.255 1.00 0.00 H new ATOM 0 HB2 PRO B 124 3.678 10.692 5.536 1.00 0.00 H new ATOM 0 HB3 PRO B 124 3.908 9.881 7.072 1.00 0.00 H new ATOM 0 HG2 PRO B 124 3.749 8.711 4.316 1.00 0.00 H new ATOM 0 HG3 PRO B 124 4.768 8.237 5.661 1.00 0.00 H new ATOM 0 HD2 PRO B 124 2.519 6.839 4.978 1.00 0.00 H new ATOM 0 HD3 PRO B 124 3.104 6.911 6.629 1.00 0.00 H new ATOM 1677 N GLY B 125 0.398 11.530 5.616 1.00 0.00 N ATOM 1678 CA GLY B 125 -0.311 12.327 4.665 1.00 0.00 C ATOM 1679 C GLY B 125 -1.804 12.087 4.749 1.00 0.00 C ATOM 1680 O GLY B 125 -2.599 12.849 4.208 1.00 0.00 O ATOM 0 H GLY B 125 0.260 11.796 6.591 1.00 0.00 H new ATOM 0 HA2 GLY B 125 -0.100 13.382 4.842 1.00 0.00 H new ATOM 0 HA3 GLY B 125 0.041 12.096 3.660 1.00 0.00 H new ATOM 1684 N VAL B 126 -2.189 11.040 5.440 1.00 0.00 N ATOM 1685 CA VAL B 126 -3.580 10.659 5.502 1.00 0.00 C ATOM 1686 C VAL B 126 -4.268 11.116 6.790 1.00 0.00 C ATOM 1687 O VAL B 126 -3.796 10.878 7.910 1.00 0.00 O ATOM 1688 CB VAL B 126 -3.769 9.135 5.299 1.00 0.00 C ATOM 1689 CG1 VAL B 126 -5.243 8.746 5.356 1.00 0.00 C ATOM 1690 CG2 VAL B 126 -3.164 8.704 3.973 1.00 0.00 C ATOM 0 H VAL B 126 -1.558 10.437 5.967 1.00 0.00 H new ATOM 0 HA VAL B 126 -4.065 11.180 4.676 1.00 0.00 H new ATOM 0 HB VAL B 126 -3.254 8.621 6.111 1.00 0.00 H new ATOM 0 HG11 VAL B 126 -5.341 7.670 5.210 1.00 0.00 H new ATOM 0 HG12 VAL B 126 -5.654 9.019 6.328 1.00 0.00 H new ATOM 0 HG13 VAL B 126 -5.788 9.270 4.571 1.00 0.00 H new ATOM 0 HG21 VAL B 126 -3.303 7.631 3.841 1.00 0.00 H new ATOM 0 HG22 VAL B 126 -3.656 9.236 3.159 1.00 0.00 H new ATOM 0 HG23 VAL B 126 -2.099 8.935 3.967 1.00 0.00 H new ATOM 1700 N ASN B 127 -5.397 11.742 6.602 1.00 0.00 N ATOM 1701 CA ASN B 127 -6.252 12.215 7.666 1.00 0.00 C ATOM 1702 C ASN B 127 -7.592 11.648 7.399 1.00 0.00 C ATOM 1703 O ASN B 127 -7.883 11.326 6.262 1.00 0.00 O ATOM 1704 CB ASN B 127 -6.387 13.743 7.675 1.00 0.00 C ATOM 1705 CG ASN B 127 -5.115 14.464 7.977 1.00 0.00 C ATOM 1706 OD1 ASN B 127 -4.786 14.703 9.138 1.00 0.00 O ATOM 1707 ND2 ASN B 127 -4.438 14.888 6.966 1.00 0.00 N ATOM 0 H ASN B 127 -5.764 11.946 5.672 1.00 0.00 H new ATOM 0 HA ASN B 127 -5.829 11.915 8.625 1.00 0.00 H new ATOM 0 HB2 ASN B 127 -6.756 14.070 6.703 1.00 0.00 H new ATOM 0 HB3 ASN B 127 -7.137 14.027 8.413 1.00 0.00 H new ATOM 0 HD21 ASN B 127 -3.595 15.444 7.113 1.00 0.00 H new ATOM 0 HD22 ASN B 127 -4.745 14.668 6.018 1.00 0.00 H new ATOM 1714 N ALA B 128 -8.439 11.587 8.391 1.00 0.00 N ATOM 1715 CA ALA B 128 -9.771 11.016 8.229 1.00 0.00 C ATOM 1716 C ALA B 128 -10.577 11.768 7.173 1.00 0.00 C ATOM 1717 O ALA B 128 -11.389 11.174 6.453 1.00 0.00 O ATOM 1718 CB ALA B 128 -10.501 10.995 9.550 1.00 0.00 C ATOM 0 H ALA B 128 -8.238 11.926 9.332 1.00 0.00 H new ATOM 0 HA ALA B 128 -9.655 9.989 7.882 1.00 0.00 H new ATOM 0 HB1 ALA B 128 -11.493 10.566 9.411 1.00 0.00 H new ATOM 0 HB2 ALA B 128 -9.942 10.392 10.265 1.00 0.00 H new ATOM 0 HB3 ALA B 128 -10.596 12.012 9.930 1.00 0.00 H new ATOM 1724 N LYS B 129 -10.274 13.051 7.005 1.00 0.00 N ATOM 1725 CA LYS B 129 -11.000 13.873 6.066 1.00 0.00 C ATOM 1726 C LYS B 129 -10.592 13.534 4.641 1.00 0.00 C ATOM 1727 O LYS B 129 -11.428 13.361 3.745 1.00 0.00 O ATOM 1728 CB LYS B 129 -10.810 15.377 6.372 1.00 0.00 C ATOM 1729 CG LYS B 129 -9.359 15.877 6.355 1.00 0.00 C ATOM 1730 CD LYS B 129 -9.273 17.391 6.546 1.00 0.00 C ATOM 1731 CE LYS B 129 -9.829 17.870 7.890 1.00 0.00 C ATOM 1732 NZ LYS B 129 -9.034 17.404 9.047 1.00 0.00 N ATOM 0 H LYS B 129 -9.531 13.536 7.509 1.00 0.00 H new ATOM 0 HA LYS B 129 -12.063 13.659 6.172 1.00 0.00 H new ATOM 0 HB2 LYS B 129 -11.383 15.953 5.645 1.00 0.00 H new ATOM 0 HB3 LYS B 129 -11.237 15.587 7.353 1.00 0.00 H new ATOM 0 HG2 LYS B 129 -8.795 15.379 7.144 1.00 0.00 H new ATOM 0 HG3 LYS B 129 -8.892 15.604 5.409 1.00 0.00 H new ATOM 0 HD2 LYS B 129 -8.232 17.701 6.461 1.00 0.00 H new ATOM 0 HD3 LYS B 129 -9.818 17.882 5.740 1.00 0.00 H new ATOM 0 HE2 LYS B 129 -9.862 18.959 7.895 1.00 0.00 H new ATOM 0 HE3 LYS B 129 -10.855 17.519 7.997 1.00 0.00 H new ATOM 0 HZ1 LYS B 129 -9.460 17.760 9.927 1.00 0.00 H new ATOM 0 HZ2 LYS B 129 -9.022 16.364 9.064 1.00 0.00 H new ATOM 0 HZ3 LYS B 129 -8.060 17.760 8.965 1.00 0.00 H new ATOM 1746 N ASN B 130 -9.327 13.327 4.439 1.00 0.00 N ATOM 1747 CA ASN B 130 -8.882 13.058 3.113 1.00 0.00 C ATOM 1748 C ASN B 130 -9.025 11.586 2.804 1.00 0.00 C ATOM 1749 O ASN B 130 -9.085 11.194 1.669 1.00 0.00 O ATOM 1750 CB ASN B 130 -7.470 13.601 2.831 1.00 0.00 C ATOM 1751 CG ASN B 130 -6.310 12.956 3.600 1.00 0.00 C ATOM 1752 OD1 ASN B 130 -6.339 11.808 3.971 1.00 0.00 O ATOM 1753 ND2 ASN B 130 -5.286 13.715 3.839 1.00 0.00 N ATOM 0 H ASN B 130 -8.603 13.339 5.157 1.00 0.00 H new ATOM 0 HA ASN B 130 -9.528 13.605 2.426 1.00 0.00 H new ATOM 0 HB2 ASN B 130 -7.272 13.492 1.765 1.00 0.00 H new ATOM 0 HB3 ASN B 130 -7.468 14.669 3.048 1.00 0.00 H new ATOM 0 HD21 ASN B 130 -4.485 13.344 4.350 1.00 0.00 H new ATOM 0 HD22 ASN B 130 -5.282 14.683 3.516 1.00 0.00 H new ATOM 1760 N CYS B 131 -9.136 10.805 3.852 1.00 0.00 N ATOM 1761 CA CYS B 131 -9.336 9.386 3.777 1.00 0.00 C ATOM 1762 C CYS B 131 -10.756 9.082 3.317 1.00 0.00 C ATOM 1763 O CYS B 131 -10.956 8.211 2.501 1.00 0.00 O ATOM 1764 CB CYS B 131 -9.053 8.751 5.141 1.00 0.00 C ATOM 1765 SG CYS B 131 -9.184 6.964 5.207 1.00 0.00 S ATOM 0 H CYS B 131 -9.087 11.155 4.809 1.00 0.00 H new ATOM 0 HA CYS B 131 -8.646 8.961 3.049 1.00 0.00 H new ATOM 0 HB2 CYS B 131 -8.048 9.035 5.452 1.00 0.00 H new ATOM 0 HB3 CYS B 131 -9.744 9.175 5.869 1.00 0.00 H new ATOM 0 HG CYS B 131 -9.130 6.570 6.445 1.00 0.00 H new ATOM 1771 N ARG B 132 -11.744 9.824 3.830 1.00 0.00 N ATOM 1772 CA ARG B 132 -13.134 9.639 3.391 1.00 0.00 C ATOM 1773 C ARG B 132 -13.253 10.038 1.918 1.00 0.00 C ATOM 1774 O ARG B 132 -13.929 9.380 1.106 1.00 0.00 O ATOM 1775 CB ARG B 132 -14.110 10.447 4.283 1.00 0.00 C ATOM 1776 CG ARG B 132 -13.953 11.959 4.224 1.00 0.00 C ATOM 1777 CD ARG B 132 -14.954 12.591 3.262 1.00 0.00 C ATOM 1778 NE ARG B 132 -14.667 14.002 2.969 1.00 0.00 N ATOM 1779 CZ ARG B 132 -15.468 14.812 2.239 1.00 0.00 C ATOM 1780 NH1 ARG B 132 -16.708 14.420 1.908 1.00 0.00 N ATOM 1781 NH2 ARG B 132 -15.043 16.015 1.879 1.00 0.00 N ATOM 0 H ARG B 132 -11.612 10.547 4.538 1.00 0.00 H new ATOM 0 HA ARG B 132 -13.410 8.589 3.493 1.00 0.00 H new ATOM 0 HB2 ARG B 132 -15.131 10.194 3.996 1.00 0.00 H new ATOM 0 HB3 ARG B 132 -13.980 10.126 5.317 1.00 0.00 H new ATOM 0 HG2 ARG B 132 -14.091 12.379 5.221 1.00 0.00 H new ATOM 0 HG3 ARG B 132 -12.939 12.208 3.910 1.00 0.00 H new ATOM 0 HD2 ARG B 132 -14.957 12.027 2.329 1.00 0.00 H new ATOM 0 HD3 ARG B 132 -15.955 12.511 3.686 1.00 0.00 H new ATOM 0 HE ARG B 132 -13.804 14.398 3.342 1.00 0.00 H new ATOM 0 HH11 ARG B 132 -17.051 13.507 2.207 1.00 0.00 H new ATOM 0 HH12 ARG B 132 -17.307 15.035 1.358 1.00 0.00 H new ATOM 0 HH21 ARG B 132 -14.112 16.330 2.152 1.00 0.00 H new ATOM 0 HH22 ARG B 132 -15.647 16.626 1.329 1.00 0.00 H new ATOM 1795 N SER B 133 -12.552 11.098 1.581 1.00 0.00 N ATOM 1796 CA SER B 133 -12.483 11.580 0.220 1.00 0.00 C ATOM 1797 C SER B 133 -11.820 10.507 -0.636 1.00 0.00 C ATOM 1798 O SER B 133 -12.265 10.192 -1.749 1.00 0.00 O ATOM 1799 CB SER B 133 -11.662 12.872 0.192 1.00 0.00 C ATOM 1800 OG SER B 133 -11.672 13.488 -1.091 1.00 0.00 O ATOM 0 H SER B 133 -12.012 11.652 2.246 1.00 0.00 H new ATOM 0 HA SER B 133 -13.479 11.789 -0.170 1.00 0.00 H new ATOM 0 HB2 SER B 133 -12.059 13.569 0.931 1.00 0.00 H new ATOM 0 HB3 SER B 133 -10.634 12.653 0.480 1.00 0.00 H new ATOM 0 HG SER B 133 -10.874 14.048 -1.191 1.00 0.00 H new ATOM 1806 N LEU B 134 -10.799 9.904 -0.073 1.00 0.00 N ATOM 1807 CA LEU B 134 -10.035 8.877 -0.738 1.00 0.00 C ATOM 1808 C LEU B 134 -10.909 7.665 -0.968 1.00 0.00 C ATOM 1809 O LEU B 134 -10.787 7.027 -1.964 1.00 0.00 O ATOM 1810 CB LEU B 134 -8.843 8.464 0.093 1.00 0.00 C ATOM 1811 CG LEU B 134 -7.730 7.760 -0.652 1.00 0.00 C ATOM 1812 CD1 LEU B 134 -6.788 8.758 -1.306 1.00 0.00 C ATOM 1813 CD2 LEU B 134 -7.009 6.809 0.251 1.00 0.00 C ATOM 0 H LEU B 134 -10.473 10.116 0.870 1.00 0.00 H new ATOM 0 HA LEU B 134 -9.683 9.279 -1.688 1.00 0.00 H new ATOM 0 HB2 LEU B 134 -8.430 9.354 0.568 1.00 0.00 H new ATOM 0 HB3 LEU B 134 -9.191 7.809 0.892 1.00 0.00 H new ATOM 0 HG LEU B 134 -8.172 7.172 -1.456 1.00 0.00 H new ATOM 0 HD11 LEU B 134 -5.999 8.222 -1.834 1.00 0.00 H new ATOM 0 HD12 LEU B 134 -7.344 9.374 -2.013 1.00 0.00 H new ATOM 0 HD13 LEU B 134 -6.345 9.395 -0.541 1.00 0.00 H new ATOM 0 HD21 LEU B 134 -6.213 6.313 -0.304 1.00 0.00 H new ATOM 0 HD22 LEU B 134 -6.580 7.358 1.089 1.00 0.00 H new ATOM 0 HD23 LEU B 134 -7.709 6.062 0.626 1.00 0.00 H new ATOM 1825 N MET B 135 -11.822 7.393 -0.033 1.00 0.00 N ATOM 1826 CA MET B 135 -12.767 6.248 -0.158 1.00 0.00 C ATOM 1827 C MET B 135 -13.565 6.399 -1.412 1.00 0.00 C ATOM 1828 O MET B 135 -13.855 5.448 -2.124 1.00 0.00 O ATOM 1829 CB MET B 135 -13.776 6.218 0.991 1.00 0.00 C ATOM 1830 CG MET B 135 -13.184 6.126 2.346 1.00 0.00 C ATOM 1831 SD MET B 135 -12.318 4.621 2.620 1.00 0.00 S ATOM 1832 CE MET B 135 -11.663 4.990 4.200 1.00 0.00 C ATOM 0 H MET B 135 -11.938 7.939 0.821 1.00 0.00 H new ATOM 0 HA MET B 135 -12.168 5.338 -0.154 1.00 0.00 H new ATOM 0 HB2 MET B 135 -14.388 7.118 0.940 1.00 0.00 H new ATOM 0 HB3 MET B 135 -14.444 5.369 0.845 1.00 0.00 H new ATOM 0 HG2 MET B 135 -12.502 6.963 2.495 1.00 0.00 H new ATOM 0 HG3 MET B 135 -13.976 6.223 3.089 1.00 0.00 H new ATOM 0 HE1 MET B 135 -10.666 4.558 4.291 1.00 0.00 H new ATOM 0 HE2 MET B 135 -11.603 6.071 4.325 1.00 0.00 H new ATOM 0 HE3 MET B 135 -12.311 4.571 4.970 1.00 0.00 H new ATOM 1842 N HIS B 136 -13.929 7.620 -1.665 1.00 0.00 N ATOM 1843 CA HIS B 136 -14.743 7.930 -2.815 1.00 0.00 C ATOM 1844 C HIS B 136 -13.939 8.131 -4.080 1.00 0.00 C ATOM 1845 O HIS B 136 -14.500 8.180 -5.157 1.00 0.00 O ATOM 1846 CB HIS B 136 -15.640 9.132 -2.561 1.00 0.00 C ATOM 1847 CG HIS B 136 -16.732 8.881 -1.565 1.00 0.00 C ATOM 1848 ND1 HIS B 136 -16.669 8.518 -0.268 1.00 0.00 N flip ATOM 1849 CD2 HIS B 136 -18.067 9.027 -1.846 1.00 0.00 C flip ATOM 1850 CE1 HIS B 136 -17.946 8.458 0.200 1.00 0.00 C flip ATOM 1851 NE2 HIS B 136 -18.769 8.768 -0.770 1.00 0.00 N flip ATOM 0 H HIS B 136 -13.677 8.425 -1.092 1.00 0.00 H new ATOM 0 HA HIS B 136 -15.370 7.053 -2.973 1.00 0.00 H new ATOM 0 HB2 HIS B 136 -15.027 9.962 -2.210 1.00 0.00 H new ATOM 0 HB3 HIS B 136 -16.088 9.443 -3.505 1.00 0.00 H new ATOM 0 HD2 HIS B 136 -18.476 9.311 -2.804 1.00 0.00 H new ATOM 0 HE1 HIS B 136 -18.234 8.197 1.208 1.00 0.00 H new ATOM 0 HE2 HIS B 136 -19.786 8.802 -0.700 1.00 0.00 H new ATOM 1860 N HIS B 137 -12.646 8.270 -3.966 1.00 0.00 N ATOM 1861 CA HIS B 137 -11.828 8.483 -5.161 1.00 0.00 C ATOM 1862 C HIS B 137 -10.910 7.307 -5.470 1.00 0.00 C ATOM 1863 O HIS B 137 -10.322 7.242 -6.552 1.00 0.00 O ATOM 1864 CB HIS B 137 -11.000 9.770 -5.054 1.00 0.00 C ATOM 1865 CG HIS B 137 -11.764 11.054 -5.231 1.00 0.00 C ATOM 1866 ND1 HIS B 137 -12.494 11.791 -4.356 1.00 0.00 N flip ATOM 1867 CD2 HIS B 137 -11.799 11.747 -6.418 1.00 0.00 C flip ATOM 1868 CE1 HIS B 137 -12.948 12.894 -5.030 1.00 0.00 C flip ATOM 1869 NE2 HIS B 137 -12.512 12.840 -6.271 1.00 0.00 N flip ATOM 0 H HIS B 137 -12.132 8.243 -3.086 1.00 0.00 H new ATOM 0 HA HIS B 137 -12.533 8.578 -5.987 1.00 0.00 H new ATOM 0 HB2 HIS B 137 -10.516 9.788 -4.078 1.00 0.00 H new ATOM 0 HB3 HIS B 137 -10.208 9.734 -5.802 1.00 0.00 H new ATOM 0 HD1 HIS B 137 -12.672 11.565 -3.377 1.00 0.00 H new ATOM 0 HD2 HIS B 137 -11.314 11.439 -7.332 1.00 0.00 H new ATOM 0 HE1 HIS B 137 -13.562 13.678 -4.612 1.00 0.00 H new ATOM 1878 N VAL B 138 -10.794 6.389 -4.544 1.00 0.00 N ATOM 1879 CA VAL B 138 -9.851 5.274 -4.648 1.00 0.00 C ATOM 1880 C VAL B 138 -10.515 3.982 -4.169 1.00 0.00 C ATOM 1881 O VAL B 138 -11.354 4.012 -3.272 1.00 0.00 O ATOM 1882 CB VAL B 138 -8.568 5.533 -3.769 1.00 0.00 C ATOM 1883 CG1 VAL B 138 -7.563 4.420 -3.889 1.00 0.00 C ATOM 1884 CG2 VAL B 138 -7.902 6.845 -4.125 1.00 0.00 C ATOM 0 H VAL B 138 -11.348 6.383 -3.688 1.00 0.00 H new ATOM 0 HA VAL B 138 -9.557 5.184 -5.694 1.00 0.00 H new ATOM 0 HB VAL B 138 -8.916 5.577 -2.737 1.00 0.00 H new ATOM 0 HG11 VAL B 138 -6.697 4.643 -3.266 1.00 0.00 H new ATOM 0 HG12 VAL B 138 -8.015 3.484 -3.560 1.00 0.00 H new ATOM 0 HG13 VAL B 138 -7.248 4.325 -4.928 1.00 0.00 H new ATOM 0 HG21 VAL B 138 -7.022 6.988 -3.498 1.00 0.00 H new ATOM 0 HG22 VAL B 138 -7.602 6.828 -5.173 1.00 0.00 H new ATOM 0 HG23 VAL B 138 -8.602 7.665 -3.961 1.00 0.00 H new ATOM 1894 N LYS B 139 -10.171 2.871 -4.801 1.00 0.00 N ATOM 1895 CA LYS B 139 -10.670 1.562 -4.405 1.00 0.00 C ATOM 1896 C LYS B 139 -9.964 1.068 -3.139 1.00 0.00 C ATOM 1897 O LYS B 139 -10.588 0.845 -2.120 1.00 0.00 O ATOM 1898 CB LYS B 139 -10.453 0.562 -5.519 1.00 0.00 C ATOM 1899 CG LYS B 139 -10.921 -0.811 -5.163 1.00 0.00 C ATOM 1900 CD LYS B 139 -10.568 -1.819 -6.211 1.00 0.00 C ATOM 1901 CE LYS B 139 -11.021 -3.177 -5.764 1.00 0.00 C ATOM 1902 NZ LYS B 139 -12.491 -3.297 -5.757 1.00 0.00 N ATOM 0 H LYS B 139 -9.539 2.850 -5.602 1.00 0.00 H new ATOM 0 HA LYS B 139 -11.736 1.657 -4.200 1.00 0.00 H new ATOM 0 HB2 LYS B 139 -10.979 0.900 -6.412 1.00 0.00 H new ATOM 0 HB3 LYS B 139 -9.392 0.526 -5.768 1.00 0.00 H new ATOM 0 HG2 LYS B 139 -10.479 -1.108 -4.212 1.00 0.00 H new ATOM 0 HG3 LYS B 139 -12.002 -0.799 -5.022 1.00 0.00 H new ATOM 0 HD2 LYS B 139 -11.042 -1.558 -7.157 1.00 0.00 H new ATOM 0 HD3 LYS B 139 -9.492 -1.820 -6.383 1.00 0.00 H new ATOM 0 HE2 LYS B 139 -10.599 -3.935 -6.424 1.00 0.00 H new ATOM 0 HE3 LYS B 139 -10.637 -3.376 -4.764 1.00 0.00 H new ATOM 0 HZ1 LYS B 139 -12.760 -4.283 -5.948 1.00 0.00 H new ATOM 0 HZ2 LYS B 139 -12.858 -3.012 -4.827 1.00 0.00 H new ATOM 0 HZ3 LYS B 139 -12.893 -2.680 -6.491 1.00 0.00 H new ATOM 1916 N ASN B 140 -8.672 0.820 -3.257 1.00 0.00 N ATOM 1917 CA ASN B 140 -7.829 0.472 -2.143 1.00 0.00 C ATOM 1918 C ASN B 140 -6.392 0.694 -2.631 1.00 0.00 C ATOM 1919 O ASN B 140 -6.198 1.356 -3.671 1.00 0.00 O ATOM 1920 CB ASN B 140 -8.034 -1.015 -1.676 1.00 0.00 C ATOM 1921 CG ASN B 140 -7.501 -1.278 -0.219 1.00 0.00 C ATOM 1922 OD1 ASN B 140 -6.631 -0.599 0.273 1.00 0.00 O ATOM 1923 ND2 ASN B 140 -7.999 -2.248 0.438 1.00 0.00 N ATOM 0 H ASN B 140 -8.177 0.857 -4.148 1.00 0.00 H new ATOM 0 HA ASN B 140 -8.071 1.084 -1.274 1.00 0.00 H new ATOM 0 HB2 ASN B 140 -9.095 -1.261 -1.719 1.00 0.00 H new ATOM 0 HB3 ASN B 140 -7.523 -1.682 -2.370 1.00 0.00 H new ATOM 0 HD21 ASN B 140 -7.664 -2.452 1.379 1.00 0.00 H new ATOM 0 HD22 ASN B 140 -8.733 -2.821 0.023 1.00 0.00 H new ATOM 1930 N ILE B 141 -5.439 0.132 -1.909 1.00 0.00 N ATOM 1931 CA ILE B 141 -3.992 0.159 -2.127 1.00 0.00 C ATOM 1932 C ILE B 141 -3.604 0.238 -3.602 1.00 0.00 C ATOM 1933 O ILE B 141 -2.850 1.126 -3.988 1.00 0.00 O ATOM 1934 CB ILE B 141 -3.377 -1.138 -1.553 1.00 0.00 C ATOM 1935 CG1 ILE B 141 -3.683 -1.288 -0.061 1.00 0.00 C ATOM 1936 CG2 ILE B 141 -1.862 -1.179 -1.783 1.00 0.00 C ATOM 1937 CD1 ILE B 141 -3.200 -2.592 0.534 1.00 0.00 C ATOM 0 H ILE B 141 -5.674 -0.407 -1.076 1.00 0.00 H new ATOM 0 HA ILE B 141 -3.618 1.055 -1.632 1.00 0.00 H new ATOM 0 HB ILE B 141 -3.834 -1.973 -2.084 1.00 0.00 H new ATOM 0 HG12 ILE B 141 -3.223 -0.461 0.479 1.00 0.00 H new ATOM 0 HG13 ILE B 141 -4.760 -1.208 0.089 1.00 0.00 H new ATOM 0 HG21 ILE B 141 -1.456 -2.102 -1.369 1.00 0.00 H new ATOM 0 HG22 ILE B 141 -1.655 -1.139 -2.852 1.00 0.00 H new ATOM 0 HG23 ILE B 141 -1.396 -0.325 -1.291 1.00 0.00 H new ATOM 0 HD11 ILE B 141 -3.453 -2.624 1.594 1.00 0.00 H new ATOM 0 HD12 ILE B 141 -3.679 -3.426 0.021 1.00 0.00 H new ATOM 0 HD13 ILE B 141 -2.119 -2.667 0.417 1.00 0.00 H new ATOM 1949 N ALA B 142 -4.130 -0.687 -4.420 1.00 0.00 N ATOM 1950 CA ALA B 142 -3.778 -0.731 -5.848 1.00 0.00 C ATOM 1951 C ALA B 142 -4.010 0.595 -6.567 1.00 0.00 C ATOM 1952 O ALA B 142 -3.105 1.107 -7.231 1.00 0.00 O ATOM 1953 CB ALA B 142 -4.502 -1.850 -6.540 1.00 0.00 C ATOM 0 H ALA B 142 -4.791 -1.405 -4.123 1.00 0.00 H new ATOM 0 HA ALA B 142 -2.705 -0.920 -5.895 1.00 0.00 H new ATOM 0 HB1 ALA B 142 -4.227 -1.864 -7.595 1.00 0.00 H new ATOM 0 HB2 ALA B 142 -4.228 -2.800 -6.081 1.00 0.00 H new ATOM 0 HB3 ALA B 142 -5.578 -1.700 -6.448 1.00 0.00 H new ATOM 1959 N GLU B 143 -5.186 1.158 -6.405 1.00 0.00 N ATOM 1960 CA GLU B 143 -5.546 2.416 -7.053 1.00 0.00 C ATOM 1961 C GLU B 143 -4.845 3.560 -6.370 1.00 0.00 C ATOM 1962 O GLU B 143 -4.423 4.486 -7.020 1.00 0.00 O ATOM 1963 CB GLU B 143 -7.052 2.626 -6.991 1.00 0.00 C ATOM 1964 CG GLU B 143 -7.877 1.509 -7.595 1.00 0.00 C ATOM 1965 CD GLU B 143 -7.577 1.255 -9.040 1.00 0.00 C ATOM 1966 OE1 GLU B 143 -8.112 1.972 -9.907 1.00 0.00 O ATOM 1967 OE2 GLU B 143 -6.823 0.318 -9.335 1.00 0.00 O ATOM 0 H GLU B 143 -5.925 0.764 -5.823 1.00 0.00 H new ATOM 0 HA GLU B 143 -5.237 2.376 -8.098 1.00 0.00 H new ATOM 0 HB2 GLU B 143 -7.344 2.751 -5.948 1.00 0.00 H new ATOM 0 HB3 GLU B 143 -7.296 3.556 -7.504 1.00 0.00 H new ATOM 0 HG2 GLU B 143 -7.702 0.593 -7.030 1.00 0.00 H new ATOM 0 HG3 GLU B 143 -8.934 1.752 -7.489 1.00 0.00 H new ATOM 1974 N LEU B 144 -4.703 3.466 -5.058 1.00 0.00 N ATOM 1975 CA LEU B 144 -4.028 4.496 -4.274 1.00 0.00 C ATOM 1976 C LEU B 144 -2.613 4.688 -4.753 1.00 0.00 C ATOM 1977 O LEU B 144 -2.181 5.796 -5.024 1.00 0.00 O ATOM 1978 CB LEU B 144 -4.019 4.121 -2.787 1.00 0.00 C ATOM 1979 CG LEU B 144 -3.269 5.077 -1.866 1.00 0.00 C ATOM 1980 CD1 LEU B 144 -3.820 6.483 -1.989 1.00 0.00 C ATOM 1981 CD2 LEU B 144 -3.366 4.604 -0.444 1.00 0.00 C ATOM 0 H LEU B 144 -5.049 2.681 -4.506 1.00 0.00 H new ATOM 0 HA LEU B 144 -4.576 5.429 -4.404 1.00 0.00 H new ATOM 0 HB2 LEU B 144 -5.051 4.050 -2.443 1.00 0.00 H new ATOM 0 HB3 LEU B 144 -3.580 3.129 -2.685 1.00 0.00 H new ATOM 0 HG LEU B 144 -2.221 5.093 -2.164 1.00 0.00 H new ATOM 0 HD11 LEU B 144 -3.271 7.149 -1.323 1.00 0.00 H new ATOM 0 HD12 LEU B 144 -3.712 6.828 -3.017 1.00 0.00 H new ATOM 0 HD13 LEU B 144 -4.875 6.486 -1.715 1.00 0.00 H new ATOM 0 HD21 LEU B 144 -2.827 5.293 0.206 1.00 0.00 H new ATOM 0 HD22 LEU B 144 -4.413 4.566 -0.144 1.00 0.00 H new ATOM 0 HD23 LEU B 144 -2.928 3.609 -0.361 1.00 0.00 H new ATOM 1993 N ALA B 145 -1.924 3.593 -4.900 1.00 0.00 N ATOM 1994 CA ALA B 145 -0.564 3.617 -5.307 1.00 0.00 C ATOM 1995 C ALA B 145 -0.432 3.785 -6.806 1.00 0.00 C ATOM 1996 O ALA B 145 0.662 4.049 -7.318 1.00 0.00 O ATOM 1997 CB ALA B 145 0.133 2.373 -4.829 1.00 0.00 C ATOM 0 H ALA B 145 -2.299 2.658 -4.738 1.00 0.00 H new ATOM 0 HA ALA B 145 -0.083 4.483 -4.852 1.00 0.00 H new ATOM 0 HB1 ALA B 145 1.176 2.397 -5.144 1.00 0.00 H new ATOM 0 HB2 ALA B 145 0.083 2.323 -3.741 1.00 0.00 H new ATOM 0 HB3 ALA B 145 -0.355 1.496 -5.255 1.00 0.00 H new ATOM 2003 N ALA B 146 -1.539 3.610 -7.514 1.00 0.00 N ATOM 2004 CA ALA B 146 -1.547 3.793 -8.952 1.00 0.00 C ATOM 2005 C ALA B 146 -1.678 5.257 -9.283 1.00 0.00 C ATOM 2006 O ALA B 146 -1.144 5.732 -10.310 1.00 0.00 O ATOM 2007 CB ALA B 146 -2.673 3.008 -9.609 1.00 0.00 C ATOM 0 H ALA B 146 -2.439 3.342 -7.114 1.00 0.00 H new ATOM 0 HA ALA B 146 -0.603 3.414 -9.343 1.00 0.00 H new ATOM 0 HB1 ALA B 146 -2.648 3.169 -10.687 1.00 0.00 H new ATOM 0 HB2 ALA B 146 -2.548 1.946 -9.398 1.00 0.00 H new ATOM 0 HB3 ALA B 146 -3.631 3.346 -9.214 1.00 0.00 H new ATOM 2013 N LEU B 147 -2.365 5.976 -8.415 1.00 0.00 N ATOM 2014 CA LEU B 147 -2.604 7.364 -8.620 1.00 0.00 C ATOM 2015 C LEU B 147 -1.337 8.213 -8.451 1.00 0.00 C ATOM 2016 O LEU B 147 -0.365 7.811 -7.803 1.00 0.00 O ATOM 2017 CB LEU B 147 -3.729 7.884 -7.723 1.00 0.00 C ATOM 2018 CG LEU B 147 -5.122 7.307 -7.987 1.00 0.00 C ATOM 2019 CD1 LEU B 147 -6.127 7.907 -7.036 1.00 0.00 C ATOM 2020 CD2 LEU B 147 -5.552 7.545 -9.429 1.00 0.00 C ATOM 0 H LEU B 147 -2.766 5.601 -7.555 1.00 0.00 H new ATOM 0 HA LEU B 147 -2.923 7.465 -9.657 1.00 0.00 H new ATOM 0 HB2 LEU B 147 -3.464 7.679 -6.686 1.00 0.00 H new ATOM 0 HB3 LEU B 147 -3.780 8.967 -7.830 1.00 0.00 H new ATOM 0 HG LEU B 147 -5.077 6.231 -7.821 1.00 0.00 H new ATOM 0 HD11 LEU B 147 -7.113 7.487 -7.236 1.00 0.00 H new ATOM 0 HD12 LEU B 147 -5.837 7.680 -6.010 1.00 0.00 H new ATOM 0 HD13 LEU B 147 -6.158 8.988 -7.174 1.00 0.00 H new ATOM 0 HD21 LEU B 147 -6.545 7.124 -9.587 1.00 0.00 H new ATOM 0 HD22 LEU B 147 -5.576 8.616 -9.630 1.00 0.00 H new ATOM 0 HD23 LEU B 147 -4.843 7.065 -10.104 1.00 0.00 H new ATOM 2032 N SER B 148 -1.362 9.371 -9.049 1.00 0.00 N ATOM 2033 CA SER B 148 -0.261 10.292 -9.014 1.00 0.00 C ATOM 2034 C SER B 148 -0.425 11.265 -7.838 1.00 0.00 C ATOM 2035 O SER B 148 -1.500 11.332 -7.229 1.00 0.00 O ATOM 2036 CB SER B 148 -0.268 11.059 -10.323 1.00 0.00 C ATOM 2037 OG SER B 148 -0.375 10.165 -11.421 1.00 0.00 O ATOM 0 H SER B 148 -2.163 9.707 -9.584 1.00 0.00 H new ATOM 0 HA SER B 148 0.680 9.758 -8.884 1.00 0.00 H new ATOM 0 HB2 SER B 148 -1.101 11.762 -10.336 1.00 0.00 H new ATOM 0 HB3 SER B 148 0.646 11.647 -10.412 1.00 0.00 H new ATOM 0 HG SER B 148 -0.380 10.674 -12.258 1.00 0.00 H new ATOM 2043 N GLN B 149 0.616 12.056 -7.550 1.00 0.00 N ATOM 2044 CA GLN B 149 0.569 13.030 -6.463 1.00 0.00 C ATOM 2045 C GLN B 149 -0.474 14.100 -6.789 1.00 0.00 C ATOM 2046 O GLN B 149 -1.143 14.635 -5.907 1.00 0.00 O ATOM 2047 CB GLN B 149 1.935 13.687 -6.284 1.00 0.00 C ATOM 2048 CG GLN B 149 2.024 14.596 -5.070 1.00 0.00 C ATOM 2049 CD GLN B 149 3.299 15.410 -5.044 1.00 0.00 C ATOM 2050 OE1 GLN B 149 4.329 14.973 -5.533 1.00 0.00 O ATOM 2051 NE2 GLN B 149 3.240 16.591 -4.477 1.00 0.00 N ATOM 0 H GLN B 149 1.500 12.037 -8.058 1.00 0.00 H new ATOM 0 HA GLN B 149 0.299 12.520 -5.538 1.00 0.00 H new ATOM 0 HB2 GLN B 149 2.694 12.909 -6.200 1.00 0.00 H new ATOM 0 HB3 GLN B 149 2.169 14.266 -7.177 1.00 0.00 H new ATOM 0 HG2 GLN B 149 1.167 15.270 -5.062 1.00 0.00 H new ATOM 0 HG3 GLN B 149 1.964 13.993 -4.164 1.00 0.00 H new ATOM 0 HE21 GLN B 149 2.361 16.922 -4.079 1.00 0.00 H new ATOM 0 HE22 GLN B 149 4.073 17.178 -4.434 1.00 0.00 H new ATOM 2060 N ASP B 150 -0.631 14.359 -8.076 1.00 0.00 N ATOM 2061 CA ASP B 150 -1.594 15.337 -8.582 1.00 0.00 C ATOM 2062 C ASP B 150 -2.991 14.887 -8.236 1.00 0.00 C ATOM 2063 O ASP B 150 -3.838 15.687 -7.834 1.00 0.00 O ATOM 2064 CB ASP B 150 -1.473 15.468 -10.099 1.00 0.00 C ATOM 2065 CG ASP B 150 -0.062 15.697 -10.544 1.00 0.00 C ATOM 2066 OD1 ASP B 150 0.403 16.855 -10.571 1.00 0.00 O ATOM 2067 OD2 ASP B 150 0.622 14.702 -10.848 1.00 0.00 O ATOM 0 H ASP B 150 -0.093 13.896 -8.809 1.00 0.00 H new ATOM 0 HA ASP B 150 -1.387 16.304 -8.124 1.00 0.00 H new ATOM 0 HB2 ASP B 150 -1.857 14.563 -10.570 1.00 0.00 H new ATOM 0 HB3 ASP B 150 -2.097 16.294 -10.440 1.00 0.00 H new ATOM 2072 N GLU B 151 -3.202 13.589 -8.334 1.00 0.00 N ATOM 2073 CA GLU B 151 -4.470 12.983 -8.037 1.00 0.00 C ATOM 2074 C GLU B 151 -4.713 13.038 -6.552 1.00 0.00 C ATOM 2075 O GLU B 151 -5.802 13.344 -6.112 1.00 0.00 O ATOM 2076 CB GLU B 151 -4.496 11.542 -8.537 1.00 0.00 C ATOM 2077 CG GLU B 151 -4.281 11.417 -10.036 1.00 0.00 C ATOM 2078 CD GLU B 151 -5.352 12.124 -10.825 1.00 0.00 C ATOM 2079 OE1 GLU B 151 -5.278 13.346 -10.989 1.00 0.00 O ATOM 2080 OE2 GLU B 151 -6.302 11.468 -11.276 1.00 0.00 O ATOM 0 H GLU B 151 -2.485 12.925 -8.626 1.00 0.00 H new ATOM 0 HA GLU B 151 -5.263 13.531 -8.546 1.00 0.00 H new ATOM 0 HB2 GLU B 151 -3.725 10.972 -8.019 1.00 0.00 H new ATOM 0 HB3 GLU B 151 -5.454 11.093 -8.277 1.00 0.00 H new ATOM 0 HG2 GLU B 151 -3.307 11.830 -10.297 1.00 0.00 H new ATOM 0 HG3 GLU B 151 -4.265 10.363 -10.312 1.00 0.00 H new ATOM 2087 N LEU B 152 -3.669 12.790 -5.780 1.00 0.00 N ATOM 2088 CA LEU B 152 -3.765 12.860 -4.337 1.00 0.00 C ATOM 2089 C LEU B 152 -4.108 14.280 -3.895 1.00 0.00 C ATOM 2090 O LEU B 152 -4.959 14.467 -3.066 1.00 0.00 O ATOM 2091 CB LEU B 152 -2.482 12.373 -3.661 1.00 0.00 C ATOM 2092 CG LEU B 152 -2.063 10.934 -3.965 1.00 0.00 C ATOM 2093 CD1 LEU B 152 -0.794 10.576 -3.221 1.00 0.00 C ATOM 2094 CD2 LEU B 152 -3.179 9.950 -3.639 1.00 0.00 C ATOM 0 H LEU B 152 -2.745 12.538 -6.131 1.00 0.00 H new ATOM 0 HA LEU B 152 -4.569 12.194 -4.024 1.00 0.00 H new ATOM 0 HB2 LEU B 152 -1.668 13.036 -3.954 1.00 0.00 H new ATOM 0 HB3 LEU B 152 -2.603 12.474 -2.582 1.00 0.00 H new ATOM 0 HG LEU B 152 -1.864 10.865 -5.034 1.00 0.00 H new ATOM 0 HD11 LEU B 152 -0.514 9.548 -3.452 1.00 0.00 H new ATOM 0 HD12 LEU B 152 0.008 11.248 -3.526 1.00 0.00 H new ATOM 0 HD13 LEU B 152 -0.961 10.674 -2.148 1.00 0.00 H new ATOM 0 HD21 LEU B 152 -2.848 8.937 -3.867 1.00 0.00 H new ATOM 0 HD22 LEU B 152 -3.429 10.021 -2.580 1.00 0.00 H new ATOM 0 HD23 LEU B 152 -4.059 10.187 -4.236 1.00 0.00 H new ATOM 2106 N THR B 153 -3.475 15.273 -4.494 1.00 0.00 N ATOM 2107 CA THR B 153 -3.778 16.672 -4.189 1.00 0.00 C ATOM 2108 C THR B 153 -5.232 16.990 -4.594 1.00 0.00 C ATOM 2109 O THR B 153 -5.909 17.773 -3.947 1.00 0.00 O ATOM 2110 CB THR B 153 -2.820 17.629 -4.929 1.00 0.00 C ATOM 2111 OG1 THR B 153 -1.464 17.201 -4.727 1.00 0.00 O ATOM 2112 CG2 THR B 153 -2.957 19.051 -4.395 1.00 0.00 C ATOM 0 H THR B 153 -2.746 15.143 -5.196 1.00 0.00 H new ATOM 0 HA THR B 153 -3.648 16.818 -3.117 1.00 0.00 H new ATOM 0 HB THR B 153 -3.075 17.613 -5.989 1.00 0.00 H new ATOM 0 HG1 THR B 153 -1.302 16.378 -5.234 1.00 0.00 H new ATOM 0 HG21 THR B 153 -2.272 19.708 -4.931 1.00 0.00 H new ATOM 0 HG22 THR B 153 -3.980 19.397 -4.540 1.00 0.00 H new ATOM 0 HG23 THR B 153 -2.716 19.065 -3.332 1.00 0.00 H new ATOM 2120 N SER B 154 -5.697 16.333 -5.632 1.00 0.00 N ATOM 2121 CA SER B 154 -7.050 16.511 -6.128 1.00 0.00 C ATOM 2122 C SER B 154 -8.061 15.897 -5.123 1.00 0.00 C ATOM 2123 O SER B 154 -9.158 16.407 -4.931 1.00 0.00 O ATOM 2124 CB SER B 154 -7.163 15.847 -7.521 1.00 0.00 C ATOM 2125 OG SER B 154 -8.378 16.152 -8.197 1.00 0.00 O ATOM 0 H SER B 154 -5.148 15.656 -6.161 1.00 0.00 H new ATOM 0 HA SER B 154 -7.282 17.571 -6.227 1.00 0.00 H new ATOM 0 HB2 SER B 154 -6.323 16.168 -8.137 1.00 0.00 H new ATOM 0 HB3 SER B 154 -7.081 14.766 -7.408 1.00 0.00 H new ATOM 0 HG SER B 154 -8.388 15.705 -9.069 1.00 0.00 H new ATOM 2131 N ILE B 155 -7.654 14.821 -4.472 1.00 0.00 N ATOM 2132 CA ILE B 155 -8.485 14.121 -3.497 1.00 0.00 C ATOM 2133 C ILE B 155 -8.375 14.757 -2.109 1.00 0.00 C ATOM 2134 O ILE B 155 -9.380 15.150 -1.501 1.00 0.00 O ATOM 2135 CB ILE B 155 -8.040 12.642 -3.378 1.00 0.00 C ATOM 2136 CG1 ILE B 155 -8.164 11.939 -4.731 1.00 0.00 C ATOM 2137 CG2 ILE B 155 -8.857 11.911 -2.305 1.00 0.00 C ATOM 2138 CD1 ILE B 155 -7.521 10.572 -4.772 1.00 0.00 C ATOM 0 H ILE B 155 -6.733 14.403 -4.603 1.00 0.00 H new ATOM 0 HA ILE B 155 -9.515 14.187 -3.847 1.00 0.00 H new ATOM 0 HB ILE B 155 -6.994 12.620 -3.074 1.00 0.00 H new ATOM 0 HG12 ILE B 155 -9.220 11.841 -4.983 1.00 0.00 H new ATOM 0 HG13 ILE B 155 -7.710 12.566 -5.498 1.00 0.00 H new ATOM 0 HG21 ILE B 155 -8.527 10.874 -2.240 1.00 0.00 H new ATOM 0 HG22 ILE B 155 -8.712 12.400 -1.341 1.00 0.00 H new ATOM 0 HG23 ILE B 155 -9.914 11.939 -2.570 1.00 0.00 H new ATOM 0 HD11 ILE B 155 -7.651 10.138 -5.764 1.00 0.00 H new ATOM 0 HD12 ILE B 155 -6.457 10.664 -4.553 1.00 0.00 H new ATOM 0 HD13 ILE B 155 -7.990 9.927 -4.029 1.00 0.00 H new ATOM 2150 N LEU B 156 -7.151 14.845 -1.624 1.00 0.00 N ATOM 2151 CA LEU B 156 -6.871 15.289 -0.272 1.00 0.00 C ATOM 2152 C LEU B 156 -7.067 16.792 -0.168 1.00 0.00 C ATOM 2153 O LEU B 156 -7.499 17.300 0.862 1.00 0.00 O ATOM 2154 CB LEU B 156 -5.425 14.919 0.143 1.00 0.00 C ATOM 2155 CG LEU B 156 -4.884 13.513 -0.262 1.00 0.00 C ATOM 2156 CD1 LEU B 156 -3.526 13.284 0.337 1.00 0.00 C ATOM 2157 CD2 LEU B 156 -5.815 12.376 0.116 1.00 0.00 C ATOM 0 H LEU B 156 -6.317 14.609 -2.161 1.00 0.00 H new ATOM 0 HA LEU B 156 -7.563 14.786 0.403 1.00 0.00 H new ATOM 0 HB2 LEU B 156 -4.755 15.669 -0.278 1.00 0.00 H new ATOM 0 HB3 LEU B 156 -5.357 15.003 1.228 1.00 0.00 H new ATOM 0 HG LEU B 156 -4.817 13.514 -1.350 1.00 0.00 H new ATOM 0 HD11 LEU B 156 -3.161 12.299 0.046 1.00 0.00 H new ATOM 0 HD12 LEU B 156 -2.836 14.047 -0.023 1.00 0.00 H new ATOM 0 HD13 LEU B 156 -3.594 13.339 1.424 1.00 0.00 H new ATOM 0 HD21 LEU B 156 -5.376 11.428 -0.195 1.00 0.00 H new ATOM 0 HD22 LEU B 156 -5.963 12.370 1.196 1.00 0.00 H new ATOM 0 HD23 LEU B 156 -6.776 12.512 -0.381 1.00 0.00 H new ATOM 2169 N GLY B 157 -6.746 17.483 -1.245 1.00 0.00 N ATOM 2170 CA GLY B 157 -6.902 18.920 -1.313 1.00 0.00 C ATOM 2171 C GLY B 157 -5.677 19.672 -0.859 1.00 0.00 C ATOM 2172 O GLY B 157 -5.650 20.913 -0.882 1.00 0.00 O ATOM 0 H GLY B 157 -6.370 17.063 -2.095 1.00 0.00 H new ATOM 0 HA2 GLY B 157 -7.136 19.205 -2.338 1.00 0.00 H new ATOM 0 HA3 GLY B 157 -7.751 19.216 -0.697 1.00 0.00 H new ATOM 2176 N ASN B 158 -4.654 18.945 -0.455 1.00 0.00 N ATOM 2177 CA ASN B 158 -3.433 19.570 0.011 1.00 0.00 C ATOM 2178 C ASN B 158 -2.270 18.812 -0.533 1.00 0.00 C ATOM 2179 O ASN B 158 -2.209 17.575 -0.396 1.00 0.00 O ATOM 2180 CB ASN B 158 -3.308 19.597 1.550 1.00 0.00 C ATOM 2181 CG ASN B 158 -4.588 19.304 2.292 1.00 0.00 C ATOM 2182 OD1 ASN B 158 -4.735 18.081 2.702 1.00 0.00 O flip ATOM 2183 ND2 ASN B 158 -5.402 20.183 2.538 1.00 0.00 N flip ATOM 0 H ASN B 158 -4.644 17.925 -0.440 1.00 0.00 H new ATOM 0 HA ASN B 158 -3.453 20.603 -0.336 1.00 0.00 H new ATOM 0 HB2 ASN B 158 -2.554 18.870 1.852 1.00 0.00 H new ATOM 0 HB3 ASN B 158 -2.944 20.578 1.854 1.00 0.00 H new ATOM 0 HD21 ASN B 158 -5.247 21.131 2.196 1.00 0.00 H new ATOM 0 HD22 ASN B 158 -6.236 19.968 3.085 1.00 0.00 H new ATOM 2190 N ALA B 159 -1.339 19.528 -1.111 1.00 0.00 N ATOM 2191 CA ALA B 159 -0.160 18.941 -1.698 1.00 0.00 C ATOM 2192 C ALA B 159 0.771 18.423 -0.631 1.00 0.00 C ATOM 2193 O ALA B 159 1.564 17.545 -0.887 1.00 0.00 O ATOM 2194 CB ALA B 159 0.566 19.931 -2.571 1.00 0.00 C ATOM 0 H ALA B 159 -1.378 20.544 -1.188 1.00 0.00 H new ATOM 0 HA ALA B 159 -0.486 18.106 -2.318 1.00 0.00 H new ATOM 0 HB1 ALA B 159 1.450 19.459 -2.999 1.00 0.00 H new ATOM 0 HB2 ALA B 159 -0.094 20.261 -3.374 1.00 0.00 H new ATOM 0 HB3 ALA B 159 0.868 20.791 -1.973 1.00 0.00 H new ATOM 2200 N ALA B 160 0.658 18.959 0.577 1.00 0.00 N ATOM 2201 CA ALA B 160 1.484 18.502 1.688 1.00 0.00 C ATOM 2202 C ALA B 160 1.168 17.057 1.976 1.00 0.00 C ATOM 2203 O ALA B 160 2.046 16.219 2.067 1.00 0.00 O ATOM 2204 CB ALA B 160 1.212 19.316 2.925 1.00 0.00 C ATOM 0 H ALA B 160 0.006 19.707 0.813 1.00 0.00 H new ATOM 0 HA ALA B 160 2.533 18.617 1.413 1.00 0.00 H new ATOM 0 HB1 ALA B 160 1.839 18.958 3.741 1.00 0.00 H new ATOM 0 HB2 ALA B 160 1.437 20.364 2.728 1.00 0.00 H new ATOM 0 HB3 ALA B 160 0.163 19.216 3.203 1.00 0.00 H new ATOM 2210 N ASN B 161 -0.107 16.774 2.058 1.00 0.00 N ATOM 2211 CA ASN B 161 -0.597 15.436 2.342 1.00 0.00 C ATOM 2212 C ASN B 161 -0.299 14.527 1.165 1.00 0.00 C ATOM 2213 O ASN B 161 0.126 13.393 1.333 1.00 0.00 O ATOM 2214 CB ASN B 161 -2.110 15.464 2.593 1.00 0.00 C ATOM 2215 CG ASN B 161 -2.564 16.113 3.901 1.00 0.00 C ATOM 2216 OD1 ASN B 161 -3.628 15.808 4.400 1.00 0.00 O ATOM 2217 ND2 ASN B 161 -1.794 16.982 4.448 1.00 0.00 N ATOM 0 H ASN B 161 -0.845 17.466 1.930 1.00 0.00 H new ATOM 0 HA ASN B 161 -0.097 15.060 3.235 1.00 0.00 H new ATOM 0 HB2 ASN B 161 -2.585 15.991 1.766 1.00 0.00 H new ATOM 0 HB3 ASN B 161 -2.480 14.439 2.572 1.00 0.00 H new ATOM 0 HD21 ASN B 161 -2.072 17.432 5.320 1.00 0.00 H new ATOM 0 HD22 ASN B 161 -0.905 17.222 4.011 1.00 0.00 H new ATOM 2224 N ALA B 162 -0.481 15.073 -0.029 1.00 0.00 N ATOM 2225 CA ALA B 162 -0.284 14.351 -1.275 1.00 0.00 C ATOM 2226 C ALA B 162 1.164 13.953 -1.458 1.00 0.00 C ATOM 2227 O ALA B 162 1.449 12.843 -1.889 1.00 0.00 O ATOM 2228 CB ALA B 162 -0.731 15.210 -2.431 1.00 0.00 C ATOM 0 H ALA B 162 -0.773 16.041 -0.160 1.00 0.00 H new ATOM 0 HA ALA B 162 -0.880 13.439 -1.241 1.00 0.00 H new ATOM 0 HB1 ALA B 162 -0.583 14.668 -3.365 1.00 0.00 H new ATOM 0 HB2 ALA B 162 -1.787 15.454 -2.316 1.00 0.00 H new ATOM 0 HB3 ALA B 162 -0.146 16.130 -2.448 1.00 0.00 H new ATOM 2234 N LYS B 163 2.078 14.842 -1.099 1.00 0.00 N ATOM 2235 CA LYS B 163 3.472 14.571 -1.250 1.00 0.00 C ATOM 2236 C LYS B 163 3.892 13.544 -0.248 1.00 0.00 C ATOM 2237 O LYS B 163 4.580 12.614 -0.592 1.00 0.00 O ATOM 2238 CB LYS B 163 4.330 15.842 -1.118 1.00 0.00 C ATOM 2239 CG LYS B 163 5.827 15.536 -1.027 1.00 0.00 C ATOM 2240 CD LYS B 163 6.670 16.759 -0.756 1.00 0.00 C ATOM 2241 CE LYS B 163 8.122 16.363 -0.481 1.00 0.00 C ATOM 2242 NZ LYS B 163 8.793 15.742 -1.650 1.00 0.00 N ATOM 0 H LYS B 163 1.863 15.756 -0.701 1.00 0.00 H new ATOM 0 HA LYS B 163 3.633 14.187 -2.257 1.00 0.00 H new ATOM 0 HB2 LYS B 163 4.147 16.490 -1.975 1.00 0.00 H new ATOM 0 HB3 LYS B 163 4.021 16.394 -0.230 1.00 0.00 H new ATOM 0 HG2 LYS B 163 5.994 14.805 -0.236 1.00 0.00 H new ATOM 0 HG3 LYS B 163 6.154 15.077 -1.960 1.00 0.00 H new ATOM 0 HD2 LYS B 163 6.627 17.433 -1.611 1.00 0.00 H new ATOM 0 HD3 LYS B 163 6.268 17.302 0.099 1.00 0.00 H new ATOM 0 HE2 LYS B 163 8.681 17.248 -0.178 1.00 0.00 H new ATOM 0 HE3 LYS B 163 8.149 15.666 0.357 1.00 0.00 H new ATOM 0 HZ1 LYS B 163 9.787 15.544 -1.415 1.00 0.00 H new ATOM 0 HZ2 LYS B 163 8.311 14.854 -1.895 1.00 0.00 H new ATOM 0 HZ3 LYS B 163 8.752 16.393 -2.460 1.00 0.00 H new ATOM 2256 N GLN B 164 3.428 13.701 0.984 1.00 0.00 N ATOM 2257 CA GLN B 164 3.767 12.774 2.058 1.00 0.00 C ATOM 2258 C GLN B 164 3.356 11.354 1.718 1.00 0.00 C ATOM 2259 O GLN B 164 4.118 10.397 1.923 1.00 0.00 O ATOM 2260 CB GLN B 164 3.147 13.212 3.380 1.00 0.00 C ATOM 2261 CG GLN B 164 3.717 14.492 3.918 1.00 0.00 C ATOM 2262 CD GLN B 164 3.240 14.782 5.322 1.00 0.00 C ATOM 2263 OE1 GLN B 164 3.852 14.368 6.308 1.00 0.00 O ATOM 2264 NE2 GLN B 164 2.154 15.486 5.426 1.00 0.00 N ATOM 0 H GLN B 164 2.813 14.464 1.267 1.00 0.00 H new ATOM 0 HA GLN B 164 4.851 12.790 2.169 1.00 0.00 H new ATOM 0 HB2 GLN B 164 2.072 13.331 3.245 1.00 0.00 H new ATOM 0 HB3 GLN B 164 3.290 12.422 4.118 1.00 0.00 H new ATOM 0 HG2 GLN B 164 4.805 14.435 3.910 1.00 0.00 H new ATOM 0 HG3 GLN B 164 3.436 15.317 3.263 1.00 0.00 H new ATOM 0 HE21 GLN B 164 1.675 15.811 4.586 1.00 0.00 H new ATOM 0 HE22 GLN B 164 1.780 15.714 6.347 1.00 0.00 H new ATOM 2273 N LEU B 165 2.187 11.232 1.156 1.00 0.00 N ATOM 2274 CA LEU B 165 1.663 9.957 0.793 1.00 0.00 C ATOM 2275 C LEU B 165 2.379 9.402 -0.448 1.00 0.00 C ATOM 2276 O LEU B 165 2.863 8.266 -0.429 1.00 0.00 O ATOM 2277 CB LEU B 165 0.150 10.063 0.597 1.00 0.00 C ATOM 2278 CG LEU B 165 -0.603 8.767 0.316 1.00 0.00 C ATOM 2279 CD1 LEU B 165 -0.302 7.730 1.385 1.00 0.00 C ATOM 2280 CD2 LEU B 165 -2.094 9.044 0.267 1.00 0.00 C ATOM 0 H LEU B 165 1.574 12.018 0.939 1.00 0.00 H new ATOM 0 HA LEU B 165 1.847 9.245 1.598 1.00 0.00 H new ATOM 0 HB2 LEU B 165 -0.277 10.516 1.492 1.00 0.00 H new ATOM 0 HB3 LEU B 165 -0.038 10.750 -0.228 1.00 0.00 H new ATOM 0 HG LEU B 165 -0.276 8.373 -0.646 1.00 0.00 H new ATOM 0 HD11 LEU B 165 -0.849 6.813 1.166 1.00 0.00 H new ATOM 0 HD12 LEU B 165 0.768 7.521 1.398 1.00 0.00 H new ATOM 0 HD13 LEU B 165 -0.609 8.112 2.359 1.00 0.00 H new ATOM 0 HD21 LEU B 165 -2.630 8.116 0.066 1.00 0.00 H new ATOM 0 HD22 LEU B 165 -2.420 9.451 1.224 1.00 0.00 H new ATOM 0 HD23 LEU B 165 -2.305 9.763 -0.524 1.00 0.00 H new ATOM 2292 N TYR B 166 2.502 10.226 -1.501 1.00 0.00 N ATOM 2293 CA TYR B 166 3.159 9.813 -2.751 1.00 0.00 C ATOM 2294 C TYR B 166 4.606 9.384 -2.491 1.00 0.00 C ATOM 2295 O TYR B 166 5.106 8.406 -3.104 1.00 0.00 O ATOM 2296 CB TYR B 166 3.116 10.960 -3.781 1.00 0.00 C ATOM 2297 CG TYR B 166 3.711 10.644 -5.144 1.00 0.00 C ATOM 2298 CD1 TYR B 166 2.952 10.020 -6.122 1.00 0.00 C ATOM 2299 CD2 TYR B 166 5.028 10.982 -5.454 1.00 0.00 C ATOM 2300 CE1 TYR B 166 3.481 9.738 -7.367 1.00 0.00 C ATOM 2301 CE2 TYR B 166 5.565 10.702 -6.697 1.00 0.00 C ATOM 2302 CZ TYR B 166 4.787 10.081 -7.650 1.00 0.00 C ATOM 2303 OH TYR B 166 5.316 9.790 -8.890 1.00 0.00 O ATOM 0 H TYR B 166 2.154 11.185 -1.511 1.00 0.00 H new ATOM 0 HA TYR B 166 2.618 8.957 -3.155 1.00 0.00 H new ATOM 0 HB2 TYR B 166 2.078 11.261 -3.919 1.00 0.00 H new ATOM 0 HB3 TYR B 166 3.644 11.818 -3.364 1.00 0.00 H new ATOM 0 HD1 TYR B 166 1.929 9.749 -5.907 1.00 0.00 H new ATOM 0 HD2 TYR B 166 5.639 11.471 -4.710 1.00 0.00 H new ATOM 0 HE1 TYR B 166 2.874 9.251 -8.116 1.00 0.00 H new ATOM 0 HE2 TYR B 166 6.588 10.968 -6.920 1.00 0.00 H new ATOM 0 HH TYR B 166 6.246 10.097 -8.929 1.00 0.00 H new ATOM 2313 N ASP B 167 5.247 10.111 -1.591 1.00 0.00 N ATOM 2314 CA ASP B 167 6.621 9.865 -1.168 1.00 0.00 C ATOM 2315 C ASP B 167 6.745 8.491 -0.572 1.00 0.00 C ATOM 2316 O ASP B 167 7.590 7.708 -0.988 1.00 0.00 O ATOM 2317 CB ASP B 167 7.051 10.919 -0.128 1.00 0.00 C ATOM 2318 CG ASP B 167 8.437 10.707 0.441 1.00 0.00 C ATOM 2319 OD1 ASP B 167 9.418 11.216 -0.140 1.00 0.00 O ATOM 2320 OD2 ASP B 167 8.570 10.068 1.498 1.00 0.00 O ATOM 0 H ASP B 167 4.818 10.909 -1.121 1.00 0.00 H new ATOM 0 HA ASP B 167 7.270 9.934 -2.041 1.00 0.00 H new ATOM 0 HB2 ASP B 167 7.008 11.906 -0.589 1.00 0.00 H new ATOM 0 HB3 ASP B 167 6.331 10.918 0.691 1.00 0.00 H new ATOM 2325 N PHE B 168 5.856 8.183 0.351 1.00 0.00 N ATOM 2326 CA PHE B 168 5.875 6.919 1.059 1.00 0.00 C ATOM 2327 C PHE B 168 5.649 5.758 0.087 1.00 0.00 C ATOM 2328 O PHE B 168 6.392 4.795 0.093 1.00 0.00 O ATOM 2329 CB PHE B 168 4.810 6.940 2.158 1.00 0.00 C ATOM 2330 CG PHE B 168 4.860 5.775 3.112 1.00 0.00 C ATOM 2331 CD1 PHE B 168 5.939 5.621 3.973 1.00 0.00 C ATOM 2332 CD2 PHE B 168 3.837 4.847 3.156 1.00 0.00 C ATOM 2333 CE1 PHE B 168 5.993 4.561 4.858 1.00 0.00 C ATOM 2334 CE2 PHE B 168 3.887 3.785 4.041 1.00 0.00 C ATOM 2335 CZ PHE B 168 4.966 3.643 4.891 1.00 0.00 C ATOM 0 H PHE B 168 5.098 8.805 0.632 1.00 0.00 H new ATOM 0 HA PHE B 168 6.851 6.773 1.521 1.00 0.00 H new ATOM 0 HB2 PHE B 168 4.916 7.863 2.728 1.00 0.00 H new ATOM 0 HB3 PHE B 168 3.826 6.965 1.690 1.00 0.00 H new ATOM 0 HD1 PHE B 168 6.746 6.339 3.951 1.00 0.00 H new ATOM 0 HD2 PHE B 168 2.991 4.952 2.493 1.00 0.00 H new ATOM 0 HE1 PHE B 168 6.838 4.452 5.522 1.00 0.00 H new ATOM 0 HE2 PHE B 168 3.081 3.066 4.067 1.00 0.00 H new ATOM 0 HZ PHE B 168 5.005 2.813 5.581 1.00 0.00 H new ATOM 2345 N ILE B 169 4.658 5.925 -0.782 1.00 0.00 N ATOM 2346 CA ILE B 169 4.272 4.942 -1.815 1.00 0.00 C ATOM 2347 C ILE B 169 5.445 4.589 -2.768 1.00 0.00 C ATOM 2348 O ILE B 169 5.535 3.453 -3.318 1.00 0.00 O ATOM 2349 CB ILE B 169 3.080 5.505 -2.647 1.00 0.00 C ATOM 2350 CG1 ILE B 169 1.836 5.671 -1.777 1.00 0.00 C ATOM 2351 CG2 ILE B 169 2.770 4.645 -3.858 1.00 0.00 C ATOM 2352 CD1 ILE B 169 0.695 6.351 -2.493 1.00 0.00 C ATOM 0 H ILE B 169 4.080 6.765 -0.797 1.00 0.00 H new ATOM 0 HA ILE B 169 3.983 4.026 -1.301 1.00 0.00 H new ATOM 0 HB ILE B 169 3.384 6.486 -3.012 1.00 0.00 H new ATOM 0 HG12 ILE B 169 1.508 4.690 -1.433 1.00 0.00 H new ATOM 0 HG13 ILE B 169 2.096 6.249 -0.890 1.00 0.00 H new ATOM 0 HG21 ILE B 169 1.933 5.077 -4.406 1.00 0.00 H new ATOM 0 HG22 ILE B 169 3.645 4.601 -4.507 1.00 0.00 H new ATOM 0 HG23 ILE B 169 2.509 3.638 -3.532 1.00 0.00 H new ATOM 0 HD11 ILE B 169 -0.157 6.438 -1.819 1.00 0.00 H new ATOM 0 HD12 ILE B 169 1.007 7.345 -2.813 1.00 0.00 H new ATOM 0 HD13 ILE B 169 0.410 5.762 -3.365 1.00 0.00 H new ATOM 2364 N HIS B 170 6.306 5.565 -3.001 1.00 0.00 N ATOM 2365 CA HIS B 170 7.425 5.384 -3.922 1.00 0.00 C ATOM 2366 C HIS B 170 8.791 5.273 -3.254 1.00 0.00 C ATOM 2367 O HIS B 170 9.802 5.149 -3.943 1.00 0.00 O ATOM 2368 CB HIS B 170 7.430 6.459 -5.009 1.00 0.00 C ATOM 2369 CG HIS B 170 6.321 6.290 -5.989 1.00 0.00 C ATOM 2370 ND1 HIS B 170 5.074 6.843 -5.821 1.00 0.00 N ATOM 2371 CD2 HIS B 170 6.268 5.587 -7.141 1.00 0.00 C ATOM 2372 CE1 HIS B 170 4.301 6.475 -6.833 1.00 0.00 C ATOM 2373 NE2 HIS B 170 5.006 5.718 -7.640 1.00 0.00 N ATOM 0 H HIS B 170 6.256 6.488 -2.570 1.00 0.00 H new ATOM 0 HA HIS B 170 7.253 4.411 -4.383 1.00 0.00 H new ATOM 0 HB2 HIS B 170 7.351 7.441 -4.543 1.00 0.00 H new ATOM 0 HB3 HIS B 170 8.383 6.432 -5.537 1.00 0.00 H new ATOM 0 HD1 HIS B 170 4.790 7.440 -5.044 1.00 0.00 H new ATOM 0 HD2 HIS B 170 7.076 5.025 -7.585 1.00 0.00 H new ATOM 0 HE1 HIS B 170 3.266 6.752 -6.970 1.00 0.00 H new ATOM 2382 N THR B 171 8.843 5.287 -1.960 1.00 0.00 N ATOM 2383 CA THR B 171 10.114 5.130 -1.295 1.00 0.00 C ATOM 2384 C THR B 171 10.384 3.661 -1.039 1.00 0.00 C ATOM 2385 O THR B 171 9.797 3.079 -0.146 1.00 0.00 O ATOM 2386 CB THR B 171 10.187 5.927 0.033 1.00 0.00 C ATOM 2387 OG1 THR B 171 10.107 7.335 -0.246 1.00 0.00 O ATOM 2388 CG2 THR B 171 11.481 5.625 0.794 1.00 0.00 C ATOM 0 H THR B 171 8.039 5.403 -1.344 1.00 0.00 H new ATOM 0 HA THR B 171 10.881 5.535 -1.955 1.00 0.00 H new ATOM 0 HB THR B 171 9.348 5.624 0.659 1.00 0.00 H new ATOM 0 HG1 THR B 171 9.266 7.529 -0.710 1.00 0.00 H new ATOM 0 HG21 THR B 171 11.501 6.200 1.720 1.00 0.00 H new ATOM 0 HG22 THR B 171 11.527 4.561 1.026 1.00 0.00 H new ATOM 0 HG23 THR B 171 12.338 5.899 0.178 1.00 0.00 H new ATOM 2396 N SER B 172 11.249 3.061 -1.855 1.00 0.00 N ATOM 2397 CA SER B 172 11.619 1.672 -1.706 1.00 0.00 C ATOM 2398 C SER B 172 12.130 1.450 -0.271 1.00 0.00 C ATOM 2399 O SER B 172 12.758 2.353 0.323 1.00 0.00 O ATOM 2400 CB SER B 172 12.724 1.329 -2.699 1.00 0.00 C ATOM 2401 OG SER B 172 12.609 2.108 -3.900 1.00 0.00 O ATOM 0 H SER B 172 11.708 3.532 -2.635 1.00 0.00 H new ATOM 0 HA SER B 172 10.756 1.034 -1.898 1.00 0.00 H new ATOM 0 HB2 SER B 172 13.696 1.507 -2.240 1.00 0.00 H new ATOM 0 HB3 SER B 172 12.677 0.268 -2.946 1.00 0.00 H new ATOM 0 HG SER B 172 13.103 1.669 -4.623 1.00 0.00 H new ATOM 2407 N PHE B 173 11.900 0.264 0.257 1.00 0.00 N ATOM 2408 CA PHE B 173 12.206 -0.081 1.670 1.00 0.00 C ATOM 2409 C PHE B 173 13.686 0.148 2.037 1.00 0.00 C ATOM 2410 O PHE B 173 14.033 0.208 3.217 1.00 0.00 O ATOM 2411 CB PHE B 173 11.851 -1.552 1.934 1.00 0.00 C ATOM 2412 CG PHE B 173 10.558 -1.983 1.292 1.00 0.00 C ATOM 2413 CD1 PHE B 173 9.317 -1.669 1.846 1.00 0.00 C ATOM 2414 CD2 PHE B 173 10.592 -2.667 0.090 1.00 0.00 C ATOM 2415 CE1 PHE B 173 8.161 -2.029 1.199 1.00 0.00 C ATOM 2416 CE2 PHE B 173 9.438 -3.041 -0.546 1.00 0.00 C ATOM 2417 CZ PHE B 173 8.220 -2.720 0.001 1.00 0.00 C ATOM 0 H PHE B 173 11.492 -0.508 -0.270 1.00 0.00 H new ATOM 0 HA PHE B 173 11.605 0.582 2.292 1.00 0.00 H new ATOM 0 HB2 PHE B 173 12.659 -2.184 1.565 1.00 0.00 H new ATOM 0 HB3 PHE B 173 11.785 -1.714 3.010 1.00 0.00 H new ATOM 0 HD1 PHE B 173 9.265 -1.141 2.787 1.00 0.00 H new ATOM 0 HD2 PHE B 173 11.546 -2.910 -0.355 1.00 0.00 H new ATOM 0 HE1 PHE B 173 7.203 -1.772 1.626 1.00 0.00 H new ATOM 0 HE2 PHE B 173 9.486 -3.588 -1.476 1.00 0.00 H new ATOM 0 HZ PHE B 173 7.309 -3.006 -0.503 1.00 0.00 H new