USER MOD reduce.3.24.130724 H: found=0, std=0, add=912, rem=0, adj=35 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 127 ASN :FLIP amide:sc= 0 F(o=-3.3,f=-2.7) USER MOD Set 1.2: B 130 ASN : amide:sc= -1.15! C(o=-2.7!,f=-12!) USER MOD Set 1.3: B 161 ASN : amide:sc= -1.51 K(o=-2.7,f=-12!) USER MOD Set 2.1: B 117 GLN : amide:sc= 0 X(o=-3.4,f=-3.5) USER MOD Set 2.2: B 131 CYS SG : rot -140:sc= -1.21 USER MOD Set 2.3: B 135 MET CE :methyl -123:sc= -2.18! (180deg=-3.66!) USER MOD Set 3.1: A 70 HIS : no HE2:sc= 0.518 K(o=0.52,f=-3.7!) USER MOD Set 3.2: B 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.1: A 27 ASN :FLIP amide:sc= 0.922 F(o=-6.8,f=-2) USER MOD Set 4.2: A 30 ASN :FLIP amide:sc= -3.48! C(o=-6.1!,f=-2!) USER MOD Set 4.3: A 61 ASN :FLIP amide:sc= 0.55 F(o=-3.7,f=-2) USER MOD Set 5.1: A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 5.2: B 170 HIS : no HE2:sc= 0.238 K(o=0.24,f=-1.6!) USER MOD Set 6.1: A 17 GLN : amide:sc= -0.0716 X(o=-3.6,f=-3.8) USER MOD Set 6.2: A 31 CYS SG : rot -170:sc= -0.292 USER MOD Set 6.3: A 35 MET CE :methyl -165:sc= -3.21! (180deg=-3.09!) USER MOD Single : A 22 LYS NZ :NH3+ -116:sc= -0.177 (180deg=-1.48!) USER MOD Single : A 23 MET CE :methyl 159:sc= -0.216 (180deg=-0.915) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 SER OG : rot 85:sc= 0.37 USER MOD Single : A 36 HIS : no HD1:sc= -0.045 X(o=-0.045,f=-0.0035) USER MOD Single : A 37 HIS :FLIP no HE2:sc= 0.237 F(o=-0.91,f=0.24) USER MOD Single : A 40 ASN : amide:sc= -2.75! C(o=-2.8!,f=-6.2!) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= -1.34! C(o=-1.3!,f=-2.5!) USER MOD Single : A 53 THR OG1 : rot 73:sc= 1.18 USER MOD Single : A 54 SER OG : rot 81:sc= 0.583 USER MOD Single : A 58 ASN :FLIP amide:sc= 0 F(o=-0.64,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 171:sc= -0.0106 (180deg=-0.168) USER MOD Single : A 64 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 THR OG1 : rot 81:sc= 0.0277 USER MOD Single : A 72 SER OG : rot 180:sc= -2.25! USER MOD Single : B 122 LYS NZ :NH3+ -172:sc= 0.814 (180deg=0.657) USER MOD Single : B 123 MET CE :methyl 147:sc= -0.124 (180deg=-2.02!) USER MOD Single : B 129 LYS NZ :NH3+ 147:sc= -0.547 (180deg=-2.17!) USER MOD Single : B 133 SER OG : rot 88:sc= 0.00978 USER MOD Single : B 136 HIS : no HD1:sc= -0.0361 X(o=-0.036,f=0) USER MOD Single : B 137 HIS :FLIP no HE2:sc= 0.115 F(o=-0.44,f=0.11) USER MOD Single : B 140 ASN : amide:sc= -1.67! C(o=-1.7!,f=-9.9!) USER MOD Single : B 148 SER OG : rot 180:sc= 0 USER MOD Single : B 149 GLN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : B 153 THR OG1 : rot 78:sc= 1.23 USER MOD Single : B 154 SER OG : rot 180:sc= 0 USER MOD Single : B 158 ASN :FLIP amide:sc= 0 F(o=-1,f=0) USER MOD Single : B 163 LYS NZ :NH3+ -175:sc=-0.00658 (180deg=-0.0596) USER MOD Single : B 164 GLN : amide:sc=-0.00957 X(o=-0.0096,f=0) USER MOD Single : B 166 TYR OH : rot 180:sc= 0 USER MOD Single : B 171 THR OG1 : rot 56:sc= 1.27 USER MOD Single : B 172 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 217 N GLY A 15 9.438 2.299 8.752 1.00 0.00 N ATOM 218 CA GLY A 15 8.170 2.745 8.177 1.00 0.00 C ATOM 219 C GLY A 15 7.655 1.833 7.066 1.00 0.00 C ATOM 220 O GLY A 15 6.698 1.086 7.275 1.00 0.00 O ATOM 0 HA2 GLY A 15 7.421 2.802 8.967 1.00 0.00 H new ATOM 0 HA3 GLY A 15 8.293 3.753 7.782 1.00 0.00 H new ATOM 224 N PRO A 16 8.290 1.845 5.892 1.00 0.00 N ATOM 225 CA PRO A 16 7.871 1.020 4.760 1.00 0.00 C ATOM 226 C PRO A 16 8.086 -0.515 5.006 1.00 0.00 C ATOM 227 O PRO A 16 7.288 -1.348 4.537 1.00 0.00 O ATOM 228 CB PRO A 16 8.735 1.572 3.604 1.00 0.00 C ATOM 229 CG PRO A 16 9.945 2.094 4.275 1.00 0.00 C ATOM 230 CD PRO A 16 9.454 2.693 5.553 1.00 0.00 C ATOM 0 HA PRO A 16 6.801 1.082 4.561 1.00 0.00 H new ATOM 0 HB2 PRO A 16 8.983 0.792 2.884 1.00 0.00 H new ATOM 0 HB3 PRO A 16 8.213 2.357 3.056 1.00 0.00 H new ATOM 0 HG2 PRO A 16 10.665 1.298 4.464 1.00 0.00 H new ATOM 0 HG3 PRO A 16 10.448 2.839 3.658 1.00 0.00 H new ATOM 0 HD2 PRO A 16 10.216 2.663 6.332 1.00 0.00 H new ATOM 0 HD3 PRO A 16 9.169 3.737 5.426 1.00 0.00 H new ATOM 238 N GLN A 17 9.122 -0.881 5.772 1.00 0.00 N ATOM 239 CA GLN A 17 9.399 -2.299 6.061 1.00 0.00 C ATOM 240 C GLN A 17 8.296 -2.902 6.933 1.00 0.00 C ATOM 241 O GLN A 17 7.716 -3.942 6.603 1.00 0.00 O ATOM 242 CB GLN A 17 10.771 -2.475 6.722 1.00 0.00 C ATOM 243 CG GLN A 17 11.078 -3.916 7.116 1.00 0.00 C ATOM 244 CD GLN A 17 12.471 -4.099 7.672 1.00 0.00 C ATOM 245 OE1 GLN A 17 13.040 -3.193 8.278 1.00 0.00 O ATOM 246 NE2 GLN A 17 13.027 -5.271 7.488 1.00 0.00 N ATOM 0 H GLN A 17 9.777 -0.226 6.199 1.00 0.00 H new ATOM 0 HA GLN A 17 9.416 -2.834 5.111 1.00 0.00 H new ATOM 0 HB2 GLN A 17 11.543 -2.122 6.038 1.00 0.00 H new ATOM 0 HB3 GLN A 17 10.820 -1.846 7.611 1.00 0.00 H new ATOM 0 HG2 GLN A 17 10.351 -4.245 7.859 1.00 0.00 H new ATOM 0 HG3 GLN A 17 10.955 -4.558 6.244 1.00 0.00 H new ATOM 0 HE21 GLN A 17 12.525 -5.999 6.980 1.00 0.00 H new ATOM 0 HE22 GLN A 17 13.962 -5.455 7.853 1.00 0.00 H new ATOM 255 N ASP A 18 7.991 -2.224 8.018 1.00 0.00 N ATOM 256 CA ASP A 18 6.918 -2.618 8.934 1.00 0.00 C ATOM 257 C ASP A 18 5.584 -2.538 8.221 1.00 0.00 C ATOM 258 O ASP A 18 4.636 -3.261 8.554 1.00 0.00 O ATOM 259 CB ASP A 18 6.929 -1.756 10.204 1.00 0.00 C ATOM 260 CG ASP A 18 5.775 -2.016 11.139 1.00 0.00 C ATOM 261 OD1 ASP A 18 5.765 -3.057 11.831 1.00 0.00 O ATOM 262 OD2 ASP A 18 4.853 -1.163 11.207 1.00 0.00 O ATOM 0 H ASP A 18 8.479 -1.374 8.301 1.00 0.00 H new ATOM 0 HA ASP A 18 7.083 -3.649 9.248 1.00 0.00 H new ATOM 0 HB2 ASP A 18 7.862 -1.931 10.740 1.00 0.00 H new ATOM 0 HB3 ASP A 18 6.919 -0.705 9.916 1.00 0.00 H new ATOM 267 N PHE A 19 5.513 -1.647 7.224 1.00 0.00 N ATOM 268 CA PHE A 19 4.305 -1.461 6.452 1.00 0.00 C ATOM 269 C PHE A 19 3.960 -2.752 5.726 1.00 0.00 C ATOM 270 O PHE A 19 2.802 -3.096 5.585 1.00 0.00 O ATOM 271 CB PHE A 19 4.467 -0.316 5.464 1.00 0.00 C ATOM 272 CG PHE A 19 3.174 0.219 4.981 1.00 0.00 C ATOM 273 CD1 PHE A 19 2.353 0.891 5.868 1.00 0.00 C ATOM 274 CD2 PHE A 19 2.771 0.076 3.663 1.00 0.00 C ATOM 275 CE1 PHE A 19 1.155 1.411 5.467 1.00 0.00 C ATOM 276 CE2 PHE A 19 1.560 0.599 3.259 1.00 0.00 C ATOM 277 CZ PHE A 19 0.756 1.268 4.167 1.00 0.00 C ATOM 0 H PHE A 19 6.288 -1.047 6.942 1.00 0.00 H new ATOM 0 HA PHE A 19 3.489 -1.205 7.128 1.00 0.00 H new ATOM 0 HB2 PHE A 19 5.032 0.487 5.937 1.00 0.00 H new ATOM 0 HB3 PHE A 19 5.053 -0.659 4.611 1.00 0.00 H new ATOM 0 HD1 PHE A 19 2.664 1.007 6.896 1.00 0.00 H new ATOM 0 HD2 PHE A 19 3.402 -0.442 2.956 1.00 0.00 H new ATOM 0 HE1 PHE A 19 0.526 1.932 6.173 1.00 0.00 H new ATOM 0 HE2 PHE A 19 1.239 0.487 2.234 1.00 0.00 H new ATOM 0 HZ PHE A 19 -0.190 1.679 3.847 1.00 0.00 H new ATOM 287 N LEU A 20 4.981 -3.460 5.292 1.00 0.00 N ATOM 288 CA LEU A 20 4.800 -4.765 4.685 1.00 0.00 C ATOM 289 C LEU A 20 4.384 -5.784 5.718 1.00 0.00 C ATOM 290 O LEU A 20 3.416 -6.479 5.542 1.00 0.00 O ATOM 291 CB LEU A 20 6.087 -5.253 4.054 1.00 0.00 C ATOM 292 CG LEU A 20 6.643 -4.429 2.928 1.00 0.00 C ATOM 293 CD1 LEU A 20 7.946 -5.032 2.463 1.00 0.00 C ATOM 294 CD2 LEU A 20 5.647 -4.347 1.784 1.00 0.00 C ATOM 0 H LEU A 20 5.952 -3.153 5.348 1.00 0.00 H new ATOM 0 HA LEU A 20 4.026 -4.657 3.925 1.00 0.00 H new ATOM 0 HB2 LEU A 20 6.845 -5.318 4.835 1.00 0.00 H new ATOM 0 HB3 LEU A 20 5.922 -6.265 3.685 1.00 0.00 H new ATOM 0 HG LEU A 20 6.827 -3.415 3.281 1.00 0.00 H new ATOM 0 HD11 LEU A 20 8.352 -4.436 1.646 1.00 0.00 H new ATOM 0 HD12 LEU A 20 8.656 -5.045 3.290 1.00 0.00 H new ATOM 0 HD13 LEU A 20 7.772 -6.051 2.117 1.00 0.00 H new ATOM 0 HD21 LEU A 20 6.068 -3.746 0.978 1.00 0.00 H new ATOM 0 HD22 LEU A 20 5.433 -5.350 1.415 1.00 0.00 H new ATOM 0 HD23 LEU A 20 4.725 -3.886 2.137 1.00 0.00 H new ATOM 306 N LEU A 21 5.115 -5.833 6.817 1.00 0.00 N ATOM 307 CA LEU A 21 4.920 -6.851 7.869 1.00 0.00 C ATOM 308 C LEU A 21 3.510 -6.862 8.470 1.00 0.00 C ATOM 309 O LEU A 21 3.071 -7.878 9.032 1.00 0.00 O ATOM 310 CB LEU A 21 5.952 -6.682 8.973 1.00 0.00 C ATOM 311 CG LEU A 21 7.413 -6.847 8.565 1.00 0.00 C ATOM 312 CD1 LEU A 21 8.330 -6.538 9.734 1.00 0.00 C ATOM 313 CD2 LEU A 21 7.664 -8.260 8.081 1.00 0.00 C ATOM 0 H LEU A 21 5.866 -5.173 7.019 1.00 0.00 H new ATOM 0 HA LEU A 21 5.053 -7.814 7.376 1.00 0.00 H new ATOM 0 HB2 LEU A 21 5.828 -5.690 9.408 1.00 0.00 H new ATOM 0 HB3 LEU A 21 5.733 -7.404 9.759 1.00 0.00 H new ATOM 0 HG LEU A 21 7.624 -6.147 7.756 1.00 0.00 H new ATOM 0 HD11 LEU A 21 9.368 -6.661 9.425 1.00 0.00 H new ATOM 0 HD12 LEU A 21 8.168 -5.511 10.062 1.00 0.00 H new ATOM 0 HD13 LEU A 21 8.113 -7.220 10.556 1.00 0.00 H new ATOM 0 HD21 LEU A 21 8.710 -8.365 7.793 1.00 0.00 H new ATOM 0 HD22 LEU A 21 7.435 -8.965 8.881 1.00 0.00 H new ATOM 0 HD23 LEU A 21 7.028 -8.468 7.221 1.00 0.00 H new ATOM 325 N LYS A 22 2.804 -5.767 8.332 1.00 0.00 N ATOM 326 CA LYS A 22 1.472 -5.651 8.878 1.00 0.00 C ATOM 327 C LYS A 22 0.420 -6.030 7.848 1.00 0.00 C ATOM 328 O LYS A 22 -0.783 -6.041 8.142 1.00 0.00 O ATOM 329 CB LYS A 22 1.231 -4.244 9.356 1.00 0.00 C ATOM 330 CG LYS A 22 1.247 -3.230 8.252 1.00 0.00 C ATOM 331 CD LYS A 22 0.910 -1.848 8.732 1.00 0.00 C ATOM 332 CE LYS A 22 2.067 -1.155 9.485 1.00 0.00 C ATOM 333 NZ LYS A 22 2.291 -1.657 10.856 1.00 0.00 N ATOM 0 H LYS A 22 3.133 -4.935 7.842 1.00 0.00 H new ATOM 0 HA LYS A 22 1.392 -6.340 9.719 1.00 0.00 H new ATOM 0 HB2 LYS A 22 0.268 -4.201 9.865 1.00 0.00 H new ATOM 0 HB3 LYS A 22 1.992 -3.982 10.091 1.00 0.00 H new ATOM 0 HG2 LYS A 22 2.233 -3.219 7.788 1.00 0.00 H new ATOM 0 HG3 LYS A 22 0.536 -3.526 7.481 1.00 0.00 H new ATOM 0 HD2 LYS A 22 0.626 -1.235 7.877 1.00 0.00 H new ATOM 0 HD3 LYS A 22 0.041 -1.902 9.388 1.00 0.00 H new ATOM 0 HE2 LYS A 22 2.985 -1.281 8.911 1.00 0.00 H new ATOM 0 HE3 LYS A 22 1.864 -0.085 9.532 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 2.104 -0.896 11.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 1.650 -2.455 11.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 3.277 -1.975 10.953 1.00 0.00 H new ATOM 347 N MET A 23 0.856 -6.331 6.655 1.00 0.00 N ATOM 348 CA MET A 23 -0.055 -6.680 5.600 1.00 0.00 C ATOM 349 C MET A 23 -0.440 -8.144 5.733 1.00 0.00 C ATOM 350 O MET A 23 0.417 -8.990 6.027 1.00 0.00 O ATOM 351 CB MET A 23 0.565 -6.459 4.220 1.00 0.00 C ATOM 352 CG MET A 23 1.023 -5.048 3.936 1.00 0.00 C ATOM 353 SD MET A 23 1.638 -4.867 2.248 1.00 0.00 S ATOM 354 CE MET A 23 2.035 -3.127 2.185 1.00 0.00 C ATOM 0 H MET A 23 1.841 -6.341 6.389 1.00 0.00 H new ATOM 0 HA MET A 23 -0.931 -6.038 5.690 1.00 0.00 H new ATOM 0 HB2 MET A 23 1.418 -7.129 4.112 1.00 0.00 H new ATOM 0 HB3 MET A 23 -0.164 -6.746 3.462 1.00 0.00 H new ATOM 0 HG2 MET A 23 0.195 -4.358 4.097 1.00 0.00 H new ATOM 0 HG3 MET A 23 1.808 -4.772 4.640 1.00 0.00 H new ATOM 0 HE1 MET A 23 2.746 -2.945 1.379 1.00 0.00 H new ATOM 0 HE2 MET A 23 1.126 -2.553 2.004 1.00 0.00 H new ATOM 0 HE3 MET A 23 2.475 -2.820 3.134 1.00 0.00 H new ATOM 364 N PRO A 24 -1.726 -8.472 5.569 1.00 0.00 N ATOM 365 CA PRO A 24 -2.173 -9.852 5.592 1.00 0.00 C ATOM 366 C PRO A 24 -1.545 -10.620 4.436 1.00 0.00 C ATOM 367 O PRO A 24 -1.756 -10.289 3.278 1.00 0.00 O ATOM 368 CB PRO A 24 -3.699 -9.765 5.423 1.00 0.00 C ATOM 369 CG PRO A 24 -3.958 -8.404 4.875 1.00 0.00 C ATOM 370 CD PRO A 24 -2.838 -7.530 5.363 1.00 0.00 C ATOM 0 HA PRO A 24 -1.892 -10.373 6.507 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -4.064 -10.537 4.746 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -4.209 -9.909 6.376 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -3.989 -8.423 3.786 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -4.922 -8.026 5.215 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -2.582 -6.762 4.633 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -3.104 -7.016 6.287 1.00 0.00 H new ATOM 378 N GLY A 25 -0.759 -11.606 4.757 1.00 0.00 N ATOM 379 CA GLY A 25 -0.082 -12.352 3.746 1.00 0.00 C ATOM 380 C GLY A 25 1.418 -12.156 3.839 1.00 0.00 C ATOM 381 O GLY A 25 2.184 -12.740 3.088 1.00 0.00 O ATOM 0 H GLY A 25 -0.573 -11.910 5.713 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -0.321 -13.410 3.849 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -0.433 -12.040 2.762 1.00 0.00 H new ATOM 385 N VAL A 26 1.841 -11.323 4.753 1.00 0.00 N ATOM 386 CA VAL A 26 3.247 -11.038 4.901 1.00 0.00 C ATOM 387 C VAL A 26 3.830 -11.585 6.208 1.00 0.00 C ATOM 388 O VAL A 26 3.216 -11.508 7.270 1.00 0.00 O ATOM 389 CB VAL A 26 3.553 -9.517 4.759 1.00 0.00 C ATOM 390 CG1 VAL A 26 5.037 -9.212 4.988 1.00 0.00 C ATOM 391 CG2 VAL A 26 3.135 -9.022 3.381 1.00 0.00 C ATOM 0 H VAL A 26 1.234 -10.829 5.407 1.00 0.00 H new ATOM 0 HA VAL A 26 3.741 -11.561 4.082 1.00 0.00 H new ATOM 0 HB VAL A 26 2.979 -8.996 5.525 1.00 0.00 H new ATOM 0 HG11 VAL A 26 5.209 -8.141 4.880 1.00 0.00 H new ATOM 0 HG12 VAL A 26 5.322 -9.526 5.992 1.00 0.00 H new ATOM 0 HG13 VAL A 26 5.637 -9.752 4.255 1.00 0.00 H new ATOM 0 HG21 VAL A 26 3.354 -7.958 3.295 1.00 0.00 H new ATOM 0 HG22 VAL A 26 3.685 -9.569 2.616 1.00 0.00 H new ATOM 0 HG23 VAL A 26 2.066 -9.184 3.245 1.00 0.00 H new ATOM 401 N ASN A 27 5.007 -12.160 6.080 1.00 0.00 N ATOM 402 CA ASN A 27 5.829 -12.636 7.183 1.00 0.00 C ATOM 403 C ASN A 27 7.176 -12.032 6.941 1.00 0.00 C ATOM 404 O ASN A 27 7.452 -11.627 5.806 1.00 0.00 O ATOM 405 CB ASN A 27 6.002 -14.165 7.179 1.00 0.00 C ATOM 406 CG ASN A 27 4.721 -14.952 7.237 1.00 0.00 C ATOM 407 OD1 ASN A 27 4.250 -15.357 6.102 1.00 0.00 O flip ATOM 408 ND2 ASN A 27 4.201 -15.253 8.311 1.00 0.00 N flip ATOM 0 H ASN A 27 5.439 -12.317 5.169 1.00 0.00 H new ATOM 0 HA ASN A 27 5.367 -12.365 8.133 1.00 0.00 H new ATOM 0 HB2 ASN A 27 6.546 -14.451 6.279 1.00 0.00 H new ATOM 0 HB3 ASN A 27 6.623 -14.447 8.030 1.00 0.00 H new ATOM 0 HD21 ASN A 27 4.603 -14.914 9.185 1.00 0.00 H new ATOM 0 HD22 ASN A 27 3.368 -15.842 8.327 1.00 0.00 H new ATOM 415 N ALA A 28 8.027 -12.003 7.935 1.00 0.00 N ATOM 416 CA ALA A 28 9.342 -11.384 7.813 1.00 0.00 C ATOM 417 C ALA A 28 10.219 -12.085 6.778 1.00 0.00 C ATOM 418 O ALA A 28 11.019 -11.438 6.092 1.00 0.00 O ATOM 419 CB ALA A 28 10.033 -11.307 9.163 1.00 0.00 C ATOM 0 H ALA A 28 7.838 -12.404 8.854 1.00 0.00 H new ATOM 0 HA ALA A 28 9.186 -10.367 7.453 1.00 0.00 H new ATOM 0 HB1 ALA A 28 11.012 -10.842 9.045 1.00 0.00 H new ATOM 0 HB2 ALA A 28 9.429 -10.712 9.848 1.00 0.00 H new ATOM 0 HB3 ALA A 28 10.156 -12.312 9.567 1.00 0.00 H new ATOM 425 N LYS A 29 10.003 -13.375 6.607 1.00 0.00 N ATOM 426 CA LYS A 29 10.786 -14.166 5.672 1.00 0.00 C ATOM 427 C LYS A 29 10.492 -13.722 4.239 1.00 0.00 C ATOM 428 O LYS A 29 11.387 -13.399 3.448 1.00 0.00 O ATOM 429 CB LYS A 29 10.491 -15.683 5.860 1.00 0.00 C ATOM 430 CG LYS A 29 9.001 -16.069 5.747 1.00 0.00 C ATOM 431 CD LYS A 29 8.759 -17.574 5.824 1.00 0.00 C ATOM 432 CE LYS A 29 9.406 -18.302 4.661 1.00 0.00 C ATOM 433 NZ LYS A 29 9.047 -19.730 4.624 1.00 0.00 N ATOM 0 H LYS A 29 9.287 -13.902 7.106 1.00 0.00 H new ATOM 0 HA LYS A 29 11.845 -14.005 5.872 1.00 0.00 H new ATOM 0 HB2 LYS A 29 11.055 -16.244 5.115 1.00 0.00 H new ATOM 0 HB3 LYS A 29 10.859 -15.992 6.838 1.00 0.00 H new ATOM 0 HG2 LYS A 29 8.444 -15.577 6.545 1.00 0.00 H new ATOM 0 HG3 LYS A 29 8.606 -15.692 4.803 1.00 0.00 H new ATOM 0 HD2 LYS A 29 9.157 -17.960 6.763 1.00 0.00 H new ATOM 0 HD3 LYS A 29 7.687 -17.771 5.827 1.00 0.00 H new ATOM 0 HE2 LYS A 29 9.104 -17.830 3.726 1.00 0.00 H new ATOM 0 HE3 LYS A 29 10.489 -18.204 4.732 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 9.513 -20.184 3.813 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 9.358 -20.189 5.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 8.016 -19.826 4.530 1.00 0.00 H new ATOM 447 N ASN A 30 9.236 -13.593 3.949 1.00 0.00 N ATOM 448 CA ASN A 30 8.826 -13.259 2.628 1.00 0.00 C ATOM 449 C ASN A 30 8.789 -11.773 2.419 1.00 0.00 C ATOM 450 O ASN A 30 8.639 -11.310 1.319 1.00 0.00 O ATOM 451 CB ASN A 30 7.527 -13.972 2.228 1.00 0.00 C ATOM 452 CG ASN A 30 6.341 -13.798 3.178 1.00 0.00 C ATOM 453 OD1 ASN A 30 5.492 -12.836 2.936 1.00 0.00 O flip ATOM 454 ND2 ASN A 30 6.193 -14.554 4.120 1.00 0.00 N flip ATOM 0 H ASN A 30 8.474 -13.715 4.616 1.00 0.00 H new ATOM 0 HA ASN A 30 9.583 -13.637 1.941 1.00 0.00 H new ATOM 0 HB2 ASN A 30 7.231 -13.616 1.241 1.00 0.00 H new ATOM 0 HB3 ASN A 30 7.736 -15.037 2.133 1.00 0.00 H new ATOM 0 HD21 ASN A 30 6.870 -15.298 4.288 1.00 0.00 H new ATOM 0 HD22 ASN A 30 5.392 -14.444 4.741 1.00 0.00 H new ATOM 461 N CYS A 31 8.942 -11.048 3.495 1.00 0.00 N ATOM 462 CA CYS A 31 9.062 -9.608 3.474 1.00 0.00 C ATOM 463 C CYS A 31 10.422 -9.230 2.962 1.00 0.00 C ATOM 464 O CYS A 31 10.543 -8.364 2.137 1.00 0.00 O ATOM 465 CB CYS A 31 8.870 -9.023 4.863 1.00 0.00 C ATOM 466 SG CYS A 31 9.078 -7.235 4.989 1.00 0.00 S ATOM 0 H CYS A 31 8.988 -11.447 4.432 1.00 0.00 H new ATOM 0 HA CYS A 31 8.287 -9.208 2.820 1.00 0.00 H new ATOM 0 HB2 CYS A 31 7.870 -9.280 5.211 1.00 0.00 H new ATOM 0 HB3 CYS A 31 9.577 -9.502 5.541 1.00 0.00 H new ATOM 0 HG CYS A 31 9.098 -6.888 6.242 1.00 0.00 H new ATOM 472 N ARG A 32 11.452 -9.901 3.463 1.00 0.00 N ATOM 473 CA ARG A 32 12.813 -9.605 3.050 1.00 0.00 C ATOM 474 C ARG A 32 12.990 -9.965 1.575 1.00 0.00 C ATOM 475 O ARG A 32 13.557 -9.188 0.776 1.00 0.00 O ATOM 476 CB ARG A 32 13.834 -10.327 3.963 1.00 0.00 C ATOM 477 CG ARG A 32 13.895 -11.842 3.837 1.00 0.00 C ATOM 478 CD ARG A 32 15.057 -12.245 2.927 1.00 0.00 C ATOM 479 NE ARG A 32 15.145 -13.681 2.688 1.00 0.00 N ATOM 480 CZ ARG A 32 16.118 -14.275 1.979 1.00 0.00 C ATOM 481 NH1 ARG A 32 17.106 -13.550 1.449 1.00 0.00 N ATOM 482 NH2 ARG A 32 16.100 -15.584 1.803 1.00 0.00 N ATOM 0 H ARG A 32 11.369 -10.649 4.152 1.00 0.00 H new ATOM 0 HA ARG A 32 13.004 -8.537 3.157 1.00 0.00 H new ATOM 0 HB2 ARG A 32 14.825 -9.926 3.753 1.00 0.00 H new ATOM 0 HB3 ARG A 32 13.603 -10.079 4.999 1.00 0.00 H new ATOM 0 HG2 ARG A 32 14.020 -12.292 4.822 1.00 0.00 H new ATOM 0 HG3 ARG A 32 12.957 -12.219 3.431 1.00 0.00 H new ATOM 0 HD2 ARG A 32 14.952 -11.732 1.971 1.00 0.00 H new ATOM 0 HD3 ARG A 32 15.991 -11.902 3.372 1.00 0.00 H new ATOM 0 HE ARG A 32 14.418 -14.275 3.087 1.00 0.00 H new ATOM 0 HH11 ARG A 32 17.124 -12.539 1.582 1.00 0.00 H new ATOM 0 HH12 ARG A 32 17.842 -14.007 0.911 1.00 0.00 H new ATOM 0 HH21 ARG A 32 15.347 -16.142 2.206 1.00 0.00 H new ATOM 0 HH22 ARG A 32 16.839 -16.036 1.264 1.00 0.00 H new ATOM 496 N SER A 33 12.472 -11.124 1.215 1.00 0.00 N ATOM 497 CA SER A 33 12.477 -11.568 -0.151 1.00 0.00 C ATOM 498 C SER A 33 11.677 -10.586 -1.025 1.00 0.00 C ATOM 499 O SER A 33 12.096 -10.211 -2.137 1.00 0.00 O ATOM 500 CB SER A 33 11.870 -12.952 -0.199 1.00 0.00 C ATOM 501 OG SER A 33 12.566 -13.825 0.675 1.00 0.00 O ATOM 0 H SER A 33 12.038 -11.778 1.866 1.00 0.00 H new ATOM 0 HA SER A 33 13.495 -11.603 -0.538 1.00 0.00 H new ATOM 0 HB2 SER A 33 10.818 -12.905 0.084 1.00 0.00 H new ATOM 0 HB3 SER A 33 11.909 -13.339 -1.217 1.00 0.00 H new ATOM 0 HG SER A 33 12.209 -13.733 1.583 1.00 0.00 H new ATOM 507 N LEU A 34 10.564 -10.118 -0.481 1.00 0.00 N ATOM 508 CA LEU A 34 9.691 -9.183 -1.171 1.00 0.00 C ATOM 509 C LEU A 34 10.438 -7.911 -1.415 1.00 0.00 C ATOM 510 O LEU A 34 10.441 -7.395 -2.485 1.00 0.00 O ATOM 511 CB LEU A 34 8.482 -8.842 -0.324 1.00 0.00 C ATOM 512 CG LEU A 34 7.349 -8.150 -1.061 1.00 0.00 C ATOM 513 CD1 LEU A 34 6.543 -9.104 -1.914 1.00 0.00 C ATOM 514 CD2 LEU A 34 6.487 -7.366 -0.129 1.00 0.00 C ATOM 0 H LEU A 34 10.241 -10.376 0.451 1.00 0.00 H new ATOM 0 HA LEU A 34 9.367 -9.646 -2.103 1.00 0.00 H new ATOM 0 HB2 LEU A 34 8.098 -9.761 0.119 1.00 0.00 H new ATOM 0 HB3 LEU A 34 8.803 -8.202 0.498 1.00 0.00 H new ATOM 0 HG LEU A 34 7.809 -7.442 -1.750 1.00 0.00 H new ATOM 0 HD11 LEU A 34 5.746 -8.557 -2.418 1.00 0.00 H new ATOM 0 HD12 LEU A 34 7.193 -9.566 -2.657 1.00 0.00 H new ATOM 0 HD13 LEU A 34 6.108 -9.878 -1.282 1.00 0.00 H new ATOM 0 HD21 LEU A 34 5.687 -6.885 -0.691 1.00 0.00 H new ATOM 0 HD22 LEU A 34 6.055 -8.034 0.616 1.00 0.00 H new ATOM 0 HD23 LEU A 34 7.088 -6.606 0.370 1.00 0.00 H new ATOM 526 N MET A 35 11.129 -7.494 -0.407 1.00 0.00 N ATOM 527 CA MET A 35 11.887 -6.261 -0.345 1.00 0.00 C ATOM 528 C MET A 35 12.938 -6.204 -1.436 1.00 0.00 C ATOM 529 O MET A 35 13.333 -5.135 -1.883 1.00 0.00 O ATOM 530 CB MET A 35 12.508 -6.200 1.024 1.00 0.00 C ATOM 531 CG MET A 35 13.069 -4.879 1.446 1.00 0.00 C ATOM 532 SD MET A 35 13.562 -4.924 3.175 1.00 0.00 S ATOM 533 CE MET A 35 12.012 -5.433 3.956 1.00 0.00 C ATOM 0 H MET A 35 11.192 -8.031 0.458 1.00 0.00 H new ATOM 0 HA MET A 35 11.238 -5.401 -0.509 1.00 0.00 H new ATOM 0 HB2 MET A 35 11.755 -6.499 1.753 1.00 0.00 H new ATOM 0 HB3 MET A 35 13.307 -6.940 1.069 1.00 0.00 H new ATOM 0 HG2 MET A 35 13.928 -4.627 0.824 1.00 0.00 H new ATOM 0 HG3 MET A 35 12.325 -4.097 1.295 1.00 0.00 H new ATOM 0 HE1 MET A 35 12.069 -5.252 5.029 1.00 0.00 H new ATOM 0 HE2 MET A 35 11.187 -4.859 3.535 1.00 0.00 H new ATOM 0 HE3 MET A 35 11.845 -6.495 3.775 1.00 0.00 H new ATOM 543 N HIS A 36 13.421 -7.354 -1.830 1.00 0.00 N ATOM 544 CA HIS A 36 14.362 -7.414 -2.930 1.00 0.00 C ATOM 545 C HIS A 36 13.664 -7.586 -4.274 1.00 0.00 C ATOM 546 O HIS A 36 14.250 -7.321 -5.317 1.00 0.00 O ATOM 547 CB HIS A 36 15.412 -8.492 -2.716 1.00 0.00 C ATOM 548 CG HIS A 36 16.413 -8.141 -1.659 1.00 0.00 C ATOM 549 ND1 HIS A 36 17.770 -8.214 -1.850 1.00 0.00 N ATOM 550 CD2 HIS A 36 16.242 -7.713 -0.385 1.00 0.00 C ATOM 551 CE1 HIS A 36 18.387 -7.849 -0.748 1.00 0.00 C ATOM 552 NE2 HIS A 36 17.483 -7.537 0.156 1.00 0.00 N ATOM 0 H HIS A 36 13.185 -8.255 -1.414 1.00 0.00 H new ATOM 0 HA HIS A 36 14.875 -6.453 -2.952 1.00 0.00 H new ATOM 0 HB2 HIS A 36 14.916 -9.423 -2.442 1.00 0.00 H new ATOM 0 HB3 HIS A 36 15.934 -8.673 -3.656 1.00 0.00 H new ATOM 0 HD2 HIS A 36 15.298 -7.542 0.111 1.00 0.00 H new ATOM 0 HE1 HIS A 36 19.457 -7.811 -0.608 1.00 0.00 H new ATOM 0 HE2 HIS A 36 17.677 -7.216 1.105 1.00 0.00 H new ATOM 561 N HIS A 37 12.411 -8.013 -4.258 1.00 0.00 N ATOM 562 CA HIS A 37 11.672 -8.204 -5.509 1.00 0.00 C ATOM 563 C HIS A 37 10.719 -7.053 -5.827 1.00 0.00 C ATOM 564 O HIS A 37 10.190 -6.978 -6.926 1.00 0.00 O ATOM 565 CB HIS A 37 10.908 -9.537 -5.542 1.00 0.00 C ATOM 566 CG HIS A 37 11.764 -10.753 -5.743 1.00 0.00 C ATOM 567 ND1 HIS A 37 12.559 -11.427 -4.888 1.00 0.00 N flip ATOM 568 CD2 HIS A 37 11.847 -11.427 -6.944 1.00 0.00 C flip ATOM 569 CE1 HIS A 37 13.105 -12.472 -5.574 1.00 0.00 C flip ATOM 570 NE2 HIS A 37 12.664 -12.455 -6.811 1.00 0.00 N flip ATOM 0 H HIS A 37 11.886 -8.232 -3.411 1.00 0.00 H new ATOM 0 HA HIS A 37 12.438 -8.224 -6.284 1.00 0.00 H new ATOM 0 HB2 HIS A 37 10.360 -9.648 -4.606 1.00 0.00 H new ATOM 0 HB3 HIS A 37 10.169 -9.495 -6.342 1.00 0.00 H new ATOM 0 HD1 HIS A 37 12.722 -11.198 -3.908 1.00 0.00 H new ATOM 0 HD2 HIS A 37 11.326 -11.156 -7.850 1.00 0.00 H new ATOM 0 HE1 HIS A 37 13.791 -13.198 -5.165 1.00 0.00 H new ATOM 579 N VAL A 38 10.499 -6.174 -4.893 1.00 0.00 N ATOM 580 CA VAL A 38 9.587 -5.069 -5.108 1.00 0.00 C ATOM 581 C VAL A 38 10.194 -3.786 -4.551 1.00 0.00 C ATOM 582 O VAL A 38 11.002 -3.836 -3.637 1.00 0.00 O ATOM 583 CB VAL A 38 8.179 -5.350 -4.475 1.00 0.00 C ATOM 584 CG1 VAL A 38 8.206 -5.407 -2.977 1.00 0.00 C ATOM 585 CG2 VAL A 38 7.166 -4.367 -4.938 1.00 0.00 C ATOM 0 H VAL A 38 10.935 -6.194 -3.971 1.00 0.00 H new ATOM 0 HA VAL A 38 9.435 -4.952 -6.181 1.00 0.00 H new ATOM 0 HB VAL A 38 7.891 -6.341 -4.826 1.00 0.00 H new ATOM 0 HG11 VAL A 38 7.202 -5.604 -2.602 1.00 0.00 H new ATOM 0 HG12 VAL A 38 8.876 -6.204 -2.655 1.00 0.00 H new ATOM 0 HG13 VAL A 38 8.560 -4.454 -2.583 1.00 0.00 H new ATOM 0 HG21 VAL A 38 6.203 -4.593 -4.479 1.00 0.00 H new ATOM 0 HG22 VAL A 38 7.477 -3.362 -4.653 1.00 0.00 H new ATOM 0 HG23 VAL A 38 7.073 -4.424 -6.023 1.00 0.00 H new ATOM 595 N LYS A 39 9.820 -2.651 -5.121 1.00 0.00 N ATOM 596 CA LYS A 39 10.356 -1.369 -4.710 1.00 0.00 C ATOM 597 C LYS A 39 9.704 -0.899 -3.422 1.00 0.00 C ATOM 598 O LYS A 39 10.356 -0.735 -2.408 1.00 0.00 O ATOM 599 CB LYS A 39 10.138 -0.349 -5.820 1.00 0.00 C ATOM 600 CG LYS A 39 10.710 1.018 -5.526 1.00 0.00 C ATOM 601 CD LYS A 39 10.637 1.926 -6.735 1.00 0.00 C ATOM 602 CE LYS A 39 9.216 2.325 -7.097 1.00 0.00 C ATOM 603 NZ LYS A 39 9.202 3.184 -8.306 1.00 0.00 N ATOM 0 H LYS A 39 9.139 -2.596 -5.878 1.00 0.00 H new ATOM 0 HA LYS A 39 11.425 -1.476 -4.524 1.00 0.00 H new ATOM 0 HB2 LYS A 39 10.585 -0.728 -6.739 1.00 0.00 H new ATOM 0 HB3 LYS A 39 9.068 -0.251 -6.003 1.00 0.00 H new ATOM 0 HG2 LYS A 39 10.165 1.470 -4.697 1.00 0.00 H new ATOM 0 HG3 LYS A 39 11.748 0.918 -5.208 1.00 0.00 H new ATOM 0 HD2 LYS A 39 11.222 2.825 -6.542 1.00 0.00 H new ATOM 0 HD3 LYS A 39 11.095 1.424 -7.587 1.00 0.00 H new ATOM 0 HE2 LYS A 39 8.616 1.432 -7.273 1.00 0.00 H new ATOM 0 HE3 LYS A 39 8.759 2.857 -6.262 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 8.222 3.445 -8.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 9.756 4.045 -8.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 9.618 2.665 -9.105 1.00 0.00 H new ATOM 617 N ASN A 40 8.423 -0.671 -3.494 1.00 0.00 N ATOM 618 CA ASN A 40 7.619 -0.260 -2.392 1.00 0.00 C ATOM 619 C ASN A 40 6.161 -0.522 -2.810 1.00 0.00 C ATOM 620 O ASN A 40 5.944 -1.203 -3.835 1.00 0.00 O ATOM 621 CB ASN A 40 7.903 1.242 -2.040 1.00 0.00 C ATOM 622 CG ASN A 40 7.176 1.727 -0.778 1.00 0.00 C ATOM 623 OD1 ASN A 40 6.100 2.248 -0.851 1.00 0.00 O ATOM 624 ND2 ASN A 40 7.741 1.509 0.365 1.00 0.00 N ATOM 0 H ASN A 40 7.895 -0.772 -4.361 1.00 0.00 H new ATOM 0 HA ASN A 40 7.843 -0.814 -1.480 1.00 0.00 H new ATOM 0 HB2 ASN A 40 8.976 1.378 -1.906 1.00 0.00 H new ATOM 0 HB3 ASN A 40 7.606 1.866 -2.883 1.00 0.00 H new ATOM 0 HD21 ASN A 40 7.270 1.782 1.227 1.00 0.00 H new ATOM 0 HD22 ASN A 40 8.658 1.064 0.404 1.00 0.00 H new ATOM 631 N ILE A 41 5.220 0.036 -2.076 1.00 0.00 N ATOM 632 CA ILE A 41 3.775 -0.109 -2.218 1.00 0.00 C ATOM 633 C ILE A 41 3.317 -0.112 -3.683 1.00 0.00 C ATOM 634 O ILE A 41 2.581 -1.002 -4.092 1.00 0.00 O ATOM 635 CB ILE A 41 3.111 1.095 -1.534 1.00 0.00 C ATOM 636 CG1 ILE A 41 3.411 1.119 -0.033 1.00 0.00 C ATOM 637 CG2 ILE A 41 1.594 1.134 -1.785 1.00 0.00 C ATOM 638 CD1 ILE A 41 2.900 2.361 0.660 1.00 0.00 C ATOM 0 H ILE A 41 5.460 0.654 -1.300 1.00 0.00 H new ATOM 0 HA ILE A 41 3.494 -1.063 -1.772 1.00 0.00 H new ATOM 0 HB ILE A 41 3.542 1.990 -1.982 1.00 0.00 H new ATOM 0 HG12 ILE A 41 2.964 0.241 0.434 1.00 0.00 H new ATOM 0 HG13 ILE A 41 4.488 1.046 0.116 1.00 0.00 H new ATOM 0 HG21 ILE A 41 1.164 2.001 -1.283 1.00 0.00 H new ATOM 0 HG22 ILE A 41 1.404 1.203 -2.856 1.00 0.00 H new ATOM 0 HG23 ILE A 41 1.137 0.225 -1.394 1.00 0.00 H new ATOM 0 HD11 ILE A 41 3.146 2.313 1.721 1.00 0.00 H new ATOM 0 HD12 ILE A 41 3.366 3.242 0.219 1.00 0.00 H new ATOM 0 HD13 ILE A 41 1.818 2.425 0.541 1.00 0.00 H new ATOM 650 N ALA A 42 3.764 0.890 -4.460 1.00 0.00 N ATOM 651 CA ALA A 42 3.341 1.029 -5.866 1.00 0.00 C ATOM 652 C ALA A 42 3.565 -0.234 -6.684 1.00 0.00 C ATOM 653 O ALA A 42 2.622 -0.765 -7.272 1.00 0.00 O ATOM 654 CB ALA A 42 4.025 2.198 -6.523 1.00 0.00 C ATOM 0 H ALA A 42 4.413 1.610 -4.142 1.00 0.00 H new ATOM 0 HA ALA A 42 2.266 1.208 -5.841 1.00 0.00 H new ATOM 0 HB1 ALA A 42 3.695 2.277 -7.559 1.00 0.00 H new ATOM 0 HB2 ALA A 42 3.771 3.114 -5.990 1.00 0.00 H new ATOM 0 HB3 ALA A 42 5.105 2.050 -6.496 1.00 0.00 H new ATOM 660 N GLU A 43 4.788 -0.746 -6.661 1.00 0.00 N ATOM 661 CA GLU A 43 5.131 -1.930 -7.426 1.00 0.00 C ATOM 662 C GLU A 43 4.478 -3.136 -6.820 1.00 0.00 C ATOM 663 O GLU A 43 4.121 -4.040 -7.517 1.00 0.00 O ATOM 664 CB GLU A 43 6.635 -2.150 -7.465 1.00 0.00 C ATOM 665 CG GLU A 43 7.463 -1.008 -8.021 1.00 0.00 C ATOM 666 CD GLU A 43 7.046 -0.583 -9.395 1.00 0.00 C ATOM 667 OE1 GLU A 43 6.199 0.318 -9.508 1.00 0.00 O ATOM 668 OE2 GLU A 43 7.598 -1.102 -10.376 1.00 0.00 O ATOM 0 H GLU A 43 5.559 -0.356 -6.118 1.00 0.00 H new ATOM 0 HA GLU A 43 4.774 -1.780 -8.445 1.00 0.00 H new ATOM 0 HB2 GLU A 43 6.977 -2.360 -6.452 1.00 0.00 H new ATOM 0 HB3 GLU A 43 6.836 -3.041 -8.060 1.00 0.00 H new ATOM 0 HG2 GLU A 43 7.390 -0.154 -7.347 1.00 0.00 H new ATOM 0 HG3 GLU A 43 8.511 -1.307 -8.044 1.00 0.00 H new ATOM 675 N LEU A 44 4.322 -3.122 -5.508 1.00 0.00 N ATOM 676 CA LEU A 44 3.700 -4.220 -4.784 1.00 0.00 C ATOM 677 C LEU A 44 2.268 -4.392 -5.227 1.00 0.00 C ATOM 678 O LEU A 44 1.816 -5.492 -5.499 1.00 0.00 O ATOM 679 CB LEU A 44 3.777 -3.961 -3.276 1.00 0.00 C ATOM 680 CG LEU A 44 3.085 -4.976 -2.377 1.00 0.00 C ATOM 681 CD1 LEU A 44 3.624 -6.375 -2.636 1.00 0.00 C ATOM 682 CD2 LEU A 44 3.286 -4.599 -0.931 1.00 0.00 C ATOM 0 H LEU A 44 4.622 -2.350 -4.913 1.00 0.00 H new ATOM 0 HA LEU A 44 4.237 -5.143 -5.004 1.00 0.00 H new ATOM 0 HB2 LEU A 44 4.828 -3.913 -2.991 1.00 0.00 H new ATOM 0 HB3 LEU A 44 3.348 -2.979 -3.076 1.00 0.00 H new ATOM 0 HG LEU A 44 2.018 -4.973 -2.601 1.00 0.00 H new ATOM 0 HD11 LEU A 44 3.117 -7.087 -1.984 1.00 0.00 H new ATOM 0 HD12 LEU A 44 3.447 -6.646 -3.677 1.00 0.00 H new ATOM 0 HD13 LEU A 44 4.695 -6.396 -2.433 1.00 0.00 H new ATOM 0 HD21 LEU A 44 2.789 -5.329 -0.292 1.00 0.00 H new ATOM 0 HD22 LEU A 44 4.352 -4.584 -0.704 1.00 0.00 H new ATOM 0 HD23 LEU A 44 2.863 -3.611 -0.750 1.00 0.00 H new ATOM 694 N ALA A 45 1.593 -3.291 -5.355 1.00 0.00 N ATOM 695 CA ALA A 45 0.233 -3.291 -5.768 1.00 0.00 C ATOM 696 C ALA A 45 0.112 -3.452 -7.276 1.00 0.00 C ATOM 697 O ALA A 45 -0.981 -3.685 -7.808 1.00 0.00 O ATOM 698 CB ALA A 45 -0.439 -2.044 -5.283 1.00 0.00 C ATOM 0 H ALA A 45 1.977 -2.364 -5.173 1.00 0.00 H new ATOM 0 HA ALA A 45 -0.272 -4.148 -5.324 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -1.482 -2.046 -5.601 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -0.391 -2.005 -4.195 1.00 0.00 H new ATOM 0 HB3 ALA A 45 0.066 -1.173 -5.700 1.00 0.00 H new ATOM 704 N ALA A 46 1.234 -3.294 -7.951 1.00 0.00 N ATOM 705 CA ALA A 46 1.315 -3.488 -9.380 1.00 0.00 C ATOM 706 C ALA A 46 1.755 -4.920 -9.705 1.00 0.00 C ATOM 707 O ALA A 46 1.766 -5.334 -10.874 1.00 0.00 O ATOM 708 CB ALA A 46 2.269 -2.475 -10.002 1.00 0.00 C ATOM 0 H ALA A 46 2.118 -3.026 -7.518 1.00 0.00 H new ATOM 0 HA ALA A 46 0.324 -3.332 -9.807 1.00 0.00 H new ATOM 0 HB1 ALA A 46 2.318 -2.635 -11.079 1.00 0.00 H new ATOM 0 HB2 ALA A 46 1.909 -1.466 -9.801 1.00 0.00 H new ATOM 0 HB3 ALA A 46 3.263 -2.599 -9.571 1.00 0.00 H new ATOM 714 N LEU A 47 2.176 -5.653 -8.690 1.00 0.00 N ATOM 715 CA LEU A 47 2.543 -7.038 -8.865 1.00 0.00 C ATOM 716 C LEU A 47 1.304 -7.925 -8.967 1.00 0.00 C ATOM 717 O LEU A 47 0.227 -7.568 -8.490 1.00 0.00 O ATOM 718 CB LEU A 47 3.434 -7.545 -7.721 1.00 0.00 C ATOM 719 CG LEU A 47 4.830 -6.944 -7.622 1.00 0.00 C ATOM 720 CD1 LEU A 47 5.536 -7.463 -6.383 1.00 0.00 C ATOM 721 CD2 LEU A 47 5.651 -7.271 -8.861 1.00 0.00 C ATOM 0 H LEU A 47 2.271 -5.307 -7.735 1.00 0.00 H new ATOM 0 HA LEU A 47 3.108 -7.095 -9.795 1.00 0.00 H new ATOM 0 HB2 LEU A 47 2.917 -7.360 -6.780 1.00 0.00 H new ATOM 0 HB3 LEU A 47 3.535 -8.626 -7.822 1.00 0.00 H new ATOM 0 HG LEU A 47 4.730 -5.861 -7.551 1.00 0.00 H new ATOM 0 HD11 LEU A 47 6.533 -7.027 -6.323 1.00 0.00 H new ATOM 0 HD12 LEU A 47 4.965 -7.187 -5.496 1.00 0.00 H new ATOM 0 HD13 LEU A 47 5.618 -8.548 -6.439 1.00 0.00 H new ATOM 0 HD21 LEU A 47 6.644 -6.831 -8.766 1.00 0.00 H new ATOM 0 HD22 LEU A 47 5.742 -8.352 -8.962 1.00 0.00 H new ATOM 0 HD23 LEU A 47 5.156 -6.864 -9.743 1.00 0.00 H new ATOM 733 N SER A 48 1.466 -9.066 -9.583 1.00 0.00 N ATOM 734 CA SER A 48 0.401 -10.026 -9.717 1.00 0.00 C ATOM 735 C SER A 48 0.511 -11.079 -8.594 1.00 0.00 C ATOM 736 O SER A 48 1.577 -11.224 -7.977 1.00 0.00 O ATOM 737 CB SER A 48 0.503 -10.673 -11.097 1.00 0.00 C ATOM 738 OG SER A 48 0.537 -9.671 -12.107 1.00 0.00 O ATOM 0 H SER A 48 2.346 -9.358 -10.009 1.00 0.00 H new ATOM 0 HA SER A 48 -0.570 -9.540 -9.625 1.00 0.00 H new ATOM 0 HB2 SER A 48 1.402 -11.287 -11.153 1.00 0.00 H new ATOM 0 HB3 SER A 48 -0.347 -11.336 -11.260 1.00 0.00 H new ATOM 0 HG SER A 48 0.604 -10.096 -12.987 1.00 0.00 H new ATOM 744 N GLN A 49 -0.563 -11.829 -8.353 1.00 0.00 N ATOM 745 CA GLN A 49 -0.599 -12.830 -7.288 1.00 0.00 C ATOM 746 C GLN A 49 0.371 -13.954 -7.616 1.00 0.00 C ATOM 747 O GLN A 49 0.965 -14.564 -6.719 1.00 0.00 O ATOM 748 CB GLN A 49 -2.047 -13.337 -7.081 1.00 0.00 C ATOM 749 CG GLN A 49 -2.264 -14.247 -5.871 1.00 0.00 C ATOM 750 CD GLN A 49 -2.290 -15.729 -6.202 1.00 0.00 C ATOM 751 OE1 GLN A 49 -1.677 -16.183 -7.162 1.00 0.00 O ATOM 752 NE2 GLN A 49 -2.986 -16.494 -5.403 1.00 0.00 N ATOM 0 H GLN A 49 -1.429 -11.761 -8.888 1.00 0.00 H new ATOM 0 HA GLN A 49 -0.282 -12.385 -6.345 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -2.705 -12.473 -6.985 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -2.356 -13.875 -7.977 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -1.472 -14.062 -5.145 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -3.205 -13.977 -5.392 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -3.485 -16.086 -4.613 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -3.030 -17.499 -5.570 1.00 0.00 H new ATOM 761 N ASP A 50 0.556 -14.184 -8.912 1.00 0.00 N ATOM 762 CA ASP A 50 1.532 -15.159 -9.423 1.00 0.00 C ATOM 763 C ASP A 50 2.905 -14.792 -8.913 1.00 0.00 C ATOM 764 O ASP A 50 3.626 -15.621 -8.361 1.00 0.00 O ATOM 765 CB ASP A 50 1.589 -15.139 -10.961 1.00 0.00 C ATOM 766 CG ASP A 50 0.300 -15.516 -11.635 1.00 0.00 C ATOM 767 OD1 ASP A 50 -0.547 -14.622 -11.861 1.00 0.00 O ATOM 768 OD2 ASP A 50 0.112 -16.686 -11.974 1.00 0.00 O ATOM 0 H ASP A 50 0.035 -13.702 -9.645 1.00 0.00 H new ATOM 0 HA ASP A 50 1.227 -16.149 -9.084 1.00 0.00 H new ATOM 0 HB2 ASP A 50 1.878 -14.140 -11.289 1.00 0.00 H new ATOM 0 HB3 ASP A 50 2.371 -15.822 -11.292 1.00 0.00 H new ATOM 773 N GLU A 51 3.221 -13.509 -9.036 1.00 0.00 N ATOM 774 CA GLU A 51 4.510 -12.980 -8.651 1.00 0.00 C ATOM 775 C GLU A 51 4.681 -13.089 -7.159 1.00 0.00 C ATOM 776 O GLU A 51 5.726 -13.504 -6.678 1.00 0.00 O ATOM 777 CB GLU A 51 4.645 -11.522 -9.090 1.00 0.00 C ATOM 778 CG GLU A 51 4.416 -11.302 -10.574 1.00 0.00 C ATOM 779 CD GLU A 51 5.337 -12.131 -11.431 1.00 0.00 C ATOM 780 OE1 GLU A 51 6.497 -11.753 -11.612 1.00 0.00 O ATOM 781 OE2 GLU A 51 4.911 -13.174 -11.946 1.00 0.00 O ATOM 0 H GLU A 51 2.582 -12.807 -9.409 1.00 0.00 H new ATOM 0 HA GLU A 51 5.289 -13.562 -9.145 1.00 0.00 H new ATOM 0 HB2 GLU A 51 3.933 -10.917 -8.529 1.00 0.00 H new ATOM 0 HB3 GLU A 51 5.641 -11.165 -8.829 1.00 0.00 H new ATOM 0 HG2 GLU A 51 3.382 -11.545 -10.818 1.00 0.00 H new ATOM 0 HG3 GLU A 51 4.560 -10.247 -10.808 1.00 0.00 H new ATOM 788 N LEU A 52 3.633 -12.752 -6.428 1.00 0.00 N ATOM 789 CA LEU A 52 3.659 -12.849 -4.981 1.00 0.00 C ATOM 790 C LEU A 52 3.869 -14.286 -4.538 1.00 0.00 C ATOM 791 O LEU A 52 4.641 -14.536 -3.644 1.00 0.00 O ATOM 792 CB LEU A 52 2.397 -12.268 -4.341 1.00 0.00 C ATOM 793 CG LEU A 52 2.117 -10.790 -4.590 1.00 0.00 C ATOM 794 CD1 LEU A 52 0.860 -10.357 -3.869 1.00 0.00 C ATOM 795 CD2 LEU A 52 3.302 -9.926 -4.181 1.00 0.00 C ATOM 0 H LEU A 52 2.753 -12.409 -6.814 1.00 0.00 H new ATOM 0 HA LEU A 52 4.503 -12.251 -4.637 1.00 0.00 H new ATOM 0 HB2 LEU A 52 1.541 -12.841 -4.698 1.00 0.00 H new ATOM 0 HB3 LEU A 52 2.459 -12.425 -3.264 1.00 0.00 H new ATOM 0 HG LEU A 52 1.963 -10.654 -5.660 1.00 0.00 H new ATOM 0 HD11 LEU A 52 0.677 -9.299 -4.059 1.00 0.00 H new ATOM 0 HD12 LEU A 52 0.014 -10.942 -4.230 1.00 0.00 H new ATOM 0 HD13 LEU A 52 0.981 -10.517 -2.798 1.00 0.00 H new ATOM 0 HD21 LEU A 52 3.071 -8.878 -4.371 1.00 0.00 H new ATOM 0 HD22 LEU A 52 3.505 -10.066 -3.119 1.00 0.00 H new ATOM 0 HD23 LEU A 52 4.180 -10.215 -4.759 1.00 0.00 H new ATOM 807 N THR A 53 3.218 -15.229 -5.201 1.00 0.00 N ATOM 808 CA THR A 53 3.374 -16.636 -4.856 1.00 0.00 C ATOM 809 C THR A 53 4.819 -17.060 -5.076 1.00 0.00 C ATOM 810 O THR A 53 5.358 -17.830 -4.323 1.00 0.00 O ATOM 811 CB THR A 53 2.462 -17.534 -5.703 1.00 0.00 C ATOM 812 OG1 THR A 53 1.113 -17.042 -5.644 1.00 0.00 O ATOM 813 CG2 THR A 53 2.476 -18.968 -5.185 1.00 0.00 C ATOM 0 H THR A 53 2.580 -15.049 -5.976 1.00 0.00 H new ATOM 0 HA THR A 53 3.095 -16.750 -3.808 1.00 0.00 H new ATOM 0 HB THR A 53 2.831 -17.520 -6.729 1.00 0.00 H new ATOM 0 HG1 THR A 53 1.041 -16.220 -6.173 1.00 0.00 H new ATOM 0 HG21 THR A 53 1.822 -19.584 -5.802 1.00 0.00 H new ATOM 0 HG22 THR A 53 3.492 -19.361 -5.229 1.00 0.00 H new ATOM 0 HG23 THR A 53 2.124 -18.986 -4.154 1.00 0.00 H new ATOM 821 N SER A 54 5.435 -16.504 -6.073 1.00 0.00 N ATOM 822 CA SER A 54 6.765 -16.804 -6.400 1.00 0.00 C ATOM 823 C SER A 54 7.764 -16.201 -5.395 1.00 0.00 C ATOM 824 O SER A 54 8.767 -16.828 -5.062 1.00 0.00 O ATOM 825 CB SER A 54 6.994 -16.341 -7.808 1.00 0.00 C ATOM 826 OG SER A 54 6.157 -17.082 -8.696 1.00 0.00 O ATOM 0 H SER A 54 5.003 -15.814 -6.687 1.00 0.00 H new ATOM 0 HA SER A 54 6.938 -17.878 -6.338 1.00 0.00 H new ATOM 0 HB2 SER A 54 6.778 -15.276 -7.891 1.00 0.00 H new ATOM 0 HB3 SER A 54 8.041 -16.476 -8.081 1.00 0.00 H new ATOM 0 HG SER A 54 5.254 -16.701 -8.689 1.00 0.00 H new ATOM 832 N ILE A 55 7.470 -15.012 -4.910 1.00 0.00 N ATOM 833 CA ILE A 55 8.310 -14.339 -3.929 1.00 0.00 C ATOM 834 C ILE A 55 8.133 -14.975 -2.553 1.00 0.00 C ATOM 835 O ILE A 55 9.102 -15.405 -1.911 1.00 0.00 O ATOM 836 CB ILE A 55 7.932 -12.830 -3.831 1.00 0.00 C ATOM 837 CG1 ILE A 55 8.192 -12.120 -5.166 1.00 0.00 C ATOM 838 CG2 ILE A 55 8.703 -12.138 -2.699 1.00 0.00 C ATOM 839 CD1 ILE A 55 7.566 -10.739 -5.270 1.00 0.00 C ATOM 0 H ILE A 55 6.643 -14.481 -5.182 1.00 0.00 H new ATOM 0 HA ILE A 55 9.347 -14.438 -4.251 1.00 0.00 H new ATOM 0 HB ILE A 55 6.868 -12.767 -3.604 1.00 0.00 H new ATOM 0 HG12 ILE A 55 9.268 -12.031 -5.313 1.00 0.00 H new ATOM 0 HG13 ILE A 55 7.810 -12.742 -5.976 1.00 0.00 H new ATOM 0 HG21 ILE A 55 8.419 -11.087 -2.655 1.00 0.00 H new ATOM 0 HG22 ILE A 55 8.465 -12.618 -1.750 1.00 0.00 H new ATOM 0 HG23 ILE A 55 9.774 -12.217 -2.887 1.00 0.00 H new ATOM 0 HD11 ILE A 55 7.797 -10.307 -6.244 1.00 0.00 H new ATOM 0 HD12 ILE A 55 6.485 -10.820 -5.157 1.00 0.00 H new ATOM 0 HD13 ILE A 55 7.966 -10.098 -4.484 1.00 0.00 H new ATOM 851 N LEU A 56 6.892 -15.058 -2.131 1.00 0.00 N ATOM 852 CA LEU A 56 6.551 -15.502 -0.797 1.00 0.00 C ATOM 853 C LEU A 56 6.675 -17.015 -0.699 1.00 0.00 C ATOM 854 O LEU A 56 7.095 -17.555 0.326 1.00 0.00 O ATOM 855 CB LEU A 56 5.118 -15.066 -0.431 1.00 0.00 C ATOM 856 CG LEU A 56 4.681 -13.639 -0.865 1.00 0.00 C ATOM 857 CD1 LEU A 56 3.332 -13.306 -0.317 1.00 0.00 C ATOM 858 CD2 LEU A 56 5.674 -12.572 -0.477 1.00 0.00 C ATOM 0 H LEU A 56 6.085 -14.818 -2.707 1.00 0.00 H new ATOM 0 HA LEU A 56 7.245 -15.043 -0.093 1.00 0.00 H new ATOM 0 HB2 LEU A 56 4.424 -15.781 -0.872 1.00 0.00 H new ATOM 0 HB3 LEU A 56 5.008 -15.139 0.651 1.00 0.00 H new ATOM 0 HG LEU A 56 4.637 -13.654 -1.954 1.00 0.00 H new ATOM 0 HD11 LEU A 56 3.048 -12.303 -0.634 1.00 0.00 H new ATOM 0 HD12 LEU A 56 2.601 -14.024 -0.688 1.00 0.00 H new ATOM 0 HD13 LEU A 56 3.361 -13.348 0.772 1.00 0.00 H new ATOM 0 HD21 LEU A 56 5.311 -11.599 -0.808 1.00 0.00 H new ATOM 0 HD22 LEU A 56 5.795 -12.565 0.606 1.00 0.00 H new ATOM 0 HD23 LEU A 56 6.635 -12.780 -0.948 1.00 0.00 H new ATOM 870 N GLY A 57 6.320 -17.676 -1.768 1.00 0.00 N ATOM 871 CA GLY A 57 6.404 -19.113 -1.846 1.00 0.00 C ATOM 872 C GLY A 57 5.146 -19.803 -1.384 1.00 0.00 C ATOM 873 O GLY A 57 5.113 -21.022 -1.275 1.00 0.00 O ATOM 0 H GLY A 57 5.963 -17.233 -2.614 1.00 0.00 H new ATOM 0 HA2 GLY A 57 6.614 -19.404 -2.875 1.00 0.00 H new ATOM 0 HA3 GLY A 57 7.243 -19.456 -1.240 1.00 0.00 H new ATOM 877 N ASN A 58 4.105 -19.035 -1.105 1.00 0.00 N ATOM 878 CA ASN A 58 2.842 -19.615 -0.672 1.00 0.00 C ATOM 879 C ASN A 58 1.742 -18.835 -1.311 1.00 0.00 C ATOM 880 O ASN A 58 1.731 -17.590 -1.224 1.00 0.00 O ATOM 881 CB ASN A 58 2.614 -19.523 0.859 1.00 0.00 C ATOM 882 CG ASN A 58 3.864 -19.408 1.687 1.00 0.00 C ATOM 883 OD1 ASN A 58 4.205 -18.196 2.004 1.00 0.00 O flip ATOM 884 ND2 ASN A 58 4.480 -20.392 2.079 1.00 0.00 N flip ATOM 0 H ASN A 58 4.108 -18.017 -1.169 1.00 0.00 H new ATOM 0 HA ASN A 58 2.860 -20.668 -0.953 1.00 0.00 H new ATOM 0 HB2 ASN A 58 1.981 -18.660 1.065 1.00 0.00 H new ATOM 0 HB3 ASN A 58 2.064 -20.407 1.182 1.00 0.00 H new ATOM 0 HD21 ASN A 58 4.176 -21.326 1.805 1.00 0.00 H new ATOM 0 HD22 ASN A 58 5.296 -20.277 2.679 1.00 0.00 H new ATOM 891 N ALA A 59 0.814 -19.526 -1.920 1.00 0.00 N ATOM 892 CA ALA A 59 -0.330 -18.897 -2.551 1.00 0.00 C ATOM 893 C ALA A 59 -1.249 -18.293 -1.501 1.00 0.00 C ATOM 894 O ALA A 59 -1.998 -17.374 -1.790 1.00 0.00 O ATOM 895 CB ALA A 59 -1.094 -19.891 -3.406 1.00 0.00 C ATOM 0 H ALA A 59 0.825 -20.543 -1.996 1.00 0.00 H new ATOM 0 HA ALA A 59 0.037 -18.101 -3.198 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -1.947 -19.394 -3.868 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -0.438 -20.282 -4.183 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -1.447 -20.712 -2.782 1.00 0.00 H new ATOM 901 N ALA A 60 -1.151 -18.800 -0.270 1.00 0.00 N ATOM 902 CA ALA A 60 -1.951 -18.309 0.845 1.00 0.00 C ATOM 903 C ALA A 60 -1.591 -16.869 1.116 1.00 0.00 C ATOM 904 O ALA A 60 -2.438 -15.989 1.130 1.00 0.00 O ATOM 905 CB ALA A 60 -1.679 -19.138 2.086 1.00 0.00 C ATOM 0 H ALA A 60 -0.516 -19.559 -0.023 1.00 0.00 H new ATOM 0 HA ALA A 60 -3.008 -18.387 0.591 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -2.282 -18.763 2.913 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -1.937 -20.179 1.892 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -0.623 -19.068 2.346 1.00 0.00 H new ATOM 911 N ASN A 61 -0.305 -16.647 1.259 1.00 0.00 N ATOM 912 CA ASN A 61 0.249 -15.335 1.534 1.00 0.00 C ATOM 913 C ASN A 61 -0.013 -14.405 0.367 1.00 0.00 C ATOM 914 O ASN A 61 -0.430 -13.266 0.542 1.00 0.00 O ATOM 915 CB ASN A 61 1.754 -15.439 1.741 1.00 0.00 C ATOM 916 CG ASN A 61 2.229 -16.019 3.062 1.00 0.00 C ATOM 917 OD1 ASN A 61 1.418 -16.770 3.743 1.00 0.00 O flip ATOM 918 ND2 ASN A 61 3.340 -15.753 3.471 1.00 0.00 N flip ATOM 0 H ASN A 61 0.399 -17.382 1.187 1.00 0.00 H new ATOM 0 HA ASN A 61 -0.225 -14.943 2.434 1.00 0.00 H new ATOM 0 HB2 ASN A 61 2.166 -16.048 0.936 1.00 0.00 H new ATOM 0 HB3 ASN A 61 2.180 -14.441 1.636 1.00 0.00 H new ATOM 0 HD21 ASN A 61 3.959 -15.161 2.917 1.00 0.00 H new ATOM 0 HD22 ASN A 61 3.655 -16.122 4.368 1.00 0.00 H new ATOM 925 N ALA A 62 0.192 -14.938 -0.828 1.00 0.00 N ATOM 926 CA ALA A 62 0.052 -14.194 -2.060 1.00 0.00 C ATOM 927 C ALA A 62 -1.371 -13.732 -2.254 1.00 0.00 C ATOM 928 O ALA A 62 -1.608 -12.582 -2.584 1.00 0.00 O ATOM 929 CB ALA A 62 0.483 -15.058 -3.223 1.00 0.00 C ATOM 0 H ALA A 62 0.463 -15.912 -0.966 1.00 0.00 H new ATOM 0 HA ALA A 62 0.688 -13.310 -2.008 1.00 0.00 H new ATOM 0 HB1 ALA A 62 0.377 -14.497 -4.152 1.00 0.00 H new ATOM 0 HB2 ALA A 62 1.525 -15.351 -3.092 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -0.142 -15.950 -3.265 1.00 0.00 H new ATOM 935 N LYS A 63 -2.317 -14.621 -2.011 1.00 0.00 N ATOM 936 CA LYS A 63 -3.695 -14.304 -2.193 1.00 0.00 C ATOM 937 C LYS A 63 -4.158 -13.323 -1.151 1.00 0.00 C ATOM 938 O LYS A 63 -4.844 -12.371 -1.480 1.00 0.00 O ATOM 939 CB LYS A 63 -4.560 -15.565 -2.204 1.00 0.00 C ATOM 940 CG LYS A 63 -6.051 -15.281 -2.270 1.00 0.00 C ATOM 941 CD LYS A 63 -6.855 -16.547 -2.393 1.00 0.00 C ATOM 942 CE LYS A 63 -8.344 -16.256 -2.349 1.00 0.00 C ATOM 943 NZ LYS A 63 -8.781 -15.329 -3.408 1.00 0.00 N ATOM 0 H LYS A 63 -2.140 -15.571 -1.685 1.00 0.00 H new ATOM 0 HA LYS A 63 -3.807 -13.830 -3.168 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -4.278 -16.181 -3.058 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -4.349 -16.148 -1.307 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -6.358 -14.741 -1.375 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -6.260 -14.633 -3.121 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -6.607 -17.049 -3.328 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -6.591 -17.229 -1.585 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -8.894 -17.192 -2.443 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -8.598 -15.834 -1.377 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -9.820 -15.286 -3.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -8.399 -14.381 -3.219 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -8.433 -15.665 -4.329 1.00 0.00 H new ATOM 957 N GLN A 64 -3.741 -13.529 0.096 1.00 0.00 N ATOM 958 CA GLN A 64 -4.129 -12.629 1.172 1.00 0.00 C ATOM 959 C GLN A 64 -3.691 -11.209 0.915 1.00 0.00 C ATOM 960 O GLN A 64 -4.471 -10.260 1.111 1.00 0.00 O ATOM 961 CB GLN A 64 -3.652 -13.108 2.539 1.00 0.00 C ATOM 962 CG GLN A 64 -4.368 -14.352 3.008 1.00 0.00 C ATOM 963 CD GLN A 64 -4.412 -14.447 4.511 1.00 0.00 C ATOM 964 OE1 GLN A 64 -5.339 -13.933 5.139 1.00 0.00 O ATOM 965 NE2 GLN A 64 -3.446 -15.095 5.100 1.00 0.00 N ATOM 0 H GLN A 64 -3.141 -14.303 0.382 1.00 0.00 H new ATOM 0 HA GLN A 64 -5.219 -12.640 1.189 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -2.581 -13.306 2.496 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -3.800 -12.312 3.269 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -5.385 -14.355 2.615 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -3.868 -15.232 2.604 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -2.696 -15.507 4.545 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -3.441 -15.190 6.116 1.00 0.00 H new ATOM 974 N LEU A 65 -2.488 -11.065 0.430 1.00 0.00 N ATOM 975 CA LEU A 65 -1.941 -9.771 0.150 1.00 0.00 C ATOM 976 C LEU A 65 -2.590 -9.159 -1.090 1.00 0.00 C ATOM 977 O LEU A 65 -3.098 -8.041 -1.043 1.00 0.00 O ATOM 978 CB LEU A 65 -0.421 -9.873 -0.001 1.00 0.00 C ATOM 979 CG LEU A 65 0.325 -8.571 -0.268 1.00 0.00 C ATOM 980 CD1 LEU A 65 -0.015 -7.542 0.790 1.00 0.00 C ATOM 981 CD2 LEU A 65 1.820 -8.827 -0.288 1.00 0.00 C ATOM 0 H LEU A 65 -1.862 -11.842 0.219 1.00 0.00 H new ATOM 0 HA LEU A 65 -2.159 -9.106 0.986 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -0.017 -10.317 0.909 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -0.205 -10.563 -0.816 1.00 0.00 H new ATOM 0 HG LEU A 65 0.018 -8.183 -1.239 1.00 0.00 H new ATOM 0 HD11 LEU A 65 0.525 -6.618 0.586 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -1.087 -7.346 0.776 1.00 0.00 H new ATOM 0 HD13 LEU A 65 0.272 -7.921 1.771 1.00 0.00 H new ATOM 0 HD21 LEU A 65 2.347 -7.892 -0.479 1.00 0.00 H new ATOM 0 HD22 LEU A 65 2.133 -9.229 0.675 1.00 0.00 H new ATOM 0 HD23 LEU A 65 2.056 -9.544 -1.074 1.00 0.00 H new ATOM 993 N TYR A 66 -2.627 -9.926 -2.168 1.00 0.00 N ATOM 994 CA TYR A 66 -3.152 -9.468 -3.453 1.00 0.00 C ATOM 995 C TYR A 66 -4.619 -9.050 -3.330 1.00 0.00 C ATOM 996 O TYR A 66 -5.054 -8.035 -3.928 1.00 0.00 O ATOM 997 CB TYR A 66 -2.995 -10.585 -4.475 1.00 0.00 C ATOM 998 CG TYR A 66 -3.234 -10.206 -5.910 1.00 0.00 C ATOM 999 CD1 TYR A 66 -2.334 -9.407 -6.590 1.00 0.00 C ATOM 1000 CD2 TYR A 66 -4.330 -10.690 -6.599 1.00 0.00 C ATOM 1001 CE1 TYR A 66 -2.522 -9.102 -7.917 1.00 0.00 C ATOM 1002 CE2 TYR A 66 -4.529 -10.385 -7.929 1.00 0.00 C ATOM 1003 CZ TYR A 66 -3.620 -9.592 -8.581 1.00 0.00 C ATOM 1004 OH TYR A 66 -3.801 -9.294 -9.906 1.00 0.00 O ATOM 0 H TYR A 66 -2.293 -10.890 -2.180 1.00 0.00 H new ATOM 0 HA TYR A 66 -2.591 -8.592 -3.779 1.00 0.00 H new ATOM 0 HB2 TYR A 66 -1.986 -10.989 -4.390 1.00 0.00 H new ATOM 0 HB3 TYR A 66 -3.683 -11.389 -4.213 1.00 0.00 H new ATOM 0 HD1 TYR A 66 -1.471 -9.017 -6.071 1.00 0.00 H new ATOM 0 HD2 TYR A 66 -5.043 -11.318 -6.087 1.00 0.00 H new ATOM 0 HE1 TYR A 66 -1.809 -8.479 -8.436 1.00 0.00 H new ATOM 0 HE2 TYR A 66 -5.393 -10.767 -8.452 1.00 0.00 H new ATOM 0 HH TYR A 66 -4.624 -9.718 -10.227 1.00 0.00 H new ATOM 1014 N ASP A 67 -5.362 -9.812 -2.551 1.00 0.00 N ATOM 1015 CA ASP A 67 -6.765 -9.535 -2.288 1.00 0.00 C ATOM 1016 C ASP A 67 -6.916 -8.244 -1.516 1.00 0.00 C ATOM 1017 O ASP A 67 -7.715 -7.402 -1.882 1.00 0.00 O ATOM 1018 CB ASP A 67 -7.416 -10.685 -1.518 1.00 0.00 C ATOM 1019 CG ASP A 67 -8.849 -10.406 -1.130 1.00 0.00 C ATOM 1020 OD1 ASP A 67 -9.762 -10.711 -1.920 1.00 0.00 O ATOM 1021 OD2 ASP A 67 -9.080 -9.910 -0.011 1.00 0.00 O ATOM 0 H ASP A 67 -5.010 -10.645 -2.079 1.00 0.00 H new ATOM 0 HA ASP A 67 -7.271 -9.433 -3.248 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -7.381 -11.588 -2.128 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -6.835 -10.886 -0.618 1.00 0.00 H new ATOM 1026 N PHE A 68 -6.086 -8.063 -0.491 1.00 0.00 N ATOM 1027 CA PHE A 68 -6.133 -6.873 0.356 1.00 0.00 C ATOM 1028 C PHE A 68 -5.800 -5.619 -0.464 1.00 0.00 C ATOM 1029 O PHE A 68 -6.328 -4.549 -0.229 1.00 0.00 O ATOM 1030 CB PHE A 68 -5.153 -7.046 1.522 1.00 0.00 C ATOM 1031 CG PHE A 68 -5.152 -5.930 2.527 1.00 0.00 C ATOM 1032 CD1 PHE A 68 -6.262 -5.698 3.323 1.00 0.00 C ATOM 1033 CD2 PHE A 68 -4.046 -5.116 2.676 1.00 0.00 C ATOM 1034 CE1 PHE A 68 -6.262 -4.680 4.250 1.00 0.00 C ATOM 1035 CE2 PHE A 68 -4.042 -4.096 3.602 1.00 0.00 C ATOM 1036 CZ PHE A 68 -5.152 -3.875 4.387 1.00 0.00 C ATOM 0 H PHE A 68 -5.365 -8.734 -0.225 1.00 0.00 H new ATOM 0 HA PHE A 68 -7.139 -6.748 0.756 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -5.387 -7.977 2.037 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -4.146 -7.150 1.117 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -7.137 -6.322 3.215 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -3.175 -5.281 2.060 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -7.131 -4.513 4.869 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -3.169 -3.470 3.712 1.00 0.00 H new ATOM 0 HZ PHE A 68 -5.152 -3.072 5.109 1.00 0.00 H new ATOM 1046 N ILE A 69 -4.931 -5.796 -1.432 1.00 0.00 N ATOM 1047 CA ILE A 69 -4.535 -4.751 -2.363 1.00 0.00 C ATOM 1048 C ILE A 69 -5.705 -4.343 -3.290 1.00 0.00 C ATOM 1049 O ILE A 69 -5.839 -3.163 -3.689 1.00 0.00 O ATOM 1050 CB ILE A 69 -3.332 -5.259 -3.211 1.00 0.00 C ATOM 1051 CG1 ILE A 69 -2.081 -5.399 -2.339 1.00 0.00 C ATOM 1052 CG2 ILE A 69 -3.063 -4.381 -4.421 1.00 0.00 C ATOM 1053 CD1 ILE A 69 -0.929 -6.077 -3.039 1.00 0.00 C ATOM 0 H ILE A 69 -4.466 -6.688 -1.602 1.00 0.00 H new ATOM 0 HA ILE A 69 -4.246 -3.868 -1.794 1.00 0.00 H new ATOM 0 HB ILE A 69 -3.600 -6.243 -3.595 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -1.764 -4.409 -2.011 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -2.335 -5.965 -1.443 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -2.215 -4.779 -4.978 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -3.944 -4.366 -5.063 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -2.837 -3.367 -4.092 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -0.078 -6.141 -2.361 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -1.227 -7.080 -3.343 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -0.648 -5.500 -3.920 1.00 0.00 H new ATOM 1065 N HIS A 70 -6.526 -5.317 -3.635 1.00 0.00 N ATOM 1066 CA HIS A 70 -7.641 -5.105 -4.573 1.00 0.00 C ATOM 1067 C HIS A 70 -8.984 -4.783 -3.923 1.00 0.00 C ATOM 1068 O HIS A 70 -9.708 -3.936 -4.423 1.00 0.00 O ATOM 1069 CB HIS A 70 -7.770 -6.271 -5.548 1.00 0.00 C ATOM 1070 CG HIS A 70 -6.696 -6.273 -6.577 1.00 0.00 C ATOM 1071 ND1 HIS A 70 -5.459 -6.823 -6.374 1.00 0.00 N ATOM 1072 CD2 HIS A 70 -6.653 -5.715 -7.803 1.00 0.00 C ATOM 1073 CE1 HIS A 70 -4.702 -6.593 -7.427 1.00 0.00 C ATOM 1074 NE2 HIS A 70 -5.407 -5.925 -8.302 1.00 0.00 N ATOM 0 H HIS A 70 -6.451 -6.272 -3.284 1.00 0.00 H new ATOM 0 HA HIS A 70 -7.373 -4.202 -5.122 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -7.740 -7.209 -4.994 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -8.741 -6.223 -6.041 1.00 0.00 H new ATOM 0 HD1 HIS A 70 -5.169 -7.331 -5.538 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -7.461 -5.196 -8.298 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -3.675 -6.903 -7.547 1.00 0.00 H new ATOM 1083 N THR A 71 -9.304 -5.463 -2.853 1.00 0.00 N ATOM 1084 CA THR A 71 -10.539 -5.288 -2.121 1.00 0.00 C ATOM 1085 C THR A 71 -10.732 -3.862 -1.645 1.00 0.00 C ATOM 1086 O THR A 71 -9.982 -3.369 -0.833 1.00 0.00 O ATOM 1087 CB THR A 71 -10.604 -6.300 -0.944 1.00 0.00 C ATOM 1088 OG1 THR A 71 -10.804 -7.625 -1.482 1.00 0.00 O ATOM 1089 CG2 THR A 71 -11.702 -5.962 0.072 1.00 0.00 C ATOM 0 H THR A 71 -8.696 -6.177 -2.452 1.00 0.00 H new ATOM 0 HA THR A 71 -11.365 -5.491 -2.803 1.00 0.00 H new ATOM 0 HB THR A 71 -9.660 -6.247 -0.401 1.00 0.00 H new ATOM 0 HG1 THR A 71 -9.947 -7.984 -1.794 1.00 0.00 H new ATOM 0 HG21 THR A 71 -11.699 -6.704 0.871 1.00 0.00 H new ATOM 0 HG22 THR A 71 -11.516 -4.974 0.493 1.00 0.00 H new ATOM 0 HG23 THR A 71 -12.672 -5.968 -0.425 1.00 0.00 H new ATOM 1097 N SER A 72 -11.732 -3.222 -2.190 1.00 0.00 N ATOM 1098 CA SER A 72 -12.071 -1.851 -1.850 1.00 0.00 C ATOM 1099 C SER A 72 -12.413 -1.749 -0.343 1.00 0.00 C ATOM 1100 O SER A 72 -12.994 -2.695 0.237 1.00 0.00 O ATOM 1101 CB SER A 72 -13.311 -1.425 -2.643 1.00 0.00 C ATOM 1102 OG SER A 72 -13.228 -1.813 -4.013 1.00 0.00 O ATOM 0 H SER A 72 -12.346 -3.636 -2.892 1.00 0.00 H new ATOM 0 HA SER A 72 -11.221 -1.211 -2.086 1.00 0.00 H new ATOM 0 HB2 SER A 72 -14.199 -1.869 -2.194 1.00 0.00 H new ATOM 0 HB3 SER A 72 -13.428 -0.343 -2.579 1.00 0.00 H new ATOM 0 HG SER A 72 -14.038 -1.525 -4.484 1.00 0.00 H new ATOM 1108 N PHE A 73 -12.095 -0.599 0.275 1.00 0.00 N ATOM 1109 CA PHE A 73 -12.415 -0.333 1.707 1.00 0.00 C ATOM 1110 C PHE A 73 -13.927 -0.486 1.917 1.00 0.00 C ATOM 1111 O PHE A 73 -14.390 -0.878 2.985 1.00 0.00 O ATOM 1112 CB PHE A 73 -12.061 1.117 2.093 1.00 0.00 C ATOM 1113 CG PHE A 73 -10.982 1.760 1.276 1.00 0.00 C ATOM 1114 CD1 PHE A 73 -9.630 1.631 1.579 1.00 0.00 C ATOM 1115 CD2 PHE A 73 -11.340 2.525 0.180 1.00 0.00 C ATOM 1116 CE1 PHE A 73 -8.698 2.257 0.783 1.00 0.00 C ATOM 1117 CE2 PHE A 73 -10.402 3.142 -0.591 1.00 0.00 C ATOM 1118 CZ PHE A 73 -9.079 3.002 -0.288 1.00 0.00 C ATOM 0 H PHE A 73 -11.614 0.171 -0.189 1.00 0.00 H new ATOM 0 HA PHE A 73 -11.842 -1.034 2.314 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -12.962 1.725 2.015 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -11.757 1.131 3.140 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -9.315 1.046 2.430 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -12.385 2.635 -0.069 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -7.648 2.155 1.013 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -10.704 3.739 -1.438 1.00 0.00 H new ATOM 0 HZ PHE A 73 -8.332 3.485 -0.901 1.00 0.00 H new ATOM 1516 N GLY B 115 -9.806 -3.069 8.515 1.00 0.00 N ATOM 1517 CA GLY B 115 -8.650 -3.649 7.818 1.00 0.00 C ATOM 1518 C GLY B 115 -8.027 -2.716 6.777 1.00 0.00 C ATOM 1519 O GLY B 115 -6.918 -2.205 6.989 1.00 0.00 O ATOM 0 HA2 GLY B 115 -7.891 -3.917 8.553 1.00 0.00 H new ATOM 0 HA3 GLY B 115 -8.959 -4.572 7.327 1.00 0.00 H new ATOM 1523 N PRO B 116 -8.715 -2.462 5.653 1.00 0.00 N ATOM 1524 CA PRO B 116 -8.221 -1.556 4.626 1.00 0.00 C ATOM 1525 C PRO B 116 -8.260 -0.078 5.092 1.00 0.00 C ATOM 1526 O PRO B 116 -7.291 0.657 4.907 1.00 0.00 O ATOM 1527 CB PRO B 116 -9.181 -1.806 3.446 1.00 0.00 C ATOM 1528 CG PRO B 116 -10.431 -2.276 4.085 1.00 0.00 C ATOM 1529 CD PRO B 116 -10.003 -3.072 5.277 1.00 0.00 C ATOM 0 HA PRO B 116 -7.176 -1.735 4.371 1.00 0.00 H new ATOM 0 HB2 PRO B 116 -9.347 -0.897 2.869 1.00 0.00 H new ATOM 0 HB3 PRO B 116 -8.781 -2.551 2.759 1.00 0.00 H new ATOM 0 HG2 PRO B 116 -11.059 -1.436 4.381 1.00 0.00 H new ATOM 0 HG3 PRO B 116 -11.017 -2.886 3.397 1.00 0.00 H new ATOM 0 HD2 PRO B 116 -10.730 -3.006 6.086 1.00 0.00 H new ATOM 0 HD3 PRO B 116 -9.891 -4.129 5.035 1.00 0.00 H new ATOM 1537 N GLN B 117 -9.351 0.320 5.763 1.00 0.00 N ATOM 1538 CA GLN B 117 -9.557 1.710 6.214 1.00 0.00 C ATOM 1539 C GLN B 117 -8.411 2.211 7.112 1.00 0.00 C ATOM 1540 O GLN B 117 -7.872 3.312 6.920 1.00 0.00 O ATOM 1541 CB GLN B 117 -10.906 1.843 6.918 1.00 0.00 C ATOM 1542 CG GLN B 117 -11.099 3.191 7.619 1.00 0.00 C ATOM 1543 CD GLN B 117 -12.411 3.309 8.348 1.00 0.00 C ATOM 1544 OE1 GLN B 117 -12.515 2.950 9.520 1.00 0.00 O ATOM 1545 NE2 GLN B 117 -13.401 3.841 7.696 1.00 0.00 N ATOM 0 H GLN B 117 -10.115 -0.309 6.009 1.00 0.00 H new ATOM 0 HA GLN B 117 -9.558 2.345 5.328 1.00 0.00 H new ATOM 0 HB2 GLN B 117 -11.703 1.705 6.188 1.00 0.00 H new ATOM 0 HB3 GLN B 117 -11.004 1.043 7.652 1.00 0.00 H new ATOM 0 HG2 GLN B 117 -10.284 3.343 8.327 1.00 0.00 H new ATOM 0 HG3 GLN B 117 -11.031 3.989 6.879 1.00 0.00 H new ATOM 0 HE21 GLN B 117 -13.277 4.127 6.725 1.00 0.00 H new ATOM 0 HE22 GLN B 117 -14.302 3.973 8.156 1.00 0.00 H new ATOM 1554 N ASP B 118 -8.014 1.384 8.032 1.00 0.00 N ATOM 1555 CA ASP B 118 -6.925 1.685 8.947 1.00 0.00 C ATOM 1556 C ASP B 118 -5.619 1.771 8.182 1.00 0.00 C ATOM 1557 O ASP B 118 -4.669 2.438 8.618 1.00 0.00 O ATOM 1558 CB ASP B 118 -6.831 0.651 10.085 1.00 0.00 C ATOM 1559 CG ASP B 118 -5.825 1.006 11.161 1.00 0.00 C ATOM 1560 OD1 ASP B 118 -6.155 1.792 12.066 1.00 0.00 O ATOM 1561 OD2 ASP B 118 -4.704 0.480 11.150 1.00 0.00 O ATOM 0 H ASP B 118 -8.435 0.467 8.180 1.00 0.00 H new ATOM 0 HA ASP B 118 -7.129 2.650 9.411 1.00 0.00 H new ATOM 0 HB2 ASP B 118 -7.814 0.541 10.543 1.00 0.00 H new ATOM 0 HB3 ASP B 118 -6.567 -0.318 9.661 1.00 0.00 H new ATOM 1566 N PHE B 119 -5.545 1.067 7.038 1.00 0.00 N ATOM 1567 CA PHE B 119 -4.304 0.981 6.292 1.00 0.00 C ATOM 1568 C PHE B 119 -3.936 2.327 5.772 1.00 0.00 C ATOM 1569 O PHE B 119 -2.807 2.756 5.894 1.00 0.00 O ATOM 1570 CB PHE B 119 -4.423 0.065 5.097 1.00 0.00 C ATOM 1571 CG PHE B 119 -3.155 -0.652 4.795 1.00 0.00 C ATOM 1572 CD1 PHE B 119 -2.517 -1.386 5.780 1.00 0.00 C ATOM 1573 CD2 PHE B 119 -2.591 -0.591 3.538 1.00 0.00 C ATOM 1574 CE1 PHE B 119 -1.341 -2.041 5.519 1.00 0.00 C ATOM 1575 CE2 PHE B 119 -1.413 -1.248 3.271 1.00 0.00 C ATOM 1576 CZ PHE B 119 -0.789 -1.972 4.264 1.00 0.00 C ATOM 0 H PHE B 119 -6.327 0.559 6.624 1.00 0.00 H new ATOM 0 HA PHE B 119 -3.552 0.591 6.977 1.00 0.00 H new ATOM 0 HB2 PHE B 119 -5.213 -0.664 5.280 1.00 0.00 H new ATOM 0 HB3 PHE B 119 -4.722 0.648 4.226 1.00 0.00 H new ATOM 0 HD1 PHE B 119 -2.951 -1.444 6.767 1.00 0.00 H new ATOM 0 HD2 PHE B 119 -3.078 -0.024 2.758 1.00 0.00 H new ATOM 0 HE1 PHE B 119 -0.852 -2.608 6.297 1.00 0.00 H new ATOM 0 HE2 PHE B 119 -0.977 -1.197 2.284 1.00 0.00 H new ATOM 0 HZ PHE B 119 0.137 -2.487 4.054 1.00 0.00 H new ATOM 1586 N LEU B 120 -4.892 2.980 5.185 1.00 0.00 N ATOM 1587 CA LEU B 120 -4.629 4.277 4.577 1.00 0.00 C ATOM 1588 C LEU B 120 -4.420 5.315 5.655 1.00 0.00 C ATOM 1589 O LEU B 120 -3.513 6.099 5.577 1.00 0.00 O ATOM 1590 CB LEU B 120 -5.726 4.741 3.577 1.00 0.00 C ATOM 1591 CG LEU B 120 -6.547 3.656 2.888 1.00 0.00 C ATOM 1592 CD1 LEU B 120 -5.721 2.483 2.344 1.00 0.00 C ATOM 1593 CD2 LEU B 120 -7.708 3.274 3.759 1.00 0.00 C ATOM 0 H LEU B 120 -5.855 2.653 5.107 1.00 0.00 H new ATOM 0 HA LEU B 120 -3.721 4.162 3.985 1.00 0.00 H new ATOM 0 HB2 LEU B 120 -6.414 5.397 4.111 1.00 0.00 H new ATOM 0 HB3 LEU B 120 -5.246 5.343 2.805 1.00 0.00 H new ATOM 0 HG LEU B 120 -6.958 4.073 1.969 1.00 0.00 H new ATOM 0 HD11 LEU B 120 -6.385 1.759 1.871 1.00 0.00 H new ATOM 0 HD12 LEU B 120 -5.004 2.852 1.610 1.00 0.00 H new ATOM 0 HD13 LEU B 120 -5.186 2.003 3.164 1.00 0.00 H new ATOM 0 HD21 LEU B 120 -8.294 2.499 3.265 1.00 0.00 H new ATOM 0 HD22 LEU B 120 -7.339 2.898 4.713 1.00 0.00 H new ATOM 0 HD23 LEU B 120 -8.336 4.148 3.932 1.00 0.00 H new ATOM 1605 N LEU B 121 -5.235 5.258 6.705 1.00 0.00 N ATOM 1606 CA LEU B 121 -5.152 6.228 7.814 1.00 0.00 C ATOM 1607 C LEU B 121 -3.775 6.288 8.468 1.00 0.00 C ATOM 1608 O LEU B 121 -3.364 7.340 8.959 1.00 0.00 O ATOM 1609 CB LEU B 121 -6.203 5.951 8.877 1.00 0.00 C ATOM 1610 CG LEU B 121 -7.649 6.158 8.468 1.00 0.00 C ATOM 1611 CD1 LEU B 121 -8.574 5.704 9.575 1.00 0.00 C ATOM 1612 CD2 LEU B 121 -7.900 7.620 8.171 1.00 0.00 C ATOM 0 H LEU B 121 -5.964 4.553 6.819 1.00 0.00 H new ATOM 0 HA LEU B 121 -5.340 7.200 7.357 1.00 0.00 H new ATOM 0 HB2 LEU B 121 -6.087 4.920 9.211 1.00 0.00 H new ATOM 0 HB3 LEU B 121 -5.996 6.590 9.736 1.00 0.00 H new ATOM 0 HG LEU B 121 -7.844 5.569 7.572 1.00 0.00 H new ATOM 0 HD11 LEU B 121 -9.609 5.857 9.270 1.00 0.00 H new ATOM 0 HD12 LEU B 121 -8.408 4.646 9.777 1.00 0.00 H new ATOM 0 HD13 LEU B 121 -8.372 6.281 10.477 1.00 0.00 H new ATOM 0 HD21 LEU B 121 -8.941 7.758 7.878 1.00 0.00 H new ATOM 0 HD22 LEU B 121 -7.692 8.213 9.061 1.00 0.00 H new ATOM 0 HD23 LEU B 121 -7.249 7.943 7.359 1.00 0.00 H new ATOM 1624 N LYS B 122 -3.049 5.193 8.437 1.00 0.00 N ATOM 1625 CA LYS B 122 -1.745 5.142 9.088 1.00 0.00 C ATOM 1626 C LYS B 122 -0.644 5.630 8.159 1.00 0.00 C ATOM 1627 O LYS B 122 0.525 5.659 8.531 1.00 0.00 O ATOM 1628 CB LYS B 122 -1.416 3.738 9.560 1.00 0.00 C ATOM 1629 CG LYS B 122 -1.248 2.754 8.440 1.00 0.00 C ATOM 1630 CD LYS B 122 -0.652 1.470 8.920 1.00 0.00 C ATOM 1631 CE LYS B 122 -1.555 0.736 9.907 1.00 0.00 C ATOM 1632 NZ LYS B 122 -2.862 0.391 9.330 1.00 0.00 N ATOM 0 H LYS B 122 -3.330 4.329 7.974 1.00 0.00 H new ATOM 0 HA LYS B 122 -1.799 5.803 9.953 1.00 0.00 H new ATOM 0 HB2 LYS B 122 -0.499 3.767 10.148 1.00 0.00 H new ATOM 0 HB3 LYS B 122 -2.209 3.391 10.222 1.00 0.00 H new ATOM 0 HG2 LYS B 122 -2.216 2.557 7.980 1.00 0.00 H new ATOM 0 HG3 LYS B 122 -0.611 3.186 7.668 1.00 0.00 H new ATOM 0 HD2 LYS B 122 -0.454 0.824 8.065 1.00 0.00 H new ATOM 0 HD3 LYS B 122 0.308 1.674 9.394 1.00 0.00 H new ATOM 0 HE2 LYS B 122 -1.058 -0.175 10.240 1.00 0.00 H new ATOM 0 HE3 LYS B 122 -1.705 1.359 10.789 1.00 0.00 H new ATOM 0 HZ1 LYS B 122 -3.483 0.018 10.076 1.00 0.00 H new ATOM 0 HZ2 LYS B 122 -3.293 1.241 8.913 1.00 0.00 H new ATOM 0 HZ3 LYS B 122 -2.736 -0.331 8.592 1.00 0.00 H new ATOM 1646 N MET B 123 -1.011 6.004 6.962 1.00 0.00 N ATOM 1647 CA MET B 123 -0.042 6.444 5.998 1.00 0.00 C ATOM 1648 C MET B 123 0.265 7.926 6.230 1.00 0.00 C ATOM 1649 O MET B 123 -0.642 8.708 6.587 1.00 0.00 O ATOM 1650 CB MET B 123 -0.555 6.252 4.563 1.00 0.00 C ATOM 1651 CG MET B 123 -0.951 4.829 4.186 1.00 0.00 C ATOM 1652 SD MET B 123 -1.486 4.724 2.459 1.00 0.00 S ATOM 1653 CE MET B 123 -1.793 2.975 2.268 1.00 0.00 C ATOM 0 H MET B 123 -1.976 6.012 6.632 1.00 0.00 H new ATOM 0 HA MET B 123 0.860 5.845 6.122 1.00 0.00 H new ATOM 0 HB2 MET B 123 -1.419 6.901 4.416 1.00 0.00 H new ATOM 0 HB3 MET B 123 0.218 6.589 3.873 1.00 0.00 H new ATOM 0 HG2 MET B 123 -0.106 4.160 4.347 1.00 0.00 H new ATOM 0 HG3 MET B 123 -1.755 4.489 4.838 1.00 0.00 H new ATOM 0 HE1 MET B 123 -2.615 2.824 1.568 1.00 0.00 H new ATOM 0 HE2 MET B 123 -0.896 2.488 1.885 1.00 0.00 H new ATOM 0 HE3 MET B 123 -2.055 2.544 3.234 1.00 0.00 H new ATOM 1663 N PRO B 124 1.540 8.335 6.089 1.00 0.00 N ATOM 1664 CA PRO B 124 1.932 9.739 6.202 1.00 0.00 C ATOM 1665 C PRO B 124 1.278 10.568 5.098 1.00 0.00 C ATOM 1666 O PRO B 124 1.513 10.333 3.917 1.00 0.00 O ATOM 1667 CB PRO B 124 3.460 9.724 6.019 1.00 0.00 C ATOM 1668 CG PRO B 124 3.769 8.411 5.382 1.00 0.00 C ATOM 1669 CD PRO B 124 2.697 7.459 5.830 1.00 0.00 C ATOM 0 HA PRO B 124 1.626 10.180 7.151 1.00 0.00 H new ATOM 0 HB2 PRO B 124 3.789 10.552 5.391 1.00 0.00 H new ATOM 0 HB3 PRO B 124 3.971 9.827 6.976 1.00 0.00 H new ATOM 0 HG2 PRO B 124 3.780 8.500 4.296 1.00 0.00 H new ATOM 0 HG3 PRO B 124 4.754 8.056 5.683 1.00 0.00 H new ATOM 0 HD2 PRO B 124 2.474 6.717 5.063 1.00 0.00 H new ATOM 0 HD3 PRO B 124 2.995 6.913 6.725 1.00 0.00 H new ATOM 1677 N GLY B 125 0.444 11.497 5.482 1.00 0.00 N ATOM 1678 CA GLY B 125 -0.235 12.302 4.519 1.00 0.00 C ATOM 1679 C GLY B 125 -1.733 12.093 4.600 1.00 0.00 C ATOM 1680 O GLY B 125 -2.518 12.896 4.117 1.00 0.00 O ATOM 0 H GLY B 125 0.223 11.710 6.455 1.00 0.00 H new ATOM 0 HA2 GLY B 125 -0.001 13.353 4.688 1.00 0.00 H new ATOM 0 HA3 GLY B 125 0.117 12.053 3.518 1.00 0.00 H new ATOM 1684 N VAL B 126 -2.134 11.025 5.230 1.00 0.00 N ATOM 1685 CA VAL B 126 -3.525 10.684 5.310 1.00 0.00 C ATOM 1686 C VAL B 126 -4.136 11.110 6.646 1.00 0.00 C ATOM 1687 O VAL B 126 -3.503 11.020 7.704 1.00 0.00 O ATOM 1688 CB VAL B 126 -3.745 9.169 5.057 1.00 0.00 C ATOM 1689 CG1 VAL B 126 -5.215 8.786 5.162 1.00 0.00 C ATOM 1690 CG2 VAL B 126 -3.201 8.785 3.689 1.00 0.00 C ATOM 0 H VAL B 126 -1.509 10.370 5.700 1.00 0.00 H new ATOM 0 HA VAL B 126 -4.040 11.237 4.524 1.00 0.00 H new ATOM 0 HB VAL B 126 -3.205 8.622 5.830 1.00 0.00 H new ATOM 0 HG11 VAL B 126 -5.327 7.717 4.978 1.00 0.00 H new ATOM 0 HG12 VAL B 126 -5.582 9.023 6.161 1.00 0.00 H new ATOM 0 HG13 VAL B 126 -5.790 9.343 4.422 1.00 0.00 H new ATOM 0 HG21 VAL B 126 -3.360 7.720 3.520 1.00 0.00 H new ATOM 0 HG22 VAL B 126 -3.719 9.356 2.918 1.00 0.00 H new ATOM 0 HG23 VAL B 126 -2.134 9.004 3.647 1.00 0.00 H new ATOM 1700 N ASN B 127 -5.347 11.600 6.561 1.00 0.00 N ATOM 1701 CA ASN B 127 -6.165 12.009 7.693 1.00 0.00 C ATOM 1702 C ASN B 127 -7.522 11.444 7.451 1.00 0.00 C ATOM 1703 O ASN B 127 -7.826 11.116 6.323 1.00 0.00 O ATOM 1704 CB ASN B 127 -6.320 13.532 7.791 1.00 0.00 C ATOM 1705 CG ASN B 127 -5.044 14.279 8.003 1.00 0.00 C ATOM 1706 OD1 ASN B 127 -4.491 14.792 6.951 1.00 0.00 O flip ATOM 1707 ND2 ASN B 127 -4.602 14.459 9.126 1.00 0.00 N flip ATOM 0 H ASN B 127 -5.817 11.734 5.666 1.00 0.00 H new ATOM 0 HA ASN B 127 -5.693 11.660 8.612 1.00 0.00 H new ATOM 0 HB2 ASN B 127 -6.789 13.895 6.877 1.00 0.00 H new ATOM 0 HB3 ASN B 127 -7.000 13.762 8.611 1.00 0.00 H new ATOM 0 HD21 ASN B 127 -5.066 14.038 9.930 1.00 0.00 H new ATOM 0 HD22 ASN B 127 -3.768 15.031 9.260 1.00 0.00 H new ATOM 1714 N ALA B 128 -8.356 11.376 8.460 1.00 0.00 N ATOM 1715 CA ALA B 128 -9.698 10.827 8.320 1.00 0.00 C ATOM 1716 C ALA B 128 -10.516 11.601 7.292 1.00 0.00 C ATOM 1717 O ALA B 128 -11.290 11.017 6.543 1.00 0.00 O ATOM 1718 CB ALA B 128 -10.406 10.794 9.664 1.00 0.00 C ATOM 0 H ALA B 128 -8.132 11.697 9.402 1.00 0.00 H new ATOM 0 HA ALA B 128 -9.602 9.804 7.957 1.00 0.00 H new ATOM 0 HB1 ALA B 128 -11.407 10.381 9.538 1.00 0.00 H new ATOM 0 HB2 ALA B 128 -9.841 10.171 10.358 1.00 0.00 H new ATOM 0 HB3 ALA B 128 -10.479 11.806 10.062 1.00 0.00 H new ATOM 1724 N LYS B 129 -10.255 12.899 7.194 1.00 0.00 N ATOM 1725 CA LYS B 129 -10.994 13.764 6.281 1.00 0.00 C ATOM 1726 C LYS B 129 -10.656 13.427 4.834 1.00 0.00 C ATOM 1727 O LYS B 129 -11.539 13.247 3.961 1.00 0.00 O ATOM 1728 CB LYS B 129 -10.701 15.249 6.602 1.00 0.00 C ATOM 1729 CG LYS B 129 -9.211 15.635 6.592 1.00 0.00 C ATOM 1730 CD LYS B 129 -8.935 17.074 7.078 1.00 0.00 C ATOM 1731 CE LYS B 129 -9.269 18.173 6.054 1.00 0.00 C ATOM 1732 NZ LYS B 129 -10.703 18.296 5.728 1.00 0.00 N ATOM 0 H LYS B 129 -9.536 13.377 7.737 1.00 0.00 H new ATOM 0 HA LYS B 129 -12.062 13.595 6.416 1.00 0.00 H new ATOM 0 HB2 LYS B 129 -11.227 15.872 5.879 1.00 0.00 H new ATOM 0 HB3 LYS B 129 -11.114 15.481 7.583 1.00 0.00 H new ATOM 0 HG2 LYS B 129 -8.661 14.937 7.223 1.00 0.00 H new ATOM 0 HG3 LYS B 129 -8.823 15.523 5.579 1.00 0.00 H new ATOM 0 HD2 LYS B 129 -9.512 17.254 7.985 1.00 0.00 H new ATOM 0 HD3 LYS B 129 -7.882 17.156 7.349 1.00 0.00 H new ATOM 0 HE2 LYS B 129 -8.914 19.129 6.439 1.00 0.00 H new ATOM 0 HE3 LYS B 129 -8.717 17.975 5.135 1.00 0.00 H new ATOM 0 HZ1 LYS B 129 -10.930 19.291 5.530 1.00 0.00 H new ATOM 0 HZ2 LYS B 129 -10.919 17.718 4.891 1.00 0.00 H new ATOM 0 HZ3 LYS B 129 -11.272 17.965 6.533 1.00 0.00 H new ATOM 1746 N ASN B 130 -9.403 13.236 4.591 1.00 0.00 N ATOM 1747 CA ASN B 130 -8.992 13.012 3.258 1.00 0.00 C ATOM 1748 C ASN B 130 -9.111 11.559 2.905 1.00 0.00 C ATOM 1749 O ASN B 130 -9.278 11.228 1.767 1.00 0.00 O ATOM 1750 CB ASN B 130 -7.596 13.599 2.950 1.00 0.00 C ATOM 1751 CG ASN B 130 -6.397 12.952 3.664 1.00 0.00 C ATOM 1752 OD1 ASN B 130 -6.388 11.787 3.990 1.00 0.00 O ATOM 1753 ND2 ASN B 130 -5.378 13.718 3.902 1.00 0.00 N ATOM 0 H ASN B 130 -8.660 13.231 5.290 1.00 0.00 H new ATOM 0 HA ASN B 130 -9.673 13.562 2.608 1.00 0.00 H new ATOM 0 HB2 ASN B 130 -7.428 13.530 1.875 1.00 0.00 H new ATOM 0 HB3 ASN B 130 -7.610 14.659 3.203 1.00 0.00 H new ATOM 0 HD21 ASN B 130 -4.554 13.340 4.370 1.00 0.00 H new ATOM 0 HD22 ASN B 130 -5.400 14.698 3.621 1.00 0.00 H new ATOM 1760 N CYS B 131 -9.079 10.710 3.910 1.00 0.00 N ATOM 1761 CA CYS B 131 -9.204 9.290 3.727 1.00 0.00 C ATOM 1762 C CYS B 131 -10.617 8.931 3.388 1.00 0.00 C ATOM 1763 O CYS B 131 -10.832 8.048 2.618 1.00 0.00 O ATOM 1764 CB CYS B 131 -8.759 8.521 4.959 1.00 0.00 C ATOM 1765 SG CYS B 131 -8.697 6.724 4.756 1.00 0.00 S ATOM 0 H CYS B 131 -8.964 10.994 4.883 1.00 0.00 H new ATOM 0 HA CYS B 131 -8.550 9.009 2.901 1.00 0.00 H new ATOM 0 HB2 CYS B 131 -7.770 8.873 5.251 1.00 0.00 H new ATOM 0 HB3 CYS B 131 -9.436 8.756 5.780 1.00 0.00 H new ATOM 0 HG CYS B 131 -9.141 6.150 5.835 1.00 0.00 H new ATOM 1771 N ARG B 132 -11.589 9.618 3.970 1.00 0.00 N ATOM 1772 CA ARG B 132 -12.978 9.343 3.646 1.00 0.00 C ATOM 1773 C ARG B 132 -13.260 9.746 2.210 1.00 0.00 C ATOM 1774 O ARG B 132 -13.877 8.988 1.433 1.00 0.00 O ATOM 1775 CB ARG B 132 -13.935 10.018 4.639 1.00 0.00 C ATOM 1776 CG ARG B 132 -13.849 11.528 4.708 1.00 0.00 C ATOM 1777 CD ARG B 132 -15.052 12.194 4.053 1.00 0.00 C ATOM 1778 NE ARG B 132 -16.320 11.791 4.696 1.00 0.00 N ATOM 1779 CZ ARG B 132 -17.435 12.542 4.762 1.00 0.00 C ATOM 1780 NH1 ARG B 132 -17.452 13.778 4.254 1.00 0.00 N ATOM 1781 NH2 ARG B 132 -18.526 12.055 5.362 1.00 0.00 N ATOM 0 H ARG B 132 -11.445 10.358 4.657 1.00 0.00 H new ATOM 0 HA ARG B 132 -13.154 8.271 3.737 1.00 0.00 H new ATOM 0 HB2 ARG B 132 -14.956 9.742 4.376 1.00 0.00 H new ATOM 0 HB3 ARG B 132 -13.742 9.615 5.633 1.00 0.00 H new ATOM 0 HG2 ARG B 132 -13.783 11.841 5.750 1.00 0.00 H new ATOM 0 HG3 ARG B 132 -12.936 11.863 4.216 1.00 0.00 H new ATOM 0 HD2 ARG B 132 -14.944 13.277 4.110 1.00 0.00 H new ATOM 0 HD3 ARG B 132 -15.081 11.932 2.995 1.00 0.00 H new ATOM 0 HE ARG B 132 -16.353 10.867 5.126 1.00 0.00 H new ATOM 0 HH11 ARG B 132 -16.616 14.159 3.812 1.00 0.00 H new ATOM 0 HH12 ARG B 132 -18.301 14.340 4.308 1.00 0.00 H new ATOM 0 HH21 ARG B 132 -18.511 11.119 5.767 1.00 0.00 H new ATOM 0 HH22 ARG B 132 -19.374 12.620 5.415 1.00 0.00 H new ATOM 1795 N SER B 133 -12.763 10.907 1.833 1.00 0.00 N ATOM 1796 CA SER B 133 -12.902 11.346 0.477 1.00 0.00 C ATOM 1797 C SER B 133 -12.105 10.433 -0.476 1.00 0.00 C ATOM 1798 O SER B 133 -12.564 10.091 -1.577 1.00 0.00 O ATOM 1799 CB SER B 133 -12.482 12.789 0.387 1.00 0.00 C ATOM 1800 OG SER B 133 -13.328 13.579 1.217 1.00 0.00 O ATOM 0 H SER B 133 -12.265 11.552 2.447 1.00 0.00 H new ATOM 0 HA SER B 133 -13.944 11.276 0.163 1.00 0.00 H new ATOM 0 HB2 SER B 133 -11.443 12.897 0.699 1.00 0.00 H new ATOM 0 HB3 SER B 133 -12.542 13.133 -0.645 1.00 0.00 H new ATOM 0 HG SER B 133 -12.959 13.610 2.124 1.00 0.00 H new ATOM 1806 N LEU B 134 -10.960 9.986 -0.009 1.00 0.00 N ATOM 1807 CA LEU B 134 -10.095 9.084 -0.755 1.00 0.00 C ATOM 1808 C LEU B 134 -10.818 7.793 -0.974 1.00 0.00 C ATOM 1809 O LEU B 134 -10.858 7.286 -2.046 1.00 0.00 O ATOM 1810 CB LEU B 134 -8.835 8.785 0.035 1.00 0.00 C ATOM 1811 CG LEU B 134 -7.741 8.046 -0.711 1.00 0.00 C ATOM 1812 CD1 LEU B 134 -6.925 8.981 -1.586 1.00 0.00 C ATOM 1813 CD2 LEU B 134 -6.886 7.242 0.233 1.00 0.00 C ATOM 0 H LEU B 134 -10.595 10.239 0.909 1.00 0.00 H new ATOM 0 HA LEU B 134 -9.831 9.554 -1.702 1.00 0.00 H new ATOM 0 HB2 LEU B 134 -8.426 9.728 0.399 1.00 0.00 H new ATOM 0 HB3 LEU B 134 -9.110 8.198 0.911 1.00 0.00 H new ATOM 0 HG LEU B 134 -8.219 7.337 -1.387 1.00 0.00 H new ATOM 0 HD11 LEU B 134 -6.152 8.413 -2.103 1.00 0.00 H new ATOM 0 HD12 LEU B 134 -7.578 9.456 -2.318 1.00 0.00 H new ATOM 0 HD13 LEU B 134 -6.459 9.746 -0.965 1.00 0.00 H new ATOM 0 HD21 LEU B 134 -6.111 6.723 -0.331 1.00 0.00 H new ATOM 0 HD22 LEU B 134 -6.422 7.908 0.960 1.00 0.00 H new ATOM 0 HD23 LEU B 134 -7.506 6.512 0.753 1.00 0.00 H new ATOM 1825 N MET B 135 -11.451 7.346 0.061 1.00 0.00 N ATOM 1826 CA MET B 135 -12.171 6.095 0.133 1.00 0.00 C ATOM 1827 C MET B 135 -13.277 6.055 -0.894 1.00 0.00 C ATOM 1828 O MET B 135 -13.675 5.002 -1.362 1.00 0.00 O ATOM 1829 CB MET B 135 -12.714 5.969 1.542 1.00 0.00 C ATOM 1830 CG MET B 135 -13.213 4.618 1.941 1.00 0.00 C ATOM 1831 SD MET B 135 -13.446 4.506 3.724 1.00 0.00 S ATOM 1832 CE MET B 135 -11.773 4.876 4.298 1.00 0.00 C ATOM 0 H MET B 135 -11.488 7.868 0.937 1.00 0.00 H new ATOM 0 HA MET B 135 -11.513 5.255 -0.089 1.00 0.00 H new ATOM 0 HB2 MET B 135 -11.929 6.263 2.239 1.00 0.00 H new ATOM 0 HB3 MET B 135 -13.529 6.683 1.660 1.00 0.00 H new ATOM 0 HG2 MET B 135 -14.156 4.413 1.435 1.00 0.00 H new ATOM 0 HG3 MET B 135 -12.505 3.856 1.616 1.00 0.00 H new ATOM 0 HE1 MET B 135 -11.411 4.055 4.917 1.00 0.00 H new ATOM 0 HE2 MET B 135 -11.113 5.002 3.439 1.00 0.00 H new ATOM 0 HE3 MET B 135 -11.784 5.795 4.885 1.00 0.00 H new ATOM 1842 N HIS B 136 -13.797 7.209 -1.206 1.00 0.00 N ATOM 1843 CA HIS B 136 -14.802 7.314 -2.230 1.00 0.00 C ATOM 1844 C HIS B 136 -14.219 7.666 -3.602 1.00 0.00 C ATOM 1845 O HIS B 136 -14.928 7.645 -4.606 1.00 0.00 O ATOM 1846 CB HIS B 136 -15.910 8.265 -1.820 1.00 0.00 C ATOM 1847 CG HIS B 136 -16.787 7.698 -0.724 1.00 0.00 C ATOM 1848 ND1 HIS B 136 -18.136 7.472 -0.865 1.00 0.00 N ATOM 1849 CD2 HIS B 136 -16.476 7.274 0.525 1.00 0.00 C ATOM 1850 CE1 HIS B 136 -18.608 6.933 0.237 1.00 0.00 C ATOM 1851 NE2 HIS B 136 -17.621 6.802 1.095 1.00 0.00 N ATOM 0 H HIS B 136 -13.542 8.093 -0.766 1.00 0.00 H new ATOM 0 HA HIS B 136 -15.243 6.323 -2.339 1.00 0.00 H new ATOM 0 HB2 HIS B 136 -15.471 9.203 -1.481 1.00 0.00 H new ATOM 0 HB3 HIS B 136 -16.525 8.497 -2.689 1.00 0.00 H new ATOM 0 HD2 HIS B 136 -15.499 7.304 0.985 1.00 0.00 H new ATOM 0 HE1 HIS B 136 -19.635 6.646 0.409 1.00 0.00 H new ATOM 0 HE2 HIS B 136 -17.699 6.411 2.034 1.00 0.00 H new ATOM 1860 N HIS B 137 -12.946 8.012 -3.647 1.00 0.00 N ATOM 1861 CA HIS B 137 -12.274 8.326 -4.919 1.00 0.00 C ATOM 1862 C HIS B 137 -11.380 7.209 -5.426 1.00 0.00 C ATOM 1863 O HIS B 137 -11.053 7.163 -6.613 1.00 0.00 O ATOM 1864 CB HIS B 137 -11.482 9.628 -4.851 1.00 0.00 C ATOM 1865 CG HIS B 137 -12.298 10.858 -5.077 1.00 0.00 C ATOM 1866 ND1 HIS B 137 -12.994 11.628 -4.224 1.00 0.00 N flip ATOM 1867 CD2 HIS B 137 -12.448 11.436 -6.314 1.00 0.00 C flip ATOM 1868 CE1 HIS B 137 -13.546 12.644 -4.950 1.00 0.00 C flip ATOM 1869 NE2 HIS B 137 -13.201 12.502 -6.209 1.00 0.00 N flip ATOM 0 H HIS B 137 -12.347 8.086 -2.825 1.00 0.00 H new ATOM 0 HA HIS B 137 -13.087 8.445 -5.635 1.00 0.00 H new ATOM 0 HB2 HIS B 137 -11.004 9.698 -3.874 1.00 0.00 H new ATOM 0 HB3 HIS B 137 -10.685 9.594 -5.594 1.00 0.00 H new ATOM 0 HD1 HIS B 137 -13.092 11.481 -3.219 1.00 0.00 H new ATOM 0 HD2 HIS B 137 -12.012 11.068 -7.231 1.00 0.00 H new ATOM 0 HE1 HIS B 137 -14.165 13.435 -4.554 1.00 0.00 H new ATOM 1878 N VAL B 138 -11.012 6.317 -4.559 1.00 0.00 N ATOM 1879 CA VAL B 138 -10.089 5.257 -4.905 1.00 0.00 C ATOM 1880 C VAL B 138 -10.678 3.905 -4.467 1.00 0.00 C ATOM 1881 O VAL B 138 -11.670 3.870 -3.739 1.00 0.00 O ATOM 1882 CB VAL B 138 -8.676 5.510 -4.250 1.00 0.00 C ATOM 1883 CG1 VAL B 138 -8.683 5.347 -2.766 1.00 0.00 C ATOM 1884 CG2 VAL B 138 -7.615 4.665 -4.865 1.00 0.00 C ATOM 0 H VAL B 138 -11.336 6.295 -3.592 1.00 0.00 H new ATOM 0 HA VAL B 138 -9.945 5.241 -5.985 1.00 0.00 H new ATOM 0 HB VAL B 138 -8.442 6.554 -4.457 1.00 0.00 H new ATOM 0 HG11 VAL B 138 -7.683 5.534 -2.375 1.00 0.00 H new ATOM 0 HG12 VAL B 138 -9.384 6.056 -2.325 1.00 0.00 H new ATOM 0 HG13 VAL B 138 -8.988 4.331 -2.513 1.00 0.00 H new ATOM 0 HG21 VAL B 138 -6.660 4.873 -4.383 1.00 0.00 H new ATOM 0 HG22 VAL B 138 -7.866 3.613 -4.734 1.00 0.00 H new ATOM 0 HG23 VAL B 138 -7.541 4.891 -5.929 1.00 0.00 H new ATOM 1894 N LYS B 139 -10.123 2.813 -4.954 1.00 0.00 N ATOM 1895 CA LYS B 139 -10.589 1.486 -4.586 1.00 0.00 C ATOM 1896 C LYS B 139 -9.908 1.014 -3.317 1.00 0.00 C ATOM 1897 O LYS B 139 -10.563 0.722 -2.320 1.00 0.00 O ATOM 1898 CB LYS B 139 -10.310 0.522 -5.712 1.00 0.00 C ATOM 1899 CG LYS B 139 -10.750 -0.887 -5.442 1.00 0.00 C ATOM 1900 CD LYS B 139 -10.550 -1.782 -6.639 1.00 0.00 C ATOM 1901 CE LYS B 139 -9.085 -1.967 -6.966 1.00 0.00 C ATOM 1902 NZ LYS B 139 -8.907 -2.829 -8.146 1.00 0.00 N ATOM 0 H LYS B 139 -9.343 2.817 -5.611 1.00 0.00 H new ATOM 0 HA LYS B 139 -11.663 1.528 -4.403 1.00 0.00 H new ATOM 0 HB2 LYS B 139 -10.809 0.880 -6.613 1.00 0.00 H new ATOM 0 HB3 LYS B 139 -9.240 0.523 -5.919 1.00 0.00 H new ATOM 0 HG2 LYS B 139 -10.191 -1.285 -4.595 1.00 0.00 H new ATOM 0 HG3 LYS B 139 -11.803 -0.890 -5.159 1.00 0.00 H new ATOM 0 HD2 LYS B 139 -11.004 -2.754 -6.446 1.00 0.00 H new ATOM 0 HD3 LYS B 139 -11.063 -1.356 -7.501 1.00 0.00 H new ATOM 0 HE2 LYS B 139 -8.625 -0.996 -7.149 1.00 0.00 H new ATOM 0 HE3 LYS B 139 -8.572 -2.406 -6.111 1.00 0.00 H new ATOM 0 HZ1 LYS B 139 -7.892 -2.938 -8.346 1.00 0.00 H new ATOM 0 HZ2 LYS B 139 -9.325 -3.763 -7.960 1.00 0.00 H new ATOM 0 HZ3 LYS B 139 -9.377 -2.396 -8.966 1.00 0.00 H new ATOM 1916 N ASN B 140 -8.603 0.893 -3.390 1.00 0.00 N ATOM 1917 CA ASN B 140 -7.768 0.566 -2.272 1.00 0.00 C ATOM 1918 C ASN B 140 -6.328 0.791 -2.752 1.00 0.00 C ATOM 1919 O ASN B 140 -6.134 1.443 -3.802 1.00 0.00 O ATOM 1920 CB ASN B 140 -7.967 -0.911 -1.808 1.00 0.00 C ATOM 1921 CG ASN B 140 -7.485 -1.147 -0.342 1.00 0.00 C ATOM 1922 OD1 ASN B 140 -6.642 -0.434 0.176 1.00 0.00 O ATOM 1923 ND2 ASN B 140 -7.990 -2.129 0.306 1.00 0.00 N ATOM 0 H ASN B 140 -8.083 1.025 -4.258 1.00 0.00 H new ATOM 0 HA ASN B 140 -8.015 1.185 -1.410 1.00 0.00 H new ATOM 0 HB2 ASN B 140 -9.022 -1.174 -1.887 1.00 0.00 H new ATOM 0 HB3 ASN B 140 -7.421 -1.576 -2.478 1.00 0.00 H new ATOM 0 HD21 ASN B 140 -7.688 -2.319 1.261 1.00 0.00 H new ATOM 0 HD22 ASN B 140 -8.695 -2.721 -0.133 1.00 0.00 H new ATOM 1930 N ILE B 141 -5.376 0.235 -2.021 1.00 0.00 N ATOM 1931 CA ILE B 141 -3.923 0.274 -2.224 1.00 0.00 C ATOM 1932 C ILE B 141 -3.509 0.362 -3.685 1.00 0.00 C ATOM 1933 O ILE B 141 -2.767 1.255 -4.048 1.00 0.00 O ATOM 1934 CB ILE B 141 -3.302 -1.018 -1.648 1.00 0.00 C ATOM 1935 CG1 ILE B 141 -3.594 -1.158 -0.155 1.00 0.00 C ATOM 1936 CG2 ILE B 141 -1.786 -1.076 -1.906 1.00 0.00 C ATOM 1937 CD1 ILE B 141 -3.107 -2.459 0.442 1.00 0.00 C ATOM 0 H ILE B 141 -5.615 -0.308 -1.191 1.00 0.00 H new ATOM 0 HA ILE B 141 -3.570 1.174 -1.721 1.00 0.00 H new ATOM 0 HB ILE B 141 -3.767 -1.857 -2.166 1.00 0.00 H new ATOM 0 HG12 ILE B 141 -3.128 -0.328 0.376 1.00 0.00 H new ATOM 0 HG13 ILE B 141 -4.669 -1.075 0.005 1.00 0.00 H new ATOM 0 HG21 ILE B 141 -1.381 -1.997 -1.488 1.00 0.00 H new ATOM 0 HG22 ILE B 141 -1.598 -1.051 -2.979 1.00 0.00 H new ATOM 0 HG23 ILE B 141 -1.304 -0.220 -1.434 1.00 0.00 H new ATOM 0 HD11 ILE B 141 -3.350 -2.485 1.504 1.00 0.00 H new ATOM 0 HD12 ILE B 141 -3.592 -3.295 -0.062 1.00 0.00 H new ATOM 0 HD13 ILE B 141 -2.027 -2.536 0.315 1.00 0.00 H new ATOM 1949 N ALA B 142 -3.993 -0.568 -4.505 1.00 0.00 N ATOM 1950 CA ALA B 142 -3.596 -0.639 -5.911 1.00 0.00 C ATOM 1951 C ALA B 142 -3.805 0.655 -6.648 1.00 0.00 C ATOM 1952 O ALA B 142 -2.862 1.207 -7.215 1.00 0.00 O ATOM 1953 CB ALA B 142 -4.331 -1.742 -6.603 1.00 0.00 C ATOM 0 H ALA B 142 -4.661 -1.284 -4.221 1.00 0.00 H new ATOM 0 HA ALA B 142 -2.525 -0.842 -5.921 1.00 0.00 H new ATOM 0 HB1 ALA B 142 -4.025 -1.783 -7.649 1.00 0.00 H new ATOM 0 HB2 ALA B 142 -4.101 -2.692 -6.120 1.00 0.00 H new ATOM 0 HB3 ALA B 142 -5.404 -1.557 -6.545 1.00 0.00 H new ATOM 1959 N GLU B 143 -5.003 1.162 -6.582 1.00 0.00 N ATOM 1960 CA GLU B 143 -5.350 2.364 -7.290 1.00 0.00 C ATOM 1961 C GLU B 143 -4.754 3.542 -6.578 1.00 0.00 C ATOM 1962 O GLU B 143 -4.349 4.476 -7.205 1.00 0.00 O ATOM 1963 CB GLU B 143 -6.856 2.518 -7.378 1.00 0.00 C ATOM 1964 CG GLU B 143 -7.614 1.254 -7.724 1.00 0.00 C ATOM 1965 CD GLU B 143 -7.173 0.587 -8.990 1.00 0.00 C ATOM 1966 OE1 GLU B 143 -7.626 0.983 -10.071 1.00 0.00 O ATOM 1967 OE2 GLU B 143 -6.416 -0.387 -8.910 1.00 0.00 O ATOM 0 H GLU B 143 -5.765 0.757 -6.038 1.00 0.00 H new ATOM 0 HA GLU B 143 -4.955 2.307 -8.304 1.00 0.00 H new ATOM 0 HB2 GLU B 143 -7.223 2.893 -6.423 1.00 0.00 H new ATOM 0 HB3 GLU B 143 -7.085 3.276 -8.127 1.00 0.00 H new ATOM 0 HG2 GLU B 143 -7.509 0.547 -6.901 1.00 0.00 H new ATOM 0 HG3 GLU B 143 -8.674 1.493 -7.806 1.00 0.00 H new ATOM 1974 N LEU B 144 -4.690 3.473 -5.247 1.00 0.00 N ATOM 1975 CA LEU B 144 -4.118 4.541 -4.448 1.00 0.00 C ATOM 1976 C LEU B 144 -2.667 4.788 -4.844 1.00 0.00 C ATOM 1977 O LEU B 144 -2.255 5.917 -5.057 1.00 0.00 O ATOM 1978 CB LEU B 144 -4.217 4.191 -2.960 1.00 0.00 C ATOM 1979 CG LEU B 144 -3.544 5.157 -1.991 1.00 0.00 C ATOM 1980 CD1 LEU B 144 -4.092 6.561 -2.171 1.00 0.00 C ATOM 1981 CD2 LEU B 144 -3.734 4.687 -0.561 1.00 0.00 C ATOM 0 H LEU B 144 -5.032 2.680 -4.703 1.00 0.00 H new ATOM 0 HA LEU B 144 -4.681 5.456 -4.632 1.00 0.00 H new ATOM 0 HB2 LEU B 144 -5.272 4.120 -2.695 1.00 0.00 H new ATOM 0 HB3 LEU B 144 -3.784 3.202 -2.812 1.00 0.00 H new ATOM 0 HG LEU B 144 -2.476 5.178 -2.208 1.00 0.00 H new ATOM 0 HD11 LEU B 144 -3.600 7.236 -1.471 1.00 0.00 H new ATOM 0 HD12 LEU B 144 -3.905 6.897 -3.191 1.00 0.00 H new ATOM 0 HD13 LEU B 144 -5.165 6.560 -1.980 1.00 0.00 H new ATOM 0 HD21 LEU B 144 -3.248 5.386 0.119 1.00 0.00 H new ATOM 0 HD22 LEU B 144 -4.799 4.638 -0.332 1.00 0.00 H new ATOM 0 HD23 LEU B 144 -3.292 3.698 -0.441 1.00 0.00 H new ATOM 1993 N ALA B 145 -1.930 3.716 -4.988 1.00 0.00 N ATOM 1994 CA ALA B 145 -0.556 3.784 -5.356 1.00 0.00 C ATOM 1995 C ALA B 145 -0.409 4.060 -6.835 1.00 0.00 C ATOM 1996 O ALA B 145 0.647 4.509 -7.294 1.00 0.00 O ATOM 1997 CB ALA B 145 0.138 2.505 -4.965 1.00 0.00 C ATOM 0 H ALA B 145 -2.279 2.767 -4.850 1.00 0.00 H new ATOM 0 HA ALA B 145 -0.085 4.610 -4.823 1.00 0.00 H new ATOM 0 HB1 ALA B 145 1.189 2.560 -5.248 1.00 0.00 H new ATOM 0 HB2 ALA B 145 0.059 2.363 -3.887 1.00 0.00 H new ATOM 0 HB3 ALA B 145 -0.332 1.665 -5.477 1.00 0.00 H new ATOM 2003 N ALA B 146 -1.469 3.811 -7.574 1.00 0.00 N ATOM 2004 CA ALA B 146 -1.478 4.063 -8.991 1.00 0.00 C ATOM 2005 C ALA B 146 -1.787 5.525 -9.265 1.00 0.00 C ATOM 2006 O ALA B 146 -1.460 6.047 -10.336 1.00 0.00 O ATOM 2007 CB ALA B 146 -2.475 3.159 -9.706 1.00 0.00 C ATOM 0 H ALA B 146 -2.342 3.430 -7.208 1.00 0.00 H new ATOM 0 HA ALA B 146 -0.486 3.837 -9.381 1.00 0.00 H new ATOM 0 HB1 ALA B 146 -2.459 3.373 -10.775 1.00 0.00 H new ATOM 0 HB2 ALA B 146 -2.204 2.116 -9.541 1.00 0.00 H new ATOM 0 HB3 ALA B 146 -3.476 3.340 -9.315 1.00 0.00 H new ATOM 2013 N LEU B 147 -2.427 6.171 -8.312 1.00 0.00 N ATOM 2014 CA LEU B 147 -2.773 7.566 -8.424 1.00 0.00 C ATOM 2015 C LEU B 147 -1.533 8.456 -8.366 1.00 0.00 C ATOM 2016 O LEU B 147 -0.598 8.197 -7.607 1.00 0.00 O ATOM 2017 CB LEU B 147 -3.745 7.997 -7.319 1.00 0.00 C ATOM 2018 CG LEU B 147 -5.120 7.343 -7.319 1.00 0.00 C ATOM 2019 CD1 LEU B 147 -5.937 7.830 -6.137 1.00 0.00 C ATOM 2020 CD2 LEU B 147 -5.853 7.626 -8.617 1.00 0.00 C ATOM 0 H LEU B 147 -2.721 5.738 -7.436 1.00 0.00 H new ATOM 0 HA LEU B 147 -3.257 7.686 -9.393 1.00 0.00 H new ATOM 0 HB2 LEU B 147 -3.274 7.798 -6.356 1.00 0.00 H new ATOM 0 HB3 LEU B 147 -3.882 9.076 -7.390 1.00 0.00 H new ATOM 0 HG LEU B 147 -4.984 6.265 -7.231 1.00 0.00 H new ATOM 0 HD11 LEU B 147 -6.917 7.353 -6.151 1.00 0.00 H new ATOM 0 HD12 LEU B 147 -5.423 7.576 -5.210 1.00 0.00 H new ATOM 0 HD13 LEU B 147 -6.058 8.911 -6.200 1.00 0.00 H new ATOM 0 HD21 LEU B 147 -6.833 7.148 -8.593 1.00 0.00 H new ATOM 0 HD22 LEU B 147 -5.977 8.702 -8.738 1.00 0.00 H new ATOM 0 HD23 LEU B 147 -5.277 7.231 -9.454 1.00 0.00 H new ATOM 2032 N SER B 148 -1.529 9.487 -9.163 1.00 0.00 N ATOM 2033 CA SER B 148 -0.453 10.441 -9.176 1.00 0.00 C ATOM 2034 C SER B 148 -0.605 11.414 -7.988 1.00 0.00 C ATOM 2035 O SER B 148 -1.693 11.511 -7.391 1.00 0.00 O ATOM 2036 CB SER B 148 -0.514 11.192 -10.494 1.00 0.00 C ATOM 2037 OG SER B 148 -0.645 10.272 -11.566 1.00 0.00 O ATOM 0 H SER B 148 -2.276 9.692 -9.827 1.00 0.00 H new ATOM 0 HA SER B 148 0.510 9.940 -9.079 1.00 0.00 H new ATOM 0 HB2 SER B 148 -1.357 11.883 -10.491 1.00 0.00 H new ATOM 0 HB3 SER B 148 0.388 11.790 -10.624 1.00 0.00 H new ATOM 0 HG SER B 148 -0.686 10.761 -12.414 1.00 0.00 H new ATOM 2043 N GLN B 149 0.460 12.148 -7.668 1.00 0.00 N ATOM 2044 CA GLN B 149 0.459 13.100 -6.564 1.00 0.00 C ATOM 2045 C GLN B 149 -0.597 14.174 -6.805 1.00 0.00 C ATOM 2046 O GLN B 149 -1.220 14.674 -5.869 1.00 0.00 O ATOM 2047 CB GLN B 149 1.841 13.738 -6.415 1.00 0.00 C ATOM 2048 CG GLN B 149 1.988 14.632 -5.197 1.00 0.00 C ATOM 2049 CD GLN B 149 3.333 15.326 -5.146 1.00 0.00 C ATOM 2050 OE1 GLN B 149 4.334 14.797 -5.614 1.00 0.00 O ATOM 2051 NE2 GLN B 149 3.364 16.519 -4.621 1.00 0.00 N ATOM 0 H GLN B 149 1.347 12.097 -8.169 1.00 0.00 H new ATOM 0 HA GLN B 149 0.220 12.572 -5.641 1.00 0.00 H new ATOM 0 HB2 GLN B 149 2.590 12.947 -6.363 1.00 0.00 H new ATOM 0 HB3 GLN B 149 2.056 14.323 -7.309 1.00 0.00 H new ATOM 0 HG2 GLN B 149 1.196 15.381 -5.202 1.00 0.00 H new ATOM 0 HG3 GLN B 149 1.856 14.035 -4.294 1.00 0.00 H new ATOM 0 HE21 GLN B 149 2.512 16.931 -4.240 1.00 0.00 H new ATOM 0 HE22 GLN B 149 4.240 17.041 -4.591 1.00 0.00 H new ATOM 2060 N ASP B 150 -0.824 14.492 -8.073 1.00 0.00 N ATOM 2061 CA ASP B 150 -1.856 15.465 -8.461 1.00 0.00 C ATOM 2062 C ASP B 150 -3.223 14.996 -8.037 1.00 0.00 C ATOM 2063 O ASP B 150 -4.021 15.774 -7.516 1.00 0.00 O ATOM 2064 CB ASP B 150 -1.881 15.720 -9.966 1.00 0.00 C ATOM 2065 CG ASP B 150 -0.716 16.510 -10.465 1.00 0.00 C ATOM 2066 OD1 ASP B 150 -0.709 17.740 -10.301 1.00 0.00 O ATOM 2067 OD2 ASP B 150 0.208 15.926 -11.056 1.00 0.00 O ATOM 0 H ASP B 150 -0.309 14.093 -8.858 1.00 0.00 H new ATOM 0 HA ASP B 150 -1.600 16.395 -7.953 1.00 0.00 H new ATOM 0 HB2 ASP B 150 -1.908 14.763 -10.486 1.00 0.00 H new ATOM 0 HB3 ASP B 150 -2.801 16.247 -10.220 1.00 0.00 H new ATOM 2072 N GLU B 151 -3.469 13.707 -8.203 1.00 0.00 N ATOM 2073 CA GLU B 151 -4.749 13.121 -7.883 1.00 0.00 C ATOM 2074 C GLU B 151 -4.938 13.160 -6.390 1.00 0.00 C ATOM 2075 O GLU B 151 -6.008 13.489 -5.898 1.00 0.00 O ATOM 2076 CB GLU B 151 -4.819 11.683 -8.392 1.00 0.00 C ATOM 2077 CG GLU B 151 -4.480 11.533 -9.869 1.00 0.00 C ATOM 2078 CD GLU B 151 -5.327 12.407 -10.757 1.00 0.00 C ATOM 2079 OE1 GLU B 151 -6.462 12.029 -11.079 1.00 0.00 O ATOM 2080 OE2 GLU B 151 -4.865 13.493 -11.163 1.00 0.00 O ATOM 0 H GLU B 151 -2.784 13.042 -8.563 1.00 0.00 H new ATOM 0 HA GLU B 151 -5.544 13.688 -8.368 1.00 0.00 H new ATOM 0 HB2 GLU B 151 -4.134 11.068 -7.808 1.00 0.00 H new ATOM 0 HB3 GLU B 151 -5.823 11.295 -8.219 1.00 0.00 H new ATOM 0 HG2 GLU B 151 -3.429 11.778 -10.022 1.00 0.00 H new ATOM 0 HG3 GLU B 151 -4.610 10.491 -10.162 1.00 0.00 H new ATOM 2087 N LEU B 152 -3.863 12.882 -5.670 1.00 0.00 N ATOM 2088 CA LEU B 152 -3.880 12.941 -4.226 1.00 0.00 C ATOM 2089 C LEU B 152 -4.158 14.364 -3.778 1.00 0.00 C ATOM 2090 O LEU B 152 -4.958 14.584 -2.912 1.00 0.00 O ATOM 2091 CB LEU B 152 -2.560 12.449 -3.631 1.00 0.00 C ATOM 2092 CG LEU B 152 -2.141 11.028 -3.988 1.00 0.00 C ATOM 2093 CD1 LEU B 152 -0.834 10.668 -3.313 1.00 0.00 C ATOM 2094 CD2 LEU B 152 -3.237 10.030 -3.642 1.00 0.00 C ATOM 0 H LEU B 152 -2.964 12.612 -6.070 1.00 0.00 H new ATOM 0 HA LEU B 152 -4.671 12.283 -3.866 1.00 0.00 H new ATOM 0 HB2 LEU B 152 -1.769 13.128 -3.948 1.00 0.00 H new ATOM 0 HB3 LEU B 152 -2.627 12.523 -2.546 1.00 0.00 H new ATOM 0 HG LEU B 152 -1.984 10.982 -5.066 1.00 0.00 H new ATOM 0 HD11 LEU B 152 -0.554 9.649 -3.582 1.00 0.00 H new ATOM 0 HD12 LEU B 152 -0.054 11.357 -3.639 1.00 0.00 H new ATOM 0 HD13 LEU B 152 -0.951 10.738 -2.232 1.00 0.00 H new ATOM 0 HD21 LEU B 152 -2.911 9.025 -3.908 1.00 0.00 H new ATOM 0 HD22 LEU B 152 -3.445 10.074 -2.573 1.00 0.00 H new ATOM 0 HD23 LEU B 152 -4.142 10.276 -4.198 1.00 0.00 H new ATOM 2106 N THR B 153 -3.530 15.323 -4.422 1.00 0.00 N ATOM 2107 CA THR B 153 -3.738 16.728 -4.100 1.00 0.00 C ATOM 2108 C THR B 153 -5.197 17.134 -4.398 1.00 0.00 C ATOM 2109 O THR B 153 -5.761 17.965 -3.723 1.00 0.00 O ATOM 2110 CB THR B 153 -2.766 17.643 -4.873 1.00 0.00 C ATOM 2111 OG1 THR B 153 -1.431 17.118 -4.763 1.00 0.00 O ATOM 2112 CG2 THR B 153 -2.768 19.040 -4.279 1.00 0.00 C ATOM 0 H THR B 153 -2.865 15.159 -5.178 1.00 0.00 H new ATOM 0 HA THR B 153 -3.538 16.854 -3.036 1.00 0.00 H new ATOM 0 HB THR B 153 -3.085 17.684 -5.915 1.00 0.00 H new ATOM 0 HG1 THR B 153 -1.324 16.365 -5.381 1.00 0.00 H new ATOM 0 HG21 THR B 153 -2.077 19.673 -4.836 1.00 0.00 H new ATOM 0 HG22 THR B 153 -3.772 19.459 -4.338 1.00 0.00 H new ATOM 0 HG23 THR B 153 -2.456 18.992 -3.236 1.00 0.00 H new ATOM 2120 N SER B 154 -5.786 16.510 -5.387 1.00 0.00 N ATOM 2121 CA SER B 154 -7.165 16.787 -5.751 1.00 0.00 C ATOM 2122 C SER B 154 -8.111 16.215 -4.664 1.00 0.00 C ATOM 2123 O SER B 154 -9.042 16.892 -4.198 1.00 0.00 O ATOM 2124 CB SER B 154 -7.472 16.183 -7.145 1.00 0.00 C ATOM 2125 OG SER B 154 -8.755 16.548 -7.623 1.00 0.00 O ATOM 0 H SER B 154 -5.333 15.800 -5.962 1.00 0.00 H new ATOM 0 HA SER B 154 -7.325 17.864 -5.810 1.00 0.00 H new ATOM 0 HB2 SER B 154 -6.715 16.514 -7.856 1.00 0.00 H new ATOM 0 HB3 SER B 154 -7.404 15.097 -7.090 1.00 0.00 H new ATOM 0 HG SER B 154 -8.902 16.146 -8.504 1.00 0.00 H new ATOM 2131 N ILE B 155 -7.830 14.994 -4.236 1.00 0.00 N ATOM 2132 CA ILE B 155 -8.633 14.297 -3.235 1.00 0.00 C ATOM 2133 C ILE B 155 -8.391 14.858 -1.827 1.00 0.00 C ATOM 2134 O ILE B 155 -9.332 15.222 -1.125 1.00 0.00 O ATOM 2135 CB ILE B 155 -8.304 12.779 -3.242 1.00 0.00 C ATOM 2136 CG1 ILE B 155 -8.615 12.173 -4.620 1.00 0.00 C ATOM 2137 CG2 ILE B 155 -9.089 12.046 -2.150 1.00 0.00 C ATOM 2138 CD1 ILE B 155 -8.057 10.775 -4.824 1.00 0.00 C ATOM 0 H ILE B 155 -7.034 14.453 -4.574 1.00 0.00 H new ATOM 0 HA ILE B 155 -9.681 14.450 -3.494 1.00 0.00 H new ATOM 0 HB ILE B 155 -7.240 12.659 -3.037 1.00 0.00 H new ATOM 0 HG12 ILE B 155 -9.696 12.144 -4.757 1.00 0.00 H new ATOM 0 HG13 ILE B 155 -8.213 12.829 -5.392 1.00 0.00 H new ATOM 0 HG21 ILE B 155 -8.842 10.985 -2.175 1.00 0.00 H new ATOM 0 HG22 ILE B 155 -8.827 12.457 -1.175 1.00 0.00 H new ATOM 0 HG23 ILE B 155 -10.158 12.174 -2.322 1.00 0.00 H new ATOM 0 HD11 ILE B 155 -8.320 10.420 -5.820 1.00 0.00 H new ATOM 0 HD12 ILE B 155 -6.972 10.798 -4.722 1.00 0.00 H new ATOM 0 HD13 ILE B 155 -8.478 10.103 -4.076 1.00 0.00 H new ATOM 2150 N LEU B 156 -7.135 14.933 -1.435 1.00 0.00 N ATOM 2151 CA LEU B 156 -6.778 15.357 -0.092 1.00 0.00 C ATOM 2152 C LEU B 156 -6.899 16.866 0.021 1.00 0.00 C ATOM 2153 O LEU B 156 -7.215 17.402 1.080 1.00 0.00 O ATOM 2154 CB LEU B 156 -5.340 14.933 0.267 1.00 0.00 C ATOM 2155 CG LEU B 156 -4.869 13.519 -0.153 1.00 0.00 C ATOM 2156 CD1 LEU B 156 -3.515 13.244 0.419 1.00 0.00 C ATOM 2157 CD2 LEU B 156 -5.832 12.423 0.250 1.00 0.00 C ATOM 0 H LEU B 156 -6.339 14.705 -2.030 1.00 0.00 H new ATOM 0 HA LEU B 156 -7.464 14.875 0.605 1.00 0.00 H new ATOM 0 HB2 LEU B 156 -4.658 15.657 -0.178 1.00 0.00 H new ATOM 0 HB3 LEU B 156 -5.229 15.014 1.348 1.00 0.00 H new ATOM 0 HG LEU B 156 -4.828 13.513 -1.242 1.00 0.00 H new ATOM 0 HD11 LEU B 156 -3.189 12.248 0.120 1.00 0.00 H new ATOM 0 HD12 LEU B 156 -2.806 13.984 0.048 1.00 0.00 H new ATOM 0 HD13 LEU B 156 -3.561 13.299 1.507 1.00 0.00 H new ATOM 0 HD21 LEU B 156 -5.442 11.458 -0.074 1.00 0.00 H new ATOM 0 HD22 LEU B 156 -5.949 12.421 1.334 1.00 0.00 H new ATOM 0 HD23 LEU B 156 -6.800 12.599 -0.219 1.00 0.00 H new ATOM 2169 N GLY B 157 -6.615 17.538 -1.069 1.00 0.00 N ATOM 2170 CA GLY B 157 -6.731 18.976 -1.137 1.00 0.00 C ATOM 2171 C GLY B 157 -5.474 19.699 -0.761 1.00 0.00 C ATOM 2172 O GLY B 157 -5.376 20.906 -0.956 1.00 0.00 O ATOM 0 H GLY B 157 -6.297 17.103 -1.935 1.00 0.00 H new ATOM 0 HA2 GLY B 157 -7.015 19.261 -2.150 1.00 0.00 H new ATOM 0 HA3 GLY B 157 -7.537 19.298 -0.477 1.00 0.00 H new ATOM 2176 N ASN B 158 -4.498 18.981 -0.257 1.00 0.00 N ATOM 2177 CA ASN B 158 -3.276 19.619 0.201 1.00 0.00 C ATOM 2178 C ASN B 158 -2.103 18.889 -0.353 1.00 0.00 C ATOM 2179 O ASN B 158 -2.003 17.650 -0.208 1.00 0.00 O ATOM 2180 CB ASN B 158 -3.148 19.612 1.736 1.00 0.00 C ATOM 2181 CG ASN B 158 -4.446 19.376 2.450 1.00 0.00 C ATOM 2182 OD1 ASN B 158 -4.675 18.143 2.806 1.00 0.00 O flip ATOM 2183 ND2 ASN B 158 -5.213 20.295 2.712 1.00 0.00 N flip ATOM 0 H ASN B 158 -4.520 17.967 -0.152 1.00 0.00 H new ATOM 0 HA ASN B 158 -3.309 20.653 -0.141 1.00 0.00 H new ATOM 0 HB2 ASN B 158 -2.437 18.839 2.029 1.00 0.00 H new ATOM 0 HB3 ASN B 158 -2.733 20.566 2.061 1.00 0.00 H new ATOM 0 HD21 ASN B 158 -4.992 21.245 2.413 1.00 0.00 H new ATOM 0 HD22 ASN B 158 -6.072 20.110 3.229 1.00 0.00 H new ATOM 2190 N ALA B 159 -1.199 19.632 -0.943 1.00 0.00 N ATOM 2191 CA ALA B 159 0.017 19.105 -1.518 1.00 0.00 C ATOM 2192 C ALA B 159 0.896 18.500 -0.448 1.00 0.00 C ATOM 2193 O ALA B 159 1.662 17.611 -0.722 1.00 0.00 O ATOM 2194 CB ALA B 159 0.780 20.192 -2.246 1.00 0.00 C ATOM 0 H ALA B 159 -1.289 20.643 -1.040 1.00 0.00 H new ATOM 0 HA ALA B 159 -0.261 18.328 -2.230 1.00 0.00 H new ATOM 0 HB1 ALA B 159 1.692 19.774 -2.671 1.00 0.00 H new ATOM 0 HB2 ALA B 159 0.160 20.599 -3.045 1.00 0.00 H new ATOM 0 HB3 ALA B 159 1.037 20.987 -1.546 1.00 0.00 H new ATOM 2200 N ALA B 160 0.749 18.970 0.781 1.00 0.00 N ATOM 2201 CA ALA B 160 1.526 18.459 1.896 1.00 0.00 C ATOM 2202 C ALA B 160 1.185 17.018 2.112 1.00 0.00 C ATOM 2203 O ALA B 160 2.043 16.176 2.189 1.00 0.00 O ATOM 2204 CB ALA B 160 1.232 19.233 3.162 1.00 0.00 C ATOM 0 H ALA B 160 0.093 19.710 1.031 1.00 0.00 H new ATOM 0 HA ALA B 160 2.585 18.569 1.660 1.00 0.00 H new ATOM 0 HB1 ALA B 160 1.827 18.830 3.981 1.00 0.00 H new ATOM 0 HB2 ALA B 160 1.484 20.283 3.013 1.00 0.00 H new ATOM 0 HB3 ALA B 160 0.173 19.145 3.405 1.00 0.00 H new ATOM 2210 N ASN B 161 -0.088 16.749 2.138 1.00 0.00 N ATOM 2211 CA ASN B 161 -0.598 15.415 2.375 1.00 0.00 C ATOM 2212 C ASN B 161 -0.280 14.523 1.184 1.00 0.00 C ATOM 2213 O ASN B 161 0.151 13.389 1.335 1.00 0.00 O ATOM 2214 CB ASN B 161 -2.113 15.469 2.580 1.00 0.00 C ATOM 2215 CG ASN B 161 -2.602 16.062 3.905 1.00 0.00 C ATOM 2216 OD1 ASN B 161 -3.692 15.773 4.332 1.00 0.00 O ATOM 2217 ND2 ASN B 161 -1.823 16.862 4.552 1.00 0.00 N ATOM 0 H ASN B 161 -0.814 17.451 1.995 1.00 0.00 H new ATOM 0 HA ASN B 161 -0.126 15.007 3.269 1.00 0.00 H new ATOM 0 HB2 ASN B 161 -2.547 16.049 1.766 1.00 0.00 H new ATOM 0 HB3 ASN B 161 -2.505 14.456 2.494 1.00 0.00 H new ATOM 0 HD21 ASN B 161 -2.126 17.261 5.440 1.00 0.00 H new ATOM 0 HD22 ASN B 161 -0.904 17.095 4.175 1.00 0.00 H new ATOM 2224 N ALA B 162 -0.446 15.084 0.000 1.00 0.00 N ATOM 2225 CA ALA B 162 -0.245 14.370 -1.252 1.00 0.00 C ATOM 2226 C ALA B 162 1.213 14.017 -1.473 1.00 0.00 C ATOM 2227 O ALA B 162 1.520 12.938 -1.961 1.00 0.00 O ATOM 2228 CB ALA B 162 -0.741 15.224 -2.396 1.00 0.00 C ATOM 0 H ALA B 162 -0.727 16.057 -0.123 1.00 0.00 H new ATOM 0 HA ALA B 162 -0.806 13.437 -1.204 1.00 0.00 H new ATOM 0 HB1 ALA B 162 -0.593 14.694 -3.337 1.00 0.00 H new ATOM 0 HB2 ALA B 162 -1.802 15.433 -2.261 1.00 0.00 H new ATOM 0 HB3 ALA B 162 -0.186 16.162 -2.417 1.00 0.00 H new ATOM 2234 N LYS B 163 2.105 14.909 -1.085 1.00 0.00 N ATOM 2235 CA LYS B 163 3.511 14.715 -1.311 1.00 0.00 C ATOM 2236 C LYS B 163 4.019 13.690 -0.348 1.00 0.00 C ATOM 2237 O LYS B 163 4.779 12.819 -0.723 1.00 0.00 O ATOM 2238 CB LYS B 163 4.275 16.041 -1.173 1.00 0.00 C ATOM 2239 CG LYS B 163 5.778 15.941 -1.424 1.00 0.00 C ATOM 2240 CD LYS B 163 6.470 17.283 -1.229 1.00 0.00 C ATOM 2241 CE LYS B 163 7.957 17.221 -1.594 1.00 0.00 C ATOM 2242 NZ LYS B 163 8.707 16.216 -0.805 1.00 0.00 N ATOM 0 H LYS B 163 1.870 15.780 -0.608 1.00 0.00 H new ATOM 0 HA LYS B 163 3.672 14.358 -2.328 1.00 0.00 H new ATOM 0 HB2 LYS B 163 3.851 16.763 -1.871 1.00 0.00 H new ATOM 0 HB3 LYS B 163 4.113 16.435 -0.170 1.00 0.00 H new ATOM 0 HG2 LYS B 163 6.212 15.205 -0.747 1.00 0.00 H new ATOM 0 HG3 LYS B 163 5.955 15.584 -2.439 1.00 0.00 H new ATOM 0 HD2 LYS B 163 5.977 18.037 -1.842 1.00 0.00 H new ATOM 0 HD3 LYS B 163 6.364 17.598 -0.191 1.00 0.00 H new ATOM 0 HE2 LYS B 163 8.055 16.989 -2.654 1.00 0.00 H new ATOM 0 HE3 LYS B 163 8.404 18.203 -1.440 1.00 0.00 H new ATOM 0 HZ1 LYS B 163 9.719 16.279 -1.035 1.00 0.00 H new ATOM 0 HZ2 LYS B 163 8.571 16.399 0.210 1.00 0.00 H new ATOM 0 HZ3 LYS B 163 8.358 15.264 -1.035 1.00 0.00 H new ATOM 2256 N GLN B 164 3.539 13.777 0.894 1.00 0.00 N ATOM 2257 CA GLN B 164 3.898 12.824 1.928 1.00 0.00 C ATOM 2258 C GLN B 164 3.521 11.417 1.516 1.00 0.00 C ATOM 2259 O GLN B 164 4.323 10.484 1.624 1.00 0.00 O ATOM 2260 CB GLN B 164 3.221 13.167 3.248 1.00 0.00 C ATOM 2261 CG GLN B 164 3.708 14.423 3.902 1.00 0.00 C ATOM 2262 CD GLN B 164 3.101 14.581 5.273 1.00 0.00 C ATOM 2263 OE1 GLN B 164 3.647 14.124 6.268 1.00 0.00 O ATOM 2264 NE2 GLN B 164 1.964 15.208 5.328 1.00 0.00 N ATOM 0 H GLN B 164 2.896 14.506 1.203 1.00 0.00 H new ATOM 0 HA GLN B 164 4.978 12.879 2.063 1.00 0.00 H new ATOM 0 HB2 GLN B 164 2.148 13.257 3.076 1.00 0.00 H new ATOM 0 HB3 GLN B 164 3.364 12.336 3.939 1.00 0.00 H new ATOM 0 HG2 GLN B 164 4.795 14.400 3.981 1.00 0.00 H new ATOM 0 HG3 GLN B 164 3.451 15.284 3.284 1.00 0.00 H new ATOM 0 HE21 GLN B 164 1.542 15.574 4.475 1.00 0.00 H new ATOM 0 HE22 GLN B 164 1.494 15.334 6.224 1.00 0.00 H new ATOM 2273 N LEU B 165 2.324 11.285 1.004 1.00 0.00 N ATOM 2274 CA LEU B 165 1.811 10.009 0.613 1.00 0.00 C ATOM 2275 C LEU B 165 2.506 9.484 -0.648 1.00 0.00 C ATOM 2276 O LEU B 165 3.016 8.363 -0.645 1.00 0.00 O ATOM 2277 CB LEU B 165 0.295 10.083 0.441 1.00 0.00 C ATOM 2278 CG LEU B 165 -0.413 8.772 0.116 1.00 0.00 C ATOM 2279 CD1 LEU B 165 -0.095 7.720 1.166 1.00 0.00 C ATOM 2280 CD2 LEU B 165 -1.910 8.996 0.037 1.00 0.00 C ATOM 0 H LEU B 165 1.682 12.063 0.849 1.00 0.00 H new ATOM 0 HA LEU B 165 2.027 9.293 1.406 1.00 0.00 H new ATOM 0 HB2 LEU B 165 -0.134 10.485 1.359 1.00 0.00 H new ATOM 0 HB3 LEU B 165 0.075 10.797 -0.353 1.00 0.00 H new ATOM 0 HG LEU B 165 -0.057 8.414 -0.850 1.00 0.00 H new ATOM 0 HD11 LEU B 165 -0.609 6.791 0.918 1.00 0.00 H new ATOM 0 HD12 LEU B 165 0.980 7.544 1.191 1.00 0.00 H new ATOM 0 HD13 LEU B 165 -0.428 8.069 2.143 1.00 0.00 H new ATOM 0 HD21 LEU B 165 -2.407 8.054 -0.196 1.00 0.00 H new ATOM 0 HD22 LEU B 165 -2.273 9.371 0.994 1.00 0.00 H new ATOM 0 HD23 LEU B 165 -2.128 9.724 -0.744 1.00 0.00 H new ATOM 2292 N TYR B 166 2.572 10.310 -1.701 1.00 0.00 N ATOM 2293 CA TYR B 166 3.182 9.905 -2.977 1.00 0.00 C ATOM 2294 C TYR B 166 4.635 9.476 -2.779 1.00 0.00 C ATOM 2295 O TYR B 166 5.101 8.465 -3.374 1.00 0.00 O ATOM 2296 CB TYR B 166 3.096 11.059 -3.992 1.00 0.00 C ATOM 2297 CG TYR B 166 3.614 10.741 -5.386 1.00 0.00 C ATOM 2298 CD1 TYR B 166 2.798 10.120 -6.317 1.00 0.00 C ATOM 2299 CD2 TYR B 166 4.911 11.073 -5.769 1.00 0.00 C ATOM 2300 CE1 TYR B 166 3.252 9.834 -7.588 1.00 0.00 C ATOM 2301 CE2 TYR B 166 5.374 10.787 -7.039 1.00 0.00 C ATOM 2302 CZ TYR B 166 4.541 10.167 -7.946 1.00 0.00 C ATOM 2303 OH TYR B 166 5.002 9.869 -9.214 1.00 0.00 O ATOM 0 H TYR B 166 2.210 11.264 -1.695 1.00 0.00 H new ATOM 0 HA TYR B 166 2.630 9.049 -3.365 1.00 0.00 H new ATOM 0 HB2 TYR B 166 2.055 11.373 -4.072 1.00 0.00 H new ATOM 0 HB3 TYR B 166 3.656 11.908 -3.600 1.00 0.00 H new ATOM 0 HD1 TYR B 166 1.788 9.855 -6.043 1.00 0.00 H new ATOM 0 HD2 TYR B 166 5.565 11.562 -5.062 1.00 0.00 H new ATOM 0 HE1 TYR B 166 2.600 9.351 -8.300 1.00 0.00 H new ATOM 0 HE2 TYR B 166 6.384 11.048 -7.320 1.00 0.00 H new ATOM 0 HH TYR B 166 5.930 10.171 -9.304 1.00 0.00 H new ATOM 2313 N ASP B 167 5.325 10.222 -1.935 1.00 0.00 N ATOM 2314 CA ASP B 167 6.720 9.974 -1.608 1.00 0.00 C ATOM 2315 C ASP B 167 6.852 8.627 -0.934 1.00 0.00 C ATOM 2316 O ASP B 167 7.670 7.814 -1.338 1.00 0.00 O ATOM 2317 CB ASP B 167 7.247 11.077 -0.680 1.00 0.00 C ATOM 2318 CG ASP B 167 8.730 11.008 -0.413 1.00 0.00 C ATOM 2319 OD1 ASP B 167 9.513 11.589 -1.198 1.00 0.00 O ATOM 2320 OD2 ASP B 167 9.148 10.439 0.611 1.00 0.00 O ATOM 0 H ASP B 167 4.928 11.027 -1.451 1.00 0.00 H new ATOM 0 HA ASP B 167 7.308 9.976 -2.526 1.00 0.00 H new ATOM 0 HB2 ASP B 167 7.014 12.047 -1.119 1.00 0.00 H new ATOM 0 HB3 ASP B 167 6.716 11.021 0.270 1.00 0.00 H new ATOM 2325 N PHE B 168 5.990 8.370 0.049 1.00 0.00 N ATOM 2326 CA PHE B 168 6.018 7.126 0.807 1.00 0.00 C ATOM 2327 C PHE B 168 5.762 5.925 -0.110 1.00 0.00 C ATOM 2328 O PHE B 168 6.489 4.948 -0.063 1.00 0.00 O ATOM 2329 CB PHE B 168 4.987 7.186 1.943 1.00 0.00 C ATOM 2330 CG PHE B 168 4.978 5.986 2.854 1.00 0.00 C ATOM 2331 CD1 PHE B 168 6.052 5.727 3.694 1.00 0.00 C ATOM 2332 CD2 PHE B 168 3.888 5.131 2.891 1.00 0.00 C ATOM 2333 CE1 PHE B 168 6.041 4.640 4.545 1.00 0.00 C ATOM 2334 CE2 PHE B 168 3.872 4.041 3.741 1.00 0.00 C ATOM 2335 CZ PHE B 168 4.949 3.796 4.568 1.00 0.00 C ATOM 0 H PHE B 168 5.257 9.017 0.339 1.00 0.00 H new ATOM 0 HA PHE B 168 7.008 7.000 1.244 1.00 0.00 H new ATOM 0 HB2 PHE B 168 5.178 8.077 2.541 1.00 0.00 H new ATOM 0 HB3 PHE B 168 3.994 7.301 1.508 1.00 0.00 H new ATOM 0 HD1 PHE B 168 6.908 6.385 3.682 1.00 0.00 H new ATOM 0 HD2 PHE B 168 3.041 5.319 2.248 1.00 0.00 H new ATOM 0 HE1 PHE B 168 6.885 4.450 5.191 1.00 0.00 H new ATOM 0 HE2 PHE B 168 3.017 3.381 3.758 1.00 0.00 H new ATOM 0 HZ PHE B 168 4.938 2.945 5.233 1.00 0.00 H new ATOM 2345 N ILE B 169 4.754 6.060 -0.972 1.00 0.00 N ATOM 2346 CA ILE B 169 4.343 5.036 -1.959 1.00 0.00 C ATOM 2347 C ILE B 169 5.500 4.633 -2.903 1.00 0.00 C ATOM 2348 O ILE B 169 5.574 3.473 -3.411 1.00 0.00 O ATOM 2349 CB ILE B 169 3.143 5.576 -2.804 1.00 0.00 C ATOM 2350 CG1 ILE B 169 1.909 5.774 -1.922 1.00 0.00 C ATOM 2351 CG2 ILE B 169 2.819 4.659 -3.974 1.00 0.00 C ATOM 2352 CD1 ILE B 169 0.772 6.476 -2.626 1.00 0.00 C ATOM 0 H ILE B 169 4.180 6.902 -1.012 1.00 0.00 H new ATOM 0 HA ILE B 169 4.047 4.146 -1.404 1.00 0.00 H new ATOM 0 HB ILE B 169 3.440 6.541 -3.214 1.00 0.00 H new ATOM 0 HG12 ILE B 169 1.563 4.802 -1.571 1.00 0.00 H new ATOM 0 HG13 ILE B 169 2.191 6.350 -1.040 1.00 0.00 H new ATOM 0 HG21 ILE B 169 1.980 5.069 -4.536 1.00 0.00 H new ATOM 0 HG22 ILE B 169 3.689 4.580 -4.626 1.00 0.00 H new ATOM 0 HG23 ILE B 169 2.556 3.670 -3.599 1.00 0.00 H new ATOM 0 HD11 ILE B 169 -0.069 6.582 -1.941 1.00 0.00 H new ATOM 0 HD12 ILE B 169 1.100 7.462 -2.953 1.00 0.00 H new ATOM 0 HD13 ILE B 169 0.463 5.890 -3.492 1.00 0.00 H new ATOM 2364 N HIS B 170 6.358 5.585 -3.182 1.00 0.00 N ATOM 2365 CA HIS B 170 7.475 5.361 -4.090 1.00 0.00 C ATOM 2366 C HIS B 170 8.832 5.161 -3.404 1.00 0.00 C ATOM 2367 O HIS B 170 9.810 4.815 -4.067 1.00 0.00 O ATOM 2368 CB HIS B 170 7.545 6.468 -5.131 1.00 0.00 C ATOM 2369 CG HIS B 170 6.439 6.395 -6.118 1.00 0.00 C ATOM 2370 ND1 HIS B 170 5.277 7.111 -6.007 1.00 0.00 N ATOM 2371 CD2 HIS B 170 6.313 5.649 -7.229 1.00 0.00 C ATOM 2372 CE1 HIS B 170 4.486 6.801 -7.017 1.00 0.00 C ATOM 2373 NE2 HIS B 170 5.089 5.918 -7.768 1.00 0.00 N ATOM 0 H HIS B 170 6.310 6.528 -2.796 1.00 0.00 H new ATOM 0 HA HIS B 170 7.267 4.409 -4.579 1.00 0.00 H new ATOM 0 HB2 HIS B 170 7.516 7.435 -4.630 1.00 0.00 H new ATOM 0 HB3 HIS B 170 8.499 6.409 -5.655 1.00 0.00 H new ATOM 0 HD1 HIS B 170 5.058 7.776 -5.265 1.00 0.00 H new ATOM 0 HD2 HIS B 170 7.047 4.962 -7.623 1.00 0.00 H new ATOM 0 HE1 HIS B 170 3.502 7.210 -7.194 1.00 0.00 H new ATOM 2382 N THR B 171 8.895 5.334 -2.113 1.00 0.00 N ATOM 2383 CA THR B 171 10.150 5.192 -1.398 1.00 0.00 C ATOM 2384 C THR B 171 10.436 3.736 -1.074 1.00 0.00 C ATOM 2385 O THR B 171 9.821 3.181 -0.189 1.00 0.00 O ATOM 2386 CB THR B 171 10.155 6.030 -0.089 1.00 0.00 C ATOM 2387 OG1 THR B 171 10.104 7.426 -0.404 1.00 0.00 O ATOM 2388 CG2 THR B 171 11.384 5.745 0.781 1.00 0.00 C ATOM 0 H THR B 171 8.096 5.574 -1.527 1.00 0.00 H new ATOM 0 HA THR B 171 10.935 5.567 -2.054 1.00 0.00 H new ATOM 0 HB THR B 171 9.273 5.741 0.483 1.00 0.00 H new ATOM 0 HG1 THR B 171 9.318 7.607 -0.961 1.00 0.00 H new ATOM 0 HG21 THR B 171 11.340 6.355 1.683 1.00 0.00 H new ATOM 0 HG22 THR B 171 11.398 4.690 1.056 1.00 0.00 H new ATOM 0 HG23 THR B 171 12.289 5.987 0.223 1.00 0.00 H new ATOM 2396 N SER B 172 11.352 3.121 -1.822 1.00 0.00 N ATOM 2397 CA SER B 172 11.776 1.754 -1.549 1.00 0.00 C ATOM 2398 C SER B 172 12.172 1.591 -0.076 1.00 0.00 C ATOM 2399 O SER B 172 12.716 2.527 0.551 1.00 0.00 O ATOM 2400 CB SER B 172 12.956 1.345 -2.454 1.00 0.00 C ATOM 2401 OG SER B 172 13.516 0.115 -2.034 1.00 0.00 O ATOM 0 H SER B 172 11.814 3.552 -2.623 1.00 0.00 H new ATOM 0 HA SER B 172 10.931 1.100 -1.764 1.00 0.00 H new ATOM 0 HB2 SER B 172 12.615 1.260 -3.486 1.00 0.00 H new ATOM 0 HB3 SER B 172 13.720 2.122 -2.434 1.00 0.00 H new ATOM 0 HG SER B 172 14.261 -0.124 -2.624 1.00 0.00 H new ATOM 2407 N PHE B 173 11.930 0.409 0.451 1.00 0.00 N ATOM 2408 CA PHE B 173 12.201 0.078 1.860 1.00 0.00 C ATOM 2409 C PHE B 173 13.693 0.289 2.189 1.00 0.00 C ATOM 2410 O PHE B 173 14.060 0.583 3.339 1.00 0.00 O ATOM 2411 CB PHE B 173 11.816 -1.392 2.134 1.00 0.00 C ATOM 2412 CG PHE B 173 10.549 -1.821 1.433 1.00 0.00 C ATOM 2413 CD1 PHE B 173 9.291 -1.512 1.933 1.00 0.00 C ATOM 2414 CD2 PHE B 173 10.632 -2.509 0.238 1.00 0.00 C ATOM 2415 CE1 PHE B 173 8.159 -1.884 1.246 1.00 0.00 C ATOM 2416 CE2 PHE B 173 9.507 -2.878 -0.446 1.00 0.00 C ATOM 2417 CZ PHE B 173 8.267 -2.565 0.050 1.00 0.00 C ATOM 0 H PHE B 173 11.535 -0.367 -0.081 1.00 0.00 H new ATOM 0 HA PHE B 173 11.605 0.737 2.492 1.00 0.00 H new ATOM 0 HB2 PHE B 173 12.634 -2.039 1.818 1.00 0.00 H new ATOM 0 HB3 PHE B 173 11.694 -1.534 3.208 1.00 0.00 H new ATOM 0 HD1 PHE B 173 9.201 -0.977 2.867 1.00 0.00 H new ATOM 0 HD2 PHE B 173 11.603 -2.760 -0.163 1.00 0.00 H new ATOM 0 HE1 PHE B 173 7.184 -1.643 1.643 1.00 0.00 H new ATOM 0 HE2 PHE B 173 9.595 -3.417 -1.378 1.00 0.00 H new ATOM 0 HZ PHE B 173 7.378 -2.850 -0.493 1.00 0.00 H new