USER MOD reduce.3.24.130724 H: found=0, std=0, add=1076, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1066 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 104 CYS SG : rot -97:sc= 0.683 USER MOD Set 1.2: A 105 CYS SG : rot 63:sc= -0.0372 USER MOD Set 1.3: A 108 CYS SG : rot -10:sc= 0.576 USER MOD Set 1.4: A 120 CYS SG : rot -121:sc= -0.311 USER MOD Set 1.5: A 122 CYS SG : rot 84:sc= 1.14 USER MOD Set 1.6: A 145 CYS SG : rot -135:sc= 1.01 USER MOD Set 1.7: A 147 HIS : no HD1:sc= -0.91 K(o=2.1,f=4.8) USER MOD Set 1.8: A 148 CYS SG : rot -39:sc= -1.3 USER MOD Set 1.9: A 150 CYS SG : rot -147:sc= -0.0641 USER MOD Set 1.10: A 153 CYS SG : rot 25:sc= 1.34 USER MOD Set 2.1: A 141 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 143 HIS : no HD1:sc= -1.84 K(o=-1.8,f=-0.87) USER MOD Set 3.1: A 94 LYS NZ :NH3+ 169:sc= 1.16 (180deg=0.000614) USER MOD Set 3.2: A 100 TYR OH : rot 150:sc= 0.984 USER MOD Set 4.1: A 67 TYR OH : rot 180:sc= 1.08 USER MOD Set 4.2: A 75 LYS NZ :NH3+ -143:sc= 1.25 (180deg=0) USER MOD Set 5.1: A 22 THR OG1 : rot 180:sc= 0 USER MOD Set 5.2: A 62 TYR OH : rot 180:sc= -2.42! USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 85:sc= 0.644 USER MOD Single : A 29 GLN : amide:sc= -2.8! C(o=-2.8!,f=-5.1!) USER MOD Single : A 34 GLN : amide:sc= -0.0258 X(o=-0.026,f=0) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 SER OG : rot 30:sc= 0.131 USER MOD Single : A 46 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 GLN : amide:sc= -0.254 X(o=-0.25,f=-0.27) USER MOD Single : A 53 MET CE :methyl 156:sc= -4.29 (180deg=-4.75!) USER MOD Single : A 54 GLN : amide:sc= -0.13 K(o=-0.13,f=-1.3!) USER MOD Single : A 56 HIS : no HE2:sc= -6.35! C(o=-6.3!,f=-16!) USER MOD Single : A 57 HIS : no HD1:sc= -6.11! C(o=-6.1!,f=-7.7!) USER MOD Single : A 58 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 60 SER OG : rot 0:sc= 0.26 USER MOD Single : A 64 TYR OH : rot 180:sc= 0.0968 USER MOD Single : A 65 THR OG1 : rot 95:sc= 0.499 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ -174:sc=-0.00816 (180deg=-0.049) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 TYR OH : rot 85:sc= 1.18 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 GLN : amide:sc= -0.0136 X(o=-0.014,f=-0.069) USER MOD Single : A 119 THR OG1 : rot -59:sc= 1.14 USER MOD Single : A 128 GLN : amide:sc= -0.0606 X(o=-0.061,f=0) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 THR OG1 : rot 180:sc= 0.0155 USER MOD Single : A 139 GLN : amide:sc= -2.42 K(o=-2.4,f=-8.2!) USER MOD Single : A 144 GLN : amide:sc= -2.15 K(o=-2.2,f=-5.3!) USER MOD Single : A 155 SER OG : rot 170:sc= -1.03! USER MOD ----------------------------------------------------------------- ATOM 216 N ALA A 12 -15.829 -6.474 17.852 1.00 0.00 N ATOM 217 CA ALA A 12 -14.348 -6.489 18.145 1.00 0.00 C ATOM 218 C ALA A 12 -14.122 -6.695 19.652 1.00 0.00 C ATOM 219 O ALA A 12 -14.904 -6.228 20.456 1.00 0.00 O ATOM 220 CB ALA A 12 -13.791 -5.122 17.704 1.00 0.00 C ATOM 0 HA ALA A 12 -13.847 -7.299 17.615 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -12.719 -5.086 17.897 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -13.972 -4.982 16.638 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -14.287 -4.329 18.264 1.00 0.00 H new ATOM 226 N PRO A 13 -13.060 -7.394 19.997 1.00 0.00 N ATOM 227 CA PRO A 13 -12.761 -7.651 21.431 1.00 0.00 C ATOM 228 C PRO A 13 -12.309 -6.363 22.132 1.00 0.00 C ATOM 229 O PRO A 13 -11.932 -5.402 21.490 1.00 0.00 O ATOM 230 CB PRO A 13 -11.629 -8.674 21.387 1.00 0.00 C ATOM 231 CG PRO A 13 -10.975 -8.468 20.060 1.00 0.00 C ATOM 232 CD PRO A 13 -12.049 -8.002 19.114 1.00 0.00 C ATOM 0 HA PRO A 13 -13.628 -8.006 21.988 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -10.924 -8.518 22.203 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -12.011 -9.690 21.486 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -10.177 -7.729 20.133 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -10.522 -9.393 19.705 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -11.662 -7.281 18.394 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -12.465 -8.831 18.542 1.00 0.00 H new ATOM 240 N ASP A 14 -12.352 -6.336 23.450 1.00 0.00 N ATOM 241 CA ASP A 14 -11.926 -5.093 24.203 1.00 0.00 C ATOM 242 C ASP A 14 -10.566 -4.568 23.699 1.00 0.00 C ATOM 243 O ASP A 14 -10.321 -3.377 23.708 1.00 0.00 O ATOM 244 CB ASP A 14 -11.810 -5.496 25.682 1.00 0.00 C ATOM 245 CG ASP A 14 -13.201 -5.499 26.319 1.00 0.00 C ATOM 246 OD1 ASP A 14 -13.715 -4.423 26.578 1.00 0.00 O ATOM 247 OD2 ASP A 14 -13.728 -6.577 26.539 1.00 0.00 O ATOM 0 H ASP A 14 -12.660 -7.112 24.036 1.00 0.00 H new ATOM 0 HA ASP A 14 -12.653 -4.294 24.054 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -11.357 -6.484 25.767 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -11.158 -4.800 26.210 1.00 0.00 H new ATOM 252 N GLY A 15 -9.679 -5.440 23.257 1.00 0.00 N ATOM 253 CA GLY A 15 -8.345 -4.978 22.753 1.00 0.00 C ATOM 254 C GLY A 15 -8.518 -3.876 21.689 1.00 0.00 C ATOM 255 O GLY A 15 -7.706 -2.973 21.600 1.00 0.00 O ATOM 0 H GLY A 15 -9.825 -6.449 23.225 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -7.748 -4.599 23.583 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -7.800 -5.820 22.327 1.00 0.00 H new ATOM 259 N PHE A 16 -9.563 -3.931 20.881 1.00 0.00 N ATOM 260 CA PHE A 16 -9.755 -2.860 19.833 1.00 0.00 C ATOM 261 C PHE A 16 -9.765 -1.462 20.476 1.00 0.00 C ATOM 262 O PHE A 16 -9.328 -0.501 19.871 1.00 0.00 O ATOM 263 CB PHE A 16 -11.108 -3.132 19.154 1.00 0.00 C ATOM 264 CG PHE A 16 -11.285 -2.184 17.989 1.00 0.00 C ATOM 265 CD1 PHE A 16 -10.294 -2.088 17.003 1.00 0.00 C ATOM 266 CD2 PHE A 16 -12.441 -1.399 17.897 1.00 0.00 C ATOM 267 CE1 PHE A 16 -10.459 -1.209 15.926 1.00 0.00 C ATOM 268 CE2 PHE A 16 -12.606 -0.520 16.819 1.00 0.00 C ATOM 269 CZ PHE A 16 -11.615 -0.424 15.835 1.00 0.00 C ATOM 0 H PHE A 16 -10.279 -4.657 20.900 1.00 0.00 H new ATOM 0 HA PHE A 16 -8.938 -2.884 19.112 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -11.152 -4.164 18.807 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -11.919 -3.001 19.870 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -9.402 -2.693 17.074 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -13.205 -1.471 18.657 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -9.695 -1.136 15.166 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -13.498 0.084 16.747 1.00 0.00 H new ATOM 0 HZ PHE A 16 -11.742 0.256 15.005 1.00 0.00 H new ATOM 279 N GLU A 17 -10.255 -1.332 21.697 1.00 0.00 N ATOM 280 CA GLU A 17 -10.274 0.028 22.357 1.00 0.00 C ATOM 281 C GLU A 17 -8.869 0.655 22.327 1.00 0.00 C ATOM 282 O GLU A 17 -8.723 1.846 22.131 1.00 0.00 O ATOM 283 CB GLU A 17 -10.722 -0.190 23.812 1.00 0.00 C ATOM 284 CG GLU A 17 -11.092 1.155 24.441 1.00 0.00 C ATOM 285 CD GLU A 17 -11.698 0.923 25.826 1.00 0.00 C ATOM 286 OE1 GLU A 17 -11.147 0.125 26.565 1.00 0.00 O ATOM 287 OE2 GLU A 17 -12.704 1.547 26.123 1.00 0.00 O ATOM 0 H GLU A 17 -10.637 -2.094 22.257 1.00 0.00 H new ATOM 0 HA GLU A 17 -10.951 0.704 21.834 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -11.577 -0.865 23.843 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -9.922 -0.662 24.383 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -10.207 1.786 24.521 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -11.803 1.682 23.805 1.00 0.00 H new ATOM 294 N LYS A 18 -7.835 -0.142 22.510 1.00 0.00 N ATOM 295 CA LYS A 18 -6.440 0.429 22.476 1.00 0.00 C ATOM 296 C LYS A 18 -6.168 1.087 21.112 1.00 0.00 C ATOM 297 O LYS A 18 -5.503 2.103 21.036 1.00 0.00 O ATOM 298 CB LYS A 18 -5.473 -0.745 22.697 1.00 0.00 C ATOM 299 CG LYS A 18 -5.266 -0.962 24.197 1.00 0.00 C ATOM 300 CD LYS A 18 -4.150 -0.041 24.697 1.00 0.00 C ATOM 301 CE LYS A 18 -4.279 0.143 26.211 1.00 0.00 C ATOM 302 NZ LYS A 18 -3.067 0.913 26.607 1.00 0.00 N ATOM 0 H LYS A 18 -7.893 -1.146 22.679 1.00 0.00 H new ATOM 0 HA LYS A 18 -6.313 1.192 23.244 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -5.873 -1.650 22.240 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -4.518 -0.539 22.214 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -6.191 -0.756 24.736 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -5.008 -2.003 24.392 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -3.176 -0.467 24.453 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -4.210 0.925 24.196 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -5.191 0.682 26.467 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -4.322 -0.818 26.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -3.082 1.080 27.633 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -2.215 0.372 26.356 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -3.057 1.825 26.108 1.00 0.00 H new ATOM 316 N ILE A 19 -6.678 0.523 20.035 1.00 0.00 N ATOM 317 CA ILE A 19 -6.441 1.132 18.687 1.00 0.00 C ATOM 318 C ILE A 19 -7.781 1.498 18.013 1.00 0.00 C ATOM 319 O ILE A 19 -7.926 1.367 16.812 1.00 0.00 O ATOM 320 CB ILE A 19 -5.691 0.057 17.878 1.00 0.00 C ATOM 321 CG1 ILE A 19 -6.564 -1.203 17.713 1.00 0.00 C ATOM 322 CG2 ILE A 19 -4.388 -0.322 18.597 1.00 0.00 C ATOM 323 CD1 ILE A 19 -6.439 -1.738 16.282 1.00 0.00 C ATOM 0 H ILE A 19 -7.243 -0.326 20.035 1.00 0.00 H new ATOM 0 HA ILE A 19 -5.867 2.056 18.753 1.00 0.00 H new ATOM 0 HB ILE A 19 -5.463 0.464 16.893 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.253 -1.967 18.425 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -7.605 -0.967 17.933 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -3.862 -1.083 18.020 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -3.756 0.561 18.695 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -4.620 -0.714 19.588 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -7.058 -2.628 16.171 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -6.771 -0.975 15.578 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -5.399 -1.992 16.078 1.00 0.00 H new ATOM 335 N LYS A 20 -8.768 1.935 18.775 1.00 0.00 N ATOM 336 CA LYS A 20 -10.101 2.279 18.156 1.00 0.00 C ATOM 337 C LYS A 20 -10.170 3.721 17.597 1.00 0.00 C ATOM 338 O LYS A 20 -10.721 3.915 16.531 1.00 0.00 O ATOM 339 CB LYS A 20 -11.148 2.099 19.266 1.00 0.00 C ATOM 340 CG LYS A 20 -12.551 2.140 18.657 1.00 0.00 C ATOM 341 CD LYS A 20 -13.113 3.560 18.760 1.00 0.00 C ATOM 342 CE LYS A 20 -14.002 3.848 17.549 1.00 0.00 C ATOM 343 NZ LYS A 20 -15.381 3.502 17.993 1.00 0.00 N ATOM 0 H LYS A 20 -8.710 2.067 19.785 1.00 0.00 H new ATOM 0 HA LYS A 20 -10.275 1.628 17.299 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -10.990 1.150 19.779 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -11.041 2.886 20.012 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -12.515 1.827 17.614 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -13.205 1.440 19.177 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -13.687 3.669 19.680 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -12.298 4.282 18.806 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -13.934 4.894 17.249 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -13.703 3.250 16.688 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -16.049 3.673 17.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -15.417 2.499 18.265 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -15.641 4.092 18.809 1.00 0.00 H new ATOM 357 N PRO A 21 -9.656 4.702 18.321 1.00 0.00 N ATOM 358 CA PRO A 21 -9.745 6.104 17.837 1.00 0.00 C ATOM 359 C PRO A 21 -8.747 6.386 16.700 1.00 0.00 C ATOM 360 O PRO A 21 -9.051 7.137 15.791 1.00 0.00 O ATOM 361 CB PRO A 21 -9.417 6.938 19.070 1.00 0.00 C ATOM 362 CG PRO A 21 -8.600 6.046 19.948 1.00 0.00 C ATOM 363 CD PRO A 21 -8.960 4.619 19.615 1.00 0.00 C ATOM 0 HA PRO A 21 -10.725 6.330 17.417 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -8.863 7.837 18.800 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -10.325 7.263 19.577 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -7.536 6.220 19.786 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -8.801 6.256 20.999 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -8.071 3.992 19.547 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -9.600 4.183 20.382 1.00 0.00 H new ATOM 371 N THR A 22 -7.564 5.806 16.734 1.00 0.00 N ATOM 372 CA THR A 22 -6.579 6.084 15.625 1.00 0.00 C ATOM 373 C THR A 22 -7.153 5.609 14.284 1.00 0.00 C ATOM 374 O THR A 22 -7.105 6.325 13.301 1.00 0.00 O ATOM 375 CB THR A 22 -5.289 5.314 15.959 1.00 0.00 C ATOM 376 OG1 THR A 22 -4.815 5.717 17.240 1.00 0.00 O ATOM 377 CG2 THR A 22 -4.223 5.619 14.902 1.00 0.00 C ATOM 0 H THR A 22 -7.241 5.168 17.461 1.00 0.00 H new ATOM 0 HA THR A 22 -6.376 7.152 15.541 1.00 0.00 H new ATOM 0 HB THR A 22 -5.497 4.244 15.967 1.00 0.00 H new ATOM 0 HG1 THR A 22 -3.994 5.226 17.455 1.00 0.00 H new ATOM 0 HG21 THR A 22 -3.309 5.074 15.139 1.00 0.00 H new ATOM 0 HG22 THR A 22 -4.585 5.312 13.921 1.00 0.00 H new ATOM 0 HG23 THR A 22 -4.015 6.689 14.893 1.00 0.00 H new ATOM 385 N LEU A 23 -7.701 4.417 14.234 1.00 0.00 N ATOM 386 CA LEU A 23 -8.285 3.922 12.936 1.00 0.00 C ATOM 387 C LEU A 23 -9.421 4.857 12.485 1.00 0.00 C ATOM 388 O LEU A 23 -9.578 5.115 11.306 1.00 0.00 O ATOM 389 CB LEU A 23 -8.829 2.511 13.201 1.00 0.00 C ATOM 390 CG LEU A 23 -7.666 1.515 13.214 1.00 0.00 C ATOM 391 CD1 LEU A 23 -7.940 0.405 14.241 1.00 0.00 C ATOM 392 CD2 LEU A 23 -7.507 0.903 11.818 1.00 0.00 C ATOM 0 H LEU A 23 -7.771 3.771 15.020 1.00 0.00 H new ATOM 0 HA LEU A 23 -7.534 3.904 12.146 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -9.356 2.485 14.155 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -9.550 2.236 12.431 1.00 0.00 H new ATOM 0 HG LEU A 23 -6.748 2.034 13.490 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -7.109 -0.300 14.245 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -8.047 0.845 15.232 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -8.858 -0.118 13.975 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -6.680 0.193 11.824 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -8.426 0.387 11.540 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -7.302 1.693 11.096 1.00 0.00 H new ATOM 404 N THR A 24 -10.213 5.375 13.408 1.00 0.00 N ATOM 405 CA THR A 24 -11.332 6.302 12.999 1.00 0.00 C ATOM 406 C THR A 24 -10.770 7.500 12.214 1.00 0.00 C ATOM 407 O THR A 24 -11.390 7.972 11.279 1.00 0.00 O ATOM 408 CB THR A 24 -12.006 6.786 14.294 1.00 0.00 C ATOM 409 OG1 THR A 24 -12.449 5.659 15.046 1.00 0.00 O ATOM 410 CG2 THR A 24 -13.207 7.667 13.945 1.00 0.00 C ATOM 0 H THR A 24 -10.135 5.200 14.410 1.00 0.00 H new ATOM 0 HA THR A 24 -12.046 5.790 12.355 1.00 0.00 H new ATOM 0 HB THR A 24 -11.292 7.361 14.883 1.00 0.00 H new ATOM 0 HG1 THR A 24 -11.708 5.316 15.588 1.00 0.00 H new ATOM 0 HG21 THR A 24 -13.685 8.010 14.862 1.00 0.00 H new ATOM 0 HG22 THR A 24 -12.871 8.528 13.367 1.00 0.00 H new ATOM 0 HG23 THR A 24 -13.922 7.091 13.357 1.00 0.00 H new ATOM 418 N ASP A 25 -9.601 7.997 12.577 1.00 0.00 N ATOM 419 CA ASP A 25 -9.022 9.170 11.822 1.00 0.00 C ATOM 420 C ASP A 25 -8.880 8.820 10.330 1.00 0.00 C ATOM 421 O ASP A 25 -9.128 9.647 9.472 1.00 0.00 O ATOM 422 CB ASP A 25 -7.639 9.451 12.435 1.00 0.00 C ATOM 423 CG ASP A 25 -7.012 10.671 11.754 1.00 0.00 C ATOM 424 OD1 ASP A 25 -7.403 11.777 12.087 1.00 0.00 O ATOM 425 OD2 ASP A 25 -6.152 10.476 10.912 1.00 0.00 O ATOM 0 H ASP A 25 -9.032 7.649 13.349 1.00 0.00 H new ATOM 0 HA ASP A 25 -9.669 10.044 11.898 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -7.734 9.629 13.506 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -6.993 8.582 12.313 1.00 0.00 H new ATOM 430 N PHE A 26 -8.489 7.601 10.009 1.00 0.00 N ATOM 431 CA PHE A 26 -8.345 7.219 8.556 1.00 0.00 C ATOM 432 C PHE A 26 -9.682 7.413 7.823 1.00 0.00 C ATOM 433 O PHE A 26 -9.712 7.866 6.694 1.00 0.00 O ATOM 434 CB PHE A 26 -7.954 5.734 8.527 1.00 0.00 C ATOM 435 CG PHE A 26 -6.454 5.607 8.602 1.00 0.00 C ATOM 436 CD1 PHE A 26 -5.801 5.736 9.832 1.00 0.00 C ATOM 437 CD2 PHE A 26 -5.719 5.355 7.440 1.00 0.00 C ATOM 438 CE1 PHE A 26 -4.410 5.614 9.900 1.00 0.00 C ATOM 439 CE2 PHE A 26 -4.327 5.232 7.508 1.00 0.00 C ATOM 440 CZ PHE A 26 -3.673 5.362 8.738 1.00 0.00 C ATOM 0 H PHE A 26 -8.266 6.864 10.678 1.00 0.00 H new ATOM 0 HA PHE A 26 -7.596 7.839 8.064 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -8.416 5.209 9.363 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -8.324 5.267 7.614 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -6.371 5.930 10.729 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -6.225 5.255 6.491 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -3.905 5.714 10.849 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -3.758 5.037 6.611 1.00 0.00 H new ATOM 0 HZ PHE A 26 -2.598 5.268 8.790 1.00 0.00 H new ATOM 450 N GLU A 27 -10.788 7.069 8.451 1.00 0.00 N ATOM 451 CA GLU A 27 -12.119 7.238 7.765 1.00 0.00 C ATOM 452 C GLU A 27 -12.368 8.706 7.376 1.00 0.00 C ATOM 453 O GLU A 27 -13.123 8.971 6.460 1.00 0.00 O ATOM 454 CB GLU A 27 -13.194 6.769 8.760 1.00 0.00 C ATOM 455 CG GLU A 27 -13.018 5.274 9.038 1.00 0.00 C ATOM 456 CD GLU A 27 -13.930 4.469 8.109 1.00 0.00 C ATOM 457 OE1 GLU A 27 -15.074 4.861 7.949 1.00 0.00 O ATOM 458 OE2 GLU A 27 -13.468 3.474 7.574 1.00 0.00 O ATOM 0 H GLU A 27 -10.829 6.684 9.395 1.00 0.00 H new ATOM 0 HA GLU A 27 -12.143 6.656 6.844 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -13.115 7.334 9.689 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -14.188 6.959 8.354 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -11.978 4.985 8.884 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -13.258 5.056 10.079 1.00 0.00 H new ATOM 465 N ILE A 28 -11.751 9.664 8.045 1.00 0.00 N ATOM 466 CA ILE A 28 -11.993 11.102 7.660 1.00 0.00 C ATOM 467 C ILE A 28 -11.182 11.449 6.397 1.00 0.00 C ATOM 468 O ILE A 28 -11.651 12.187 5.550 1.00 0.00 O ATOM 469 CB ILE A 28 -11.576 11.965 8.880 1.00 0.00 C ATOM 470 CG1 ILE A 28 -12.649 11.849 9.968 1.00 0.00 C ATOM 471 CG2 ILE A 28 -11.443 13.443 8.484 1.00 0.00 C ATOM 472 CD1 ILE A 28 -12.419 10.583 10.794 1.00 0.00 C ATOM 0 H ILE A 28 -11.106 9.518 8.822 1.00 0.00 H new ATOM 0 HA ILE A 28 -13.039 11.290 7.417 1.00 0.00 H new ATOM 0 HB ILE A 28 -10.614 11.605 9.244 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -12.620 12.726 10.615 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -13.639 11.822 9.513 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -11.150 14.028 9.356 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -10.685 13.545 7.707 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -12.399 13.806 8.108 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -13.186 10.508 11.565 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -12.471 9.710 10.144 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -11.436 10.628 11.263 1.00 0.00 H new ATOM 484 N GLN A 29 -9.988 10.916 6.246 1.00 0.00 N ATOM 485 CA GLN A 29 -9.202 11.226 5.004 1.00 0.00 C ATOM 486 C GLN A 29 -9.697 10.337 3.855 1.00 0.00 C ATOM 487 O GLN A 29 -9.779 10.778 2.724 1.00 0.00 O ATOM 488 CB GLN A 29 -7.727 10.933 5.328 1.00 0.00 C ATOM 489 CG GLN A 29 -6.860 11.266 4.112 1.00 0.00 C ATOM 490 CD GLN A 29 -5.392 11.366 4.543 1.00 0.00 C ATOM 491 OE1 GLN A 29 -4.927 10.565 5.328 1.00 0.00 O ATOM 492 NE2 GLN A 29 -4.632 12.320 4.061 1.00 0.00 N ATOM 0 H GLN A 29 -9.532 10.293 6.913 1.00 0.00 H new ATOM 0 HA GLN A 29 -9.322 12.265 4.697 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -7.408 11.523 6.187 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -7.605 9.884 5.599 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -6.974 10.496 3.349 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -7.184 12.207 3.667 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -5.018 12.995 3.401 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -3.655 12.387 4.346 1.00 0.00 H new ATOM 501 N LEU A 30 -10.046 9.093 4.130 1.00 0.00 N ATOM 502 CA LEU A 30 -10.555 8.209 3.026 1.00 0.00 C ATOM 503 C LEU A 30 -11.984 8.621 2.633 1.00 0.00 C ATOM 504 O LEU A 30 -12.356 8.499 1.479 1.00 0.00 O ATOM 505 CB LEU A 30 -10.539 6.767 3.560 1.00 0.00 C ATOM 506 CG LEU A 30 -10.055 5.824 2.456 1.00 0.00 C ATOM 507 CD1 LEU A 30 -9.240 4.687 3.075 1.00 0.00 C ATOM 508 CD2 LEU A 30 -11.262 5.246 1.714 1.00 0.00 C ATOM 0 H LEU A 30 -10.001 8.661 5.053 1.00 0.00 H new ATOM 0 HA LEU A 30 -9.931 8.297 2.137 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -9.884 6.696 4.428 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -11.537 6.478 3.889 1.00 0.00 H new ATOM 0 HG LEU A 30 -9.429 6.376 1.755 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -8.896 4.016 2.288 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -8.380 5.101 3.601 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -9.863 4.133 3.777 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -10.918 4.574 0.927 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -11.889 4.694 2.414 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -11.840 6.057 1.271 1.00 0.00 H new ATOM 520 N ARG A 31 -12.793 9.120 3.559 1.00 0.00 N ATOM 521 CA ARG A 31 -14.183 9.535 3.158 1.00 0.00 C ATOM 522 C ARG A 31 -14.117 10.813 2.301 1.00 0.00 C ATOM 523 O ARG A 31 -14.873 10.964 1.360 1.00 0.00 O ATOM 524 CB ARG A 31 -14.997 9.759 4.453 1.00 0.00 C ATOM 525 CG ARG A 31 -14.518 11.013 5.196 1.00 0.00 C ATOM 526 CD ARG A 31 -15.318 11.184 6.494 1.00 0.00 C ATOM 527 NE ARG A 31 -16.687 11.610 6.061 1.00 0.00 N ATOM 528 CZ ARG A 31 -17.664 10.734 5.868 1.00 0.00 C ATOM 529 NH1 ARG A 31 -17.473 9.441 5.999 1.00 0.00 N ATOM 530 NH2 ARG A 31 -18.852 11.162 5.522 1.00 0.00 N ATOM 0 H ARG A 31 -12.556 9.253 4.542 1.00 0.00 H new ATOM 0 HA ARG A 31 -14.667 8.766 2.556 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -16.055 9.859 4.209 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -14.900 8.889 5.102 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -13.455 10.930 5.421 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -14.642 11.892 4.563 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -15.356 10.252 7.058 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -14.860 11.931 7.143 1.00 0.00 H new ATOM 0 HE ARG A 31 -16.873 12.601 5.910 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -16.552 9.085 6.256 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -18.245 8.793 5.844 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -19.020 12.161 5.403 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -19.610 10.496 5.371 1.00 0.00 H new ATOM 544 N ASP A 32 -13.210 11.728 2.605 1.00 0.00 N ATOM 545 CA ASP A 32 -13.118 12.976 1.764 1.00 0.00 C ATOM 546 C ASP A 32 -12.720 12.591 0.333 1.00 0.00 C ATOM 547 O ASP A 32 -13.259 13.115 -0.623 1.00 0.00 O ATOM 548 CB ASP A 32 -12.040 13.867 2.400 1.00 0.00 C ATOM 549 CG ASP A 32 -12.676 14.754 3.473 1.00 0.00 C ATOM 550 OD1 ASP A 32 -13.428 14.229 4.277 1.00 0.00 O ATOM 551 OD2 ASP A 32 -12.399 15.942 3.470 1.00 0.00 O ATOM 0 H ASP A 32 -12.547 11.667 3.378 1.00 0.00 H new ATOM 0 HA ASP A 32 -14.071 13.504 1.723 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -11.257 13.250 2.841 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -11.567 14.485 1.636 1.00 0.00 H new ATOM 556 N ALA A 33 -11.792 11.664 0.173 1.00 0.00 N ATOM 557 CA ALA A 33 -11.393 11.247 -1.216 1.00 0.00 C ATOM 558 C ALA A 33 -12.559 10.496 -1.867 1.00 0.00 C ATOM 559 O ALA A 33 -12.879 10.721 -3.019 1.00 0.00 O ATOM 560 CB ALA A 33 -10.179 10.316 -1.071 1.00 0.00 C ATOM 0 H ALA A 33 -11.303 11.187 0.931 1.00 0.00 H new ATOM 0 HA ALA A 33 -11.145 12.107 -1.839 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -9.853 9.987 -2.058 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -9.366 10.852 -0.580 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -10.455 9.448 -0.472 1.00 0.00 H new ATOM 566 N GLN A 34 -13.209 9.611 -1.135 1.00 0.00 N ATOM 567 CA GLN A 34 -14.370 8.862 -1.732 1.00 0.00 C ATOM 568 C GLN A 34 -15.466 9.857 -2.150 1.00 0.00 C ATOM 569 O GLN A 34 -16.098 9.689 -3.176 1.00 0.00 O ATOM 570 CB GLN A 34 -14.900 7.915 -0.641 1.00 0.00 C ATOM 571 CG GLN A 34 -14.090 6.612 -0.648 1.00 0.00 C ATOM 572 CD GLN A 34 -14.892 5.506 -1.348 1.00 0.00 C ATOM 573 OE1 GLN A 34 -15.003 4.410 -0.835 1.00 0.00 O ATOM 574 NE2 GLN A 34 -15.461 5.741 -2.505 1.00 0.00 N ATOM 0 H GLN A 34 -12.990 9.378 -0.166 1.00 0.00 H new ATOM 0 HA GLN A 34 -14.067 8.301 -2.616 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -14.828 8.394 0.336 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -15.954 7.700 -0.814 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -13.141 6.766 -1.161 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -13.856 6.313 0.374 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -15.371 6.659 -2.940 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -15.994 5.006 -2.970 1.00 0.00 H new ATOM 583 N LYS A 35 -15.696 10.899 -1.368 1.00 0.00 N ATOM 584 CA LYS A 35 -16.761 11.900 -1.751 1.00 0.00 C ATOM 585 C LYS A 35 -16.466 12.495 -3.140 1.00 0.00 C ATOM 586 O LYS A 35 -17.376 12.783 -3.893 1.00 0.00 O ATOM 587 CB LYS A 35 -16.732 13.009 -0.686 1.00 0.00 C ATOM 588 CG LYS A 35 -17.519 12.554 0.544 1.00 0.00 C ATOM 589 CD LYS A 35 -17.716 13.739 1.492 1.00 0.00 C ATOM 590 CE LYS A 35 -18.945 14.540 1.056 1.00 0.00 C ATOM 591 NZ LYS A 35 -18.896 15.789 1.867 1.00 0.00 N ATOM 0 H LYS A 35 -15.203 11.097 -0.498 1.00 0.00 H new ATOM 0 HA LYS A 35 -17.740 11.424 -1.798 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -15.702 13.235 -0.409 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -17.163 13.926 -1.088 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -18.486 12.152 0.242 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -16.986 11.752 1.054 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -17.844 13.384 2.514 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -16.832 14.376 1.484 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -18.915 14.760 -0.011 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -19.865 13.985 1.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -19.708 16.392 1.625 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -18.933 15.548 2.878 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -18.013 16.300 1.665 1.00 0.00 H new ATOM 605 N ASP A 36 -15.206 12.680 -3.491 1.00 0.00 N ATOM 606 CA ASP A 36 -14.885 13.260 -4.849 1.00 0.00 C ATOM 607 C ASP A 36 -15.531 12.412 -5.959 1.00 0.00 C ATOM 608 O ASP A 36 -15.989 12.940 -6.955 1.00 0.00 O ATOM 609 CB ASP A 36 -13.355 13.230 -4.992 1.00 0.00 C ATOM 610 CG ASP A 36 -12.918 14.280 -6.017 1.00 0.00 C ATOM 611 OD1 ASP A 36 -13.121 15.453 -5.755 1.00 0.00 O ATOM 612 OD2 ASP A 36 -12.386 13.891 -7.043 1.00 0.00 O ATOM 0 H ASP A 36 -14.398 12.459 -2.908 1.00 0.00 H new ATOM 0 HA ASP A 36 -15.271 14.275 -4.939 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -12.885 13.429 -4.029 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -13.028 12.239 -5.308 1.00 0.00 H new ATOM 744 N SER A 45 -8.576 14.542 -9.816 1.00 0.00 N ATOM 745 CA SER A 45 -9.448 13.431 -9.320 1.00 0.00 C ATOM 746 C SER A 45 -8.615 12.164 -9.079 1.00 0.00 C ATOM 747 O SER A 45 -8.628 11.610 -7.995 1.00 0.00 O ATOM 748 CB SER A 45 -10.474 13.197 -10.430 1.00 0.00 C ATOM 749 OG SER A 45 -11.247 14.377 -10.610 1.00 0.00 O ATOM 0 HA SER A 45 -9.926 13.679 -8.373 1.00 0.00 H new ATOM 0 HB2 SER A 45 -9.968 12.934 -11.359 1.00 0.00 H new ATOM 0 HB3 SER A 45 -11.122 12.359 -10.172 1.00 0.00 H new ATOM 0 HG SER A 45 -10.705 15.161 -10.383 1.00 0.00 H new ATOM 755 N ASN A 46 -7.886 11.701 -10.073 1.00 0.00 N ATOM 756 CA ASN A 46 -7.047 10.461 -9.874 1.00 0.00 C ATOM 757 C ASN A 46 -6.100 10.650 -8.675 1.00 0.00 C ATOM 758 O ASN A 46 -5.869 9.727 -7.916 1.00 0.00 O ATOM 759 CB ASN A 46 -6.230 10.265 -11.162 1.00 0.00 C ATOM 760 CG ASN A 46 -7.140 9.718 -12.268 1.00 0.00 C ATOM 761 OD1 ASN A 46 -7.440 10.415 -13.217 1.00 0.00 O ATOM 762 ND2 ASN A 46 -7.599 8.491 -12.191 1.00 0.00 N ATOM 0 H ASN A 46 -7.833 12.119 -11.002 1.00 0.00 H new ATOM 0 HA ASN A 46 -7.675 9.593 -9.672 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -5.790 11.212 -11.474 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -5.406 9.575 -10.981 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -8.205 8.126 -12.926 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -7.350 7.902 -11.396 1.00 0.00 H new ATOM 769 N GLU A 47 -5.555 11.839 -8.494 1.00 0.00 N ATOM 770 CA GLU A 47 -4.628 12.062 -7.327 1.00 0.00 C ATOM 771 C GLU A 47 -5.371 11.799 -6.008 1.00 0.00 C ATOM 772 O GLU A 47 -4.816 11.225 -5.090 1.00 0.00 O ATOM 773 CB GLU A 47 -4.172 13.528 -7.395 1.00 0.00 C ATOM 774 CG GLU A 47 -3.290 13.732 -8.628 1.00 0.00 C ATOM 775 CD GLU A 47 -2.350 14.917 -8.394 1.00 0.00 C ATOM 776 OE1 GLU A 47 -2.847 16.021 -8.246 1.00 0.00 O ATOM 777 OE2 GLU A 47 -1.150 14.699 -8.367 1.00 0.00 O ATOM 0 H GLU A 47 -5.708 12.651 -9.092 1.00 0.00 H new ATOM 0 HA GLU A 47 -3.774 11.386 -7.369 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -5.039 14.188 -7.442 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -3.620 13.790 -6.493 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -2.712 12.830 -8.828 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -3.910 13.914 -9.506 1.00 0.00 H new ATOM 784 N GLN A 48 -6.622 12.209 -5.901 1.00 0.00 N ATOM 785 CA GLN A 48 -7.374 11.960 -4.617 1.00 0.00 C ATOM 786 C GLN A 48 -7.487 10.448 -4.364 1.00 0.00 C ATOM 787 O GLN A 48 -7.336 9.994 -3.246 1.00 0.00 O ATOM 788 CB GLN A 48 -8.774 12.572 -4.792 1.00 0.00 C ATOM 789 CG GLN A 48 -9.377 12.869 -3.417 1.00 0.00 C ATOM 790 CD GLN A 48 -8.550 13.954 -2.716 1.00 0.00 C ATOM 791 OE1 GLN A 48 -8.384 15.036 -3.243 1.00 0.00 O ATOM 792 NE2 GLN A 48 -8.020 13.715 -1.541 1.00 0.00 N ATOM 0 H GLN A 48 -7.145 12.695 -6.630 1.00 0.00 H new ATOM 0 HA GLN A 48 -6.858 12.407 -3.767 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -8.711 13.488 -5.379 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -9.417 11.885 -5.342 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -10.410 13.198 -3.525 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -9.393 11.962 -2.812 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -8.157 12.808 -1.095 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -7.471 14.436 -1.073 1.00 0.00 H new ATOM 801 N LEU A 49 -7.746 9.663 -5.392 1.00 0.00 N ATOM 802 CA LEU A 49 -7.860 8.175 -5.181 1.00 0.00 C ATOM 803 C LEU A 49 -6.533 7.613 -4.643 1.00 0.00 C ATOM 804 O LEU A 49 -6.532 6.728 -3.808 1.00 0.00 O ATOM 805 CB LEU A 49 -8.181 7.554 -6.550 1.00 0.00 C ATOM 806 CG LEU A 49 -9.690 7.601 -6.792 1.00 0.00 C ATOM 807 CD1 LEU A 49 -9.997 7.103 -8.205 1.00 0.00 C ATOM 808 CD2 LEU A 49 -10.399 6.705 -5.772 1.00 0.00 C ATOM 0 H LEU A 49 -7.881 9.981 -6.352 1.00 0.00 H new ATOM 0 HA LEU A 49 -8.638 7.942 -4.454 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -7.659 8.096 -7.338 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -7.829 6.523 -6.585 1.00 0.00 H new ATOM 0 HG LEU A 49 -10.042 8.627 -6.683 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -11.073 7.137 -8.377 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -9.493 7.739 -8.933 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -9.644 6.077 -8.314 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -11.475 6.738 -5.944 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -10.046 5.680 -5.881 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -10.182 7.059 -4.764 1.00 0.00 H new ATOM 820 N TRP A 50 -5.403 8.113 -5.110 1.00 0.00 N ATOM 821 CA TRP A 50 -4.086 7.578 -4.598 1.00 0.00 C ATOM 822 C TRP A 50 -3.997 7.764 -3.079 1.00 0.00 C ATOM 823 O TRP A 50 -3.497 6.899 -2.381 1.00 0.00 O ATOM 824 CB TRP A 50 -2.971 8.361 -5.324 1.00 0.00 C ATOM 825 CG TRP A 50 -3.063 8.159 -6.819 1.00 0.00 C ATOM 826 CD1 TRP A 50 -3.851 7.249 -7.456 1.00 0.00 C ATOM 827 CD2 TRP A 50 -2.346 8.871 -7.872 1.00 0.00 C ATOM 828 NE1 TRP A 50 -3.666 7.370 -8.820 1.00 0.00 N ATOM 829 CE2 TRP A 50 -2.752 8.352 -9.126 1.00 0.00 C ATOM 830 CE3 TRP A 50 -1.395 9.908 -7.864 1.00 0.00 C ATOM 831 CZ2 TRP A 50 -2.237 8.843 -10.321 1.00 0.00 C ATOM 832 CZ3 TRP A 50 -0.872 10.402 -9.072 1.00 0.00 C ATOM 833 CH2 TRP A 50 -1.295 9.869 -10.298 1.00 0.00 C ATOM 0 H TRP A 50 -5.334 8.853 -5.809 1.00 0.00 H new ATOM 0 HA TRP A 50 -3.987 6.511 -4.795 1.00 0.00 H new ATOM 0 HB2 TRP A 50 -3.053 9.422 -5.090 1.00 0.00 H new ATOM 0 HB3 TRP A 50 -1.996 8.030 -4.967 1.00 0.00 H new ATOM 0 HD1 TRP A 50 -4.514 6.546 -6.973 1.00 0.00 H new ATOM 0 HE1 TRP A 50 -4.148 6.801 -9.515 1.00 0.00 H new ATOM 0 HE3 TRP A 50 -1.065 10.327 -6.925 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 -2.566 8.430 -11.263 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 -0.140 11.196 -9.056 1.00 0.00 H new ATOM 0 HH2 TRP A 50 -0.891 10.253 -11.223 1.00 0.00 H new ATOM 844 N GLU A 51 -4.494 8.862 -2.548 1.00 0.00 N ATOM 845 CA GLU A 51 -4.442 9.044 -1.055 1.00 0.00 C ATOM 846 C GLU A 51 -5.254 7.931 -0.364 1.00 0.00 C ATOM 847 O GLU A 51 -4.922 7.519 0.731 1.00 0.00 O ATOM 848 CB GLU A 51 -5.057 10.421 -0.748 1.00 0.00 C ATOM 849 CG GLU A 51 -4.179 11.518 -1.355 1.00 0.00 C ATOM 850 CD GLU A 51 -4.489 12.853 -0.675 1.00 0.00 C ATOM 851 OE1 GLU A 51 -4.474 12.892 0.545 1.00 0.00 O ATOM 852 OE2 GLU A 51 -4.737 13.814 -1.385 1.00 0.00 O ATOM 0 H GLU A 51 -4.925 9.625 -3.070 1.00 0.00 H new ATOM 0 HA GLU A 51 -3.417 8.989 -0.688 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -6.066 10.480 -1.157 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -5.141 10.562 0.330 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -3.126 11.268 -1.227 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -4.361 11.593 -2.427 1.00 0.00 H new ATOM 859 N ILE A 52 -6.305 7.428 -0.994 1.00 0.00 N ATOM 860 CA ILE A 52 -7.099 6.329 -0.342 1.00 0.00 C ATOM 861 C ILE A 52 -6.276 5.034 -0.367 1.00 0.00 C ATOM 862 O ILE A 52 -5.969 4.483 0.676 1.00 0.00 O ATOM 863 CB ILE A 52 -8.406 6.184 -1.145 1.00 0.00 C ATOM 864 CG1 ILE A 52 -9.193 7.496 -1.043 1.00 0.00 C ATOM 865 CG2 ILE A 52 -9.246 5.038 -0.566 1.00 0.00 C ATOM 866 CD1 ILE A 52 -10.469 7.416 -1.887 1.00 0.00 C ATOM 0 H ILE A 52 -6.638 7.726 -1.911 1.00 0.00 H new ATOM 0 HA ILE A 52 -7.331 6.552 0.700 1.00 0.00 H new ATOM 0 HB ILE A 52 -8.176 5.965 -2.188 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -9.449 7.695 -0.002 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -8.575 8.327 -1.384 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -10.169 4.939 -1.137 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -8.682 4.107 -0.625 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -9.485 5.252 0.476 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -11.018 8.354 -1.806 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -10.205 7.239 -2.930 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -11.093 6.598 -1.527 1.00 0.00 H new ATOM 878 N MET A 53 -5.891 4.545 -1.535 1.00 0.00 N ATOM 879 CA MET A 53 -5.060 3.285 -1.553 1.00 0.00 C ATOM 880 C MET A 53 -3.737 3.517 -0.798 1.00 0.00 C ATOM 881 O MET A 53 -3.200 2.596 -0.208 1.00 0.00 O ATOM 882 CB MET A 53 -4.800 2.878 -3.020 1.00 0.00 C ATOM 883 CG MET A 53 -4.179 4.028 -3.828 1.00 0.00 C ATOM 884 SD MET A 53 -5.088 4.229 -5.388 1.00 0.00 S ATOM 885 CE MET A 53 -4.617 2.649 -6.129 1.00 0.00 C ATOM 0 H MET A 53 -6.108 4.948 -2.447 1.00 0.00 H new ATOM 0 HA MET A 53 -5.593 2.477 -1.052 1.00 0.00 H new ATOM 0 HB2 MET A 53 -4.135 2.015 -3.046 1.00 0.00 H new ATOM 0 HB3 MET A 53 -5.738 2.572 -3.484 1.00 0.00 H new ATOM 0 HG2 MET A 53 -4.215 4.953 -3.252 1.00 0.00 H new ATOM 0 HG3 MET A 53 -3.129 3.819 -4.031 1.00 0.00 H new ATOM 0 HE1 MET A 53 -5.362 2.358 -6.870 1.00 0.00 H new ATOM 0 HE2 MET A 53 -3.645 2.749 -6.611 1.00 0.00 H new ATOM 0 HE3 MET A 53 -4.560 1.886 -5.353 1.00 0.00 H new ATOM 895 N GLN A 54 -3.214 4.735 -0.775 1.00 0.00 N ATOM 896 CA GLN A 54 -1.941 4.974 -0.005 1.00 0.00 C ATOM 897 C GLN A 54 -2.236 4.871 1.502 1.00 0.00 C ATOM 898 O GLN A 54 -1.440 4.344 2.254 1.00 0.00 O ATOM 899 CB GLN A 54 -1.458 6.388 -0.363 1.00 0.00 C ATOM 900 CG GLN A 54 -0.694 6.346 -1.688 1.00 0.00 C ATOM 901 CD GLN A 54 0.805 6.182 -1.411 1.00 0.00 C ATOM 902 OE1 GLN A 54 1.326 6.766 -0.480 1.00 0.00 O ATOM 903 NE2 GLN A 54 1.532 5.409 -2.181 1.00 0.00 N ATOM 0 H GLN A 54 -3.605 5.552 -1.245 1.00 0.00 H new ATOM 0 HA GLN A 54 -1.176 4.238 -0.254 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -2.309 7.065 -0.443 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -0.815 6.775 0.428 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -1.054 5.520 -2.301 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -0.872 7.262 -2.252 1.00 0.00 H new ATOM 0 HE21 GLN A 54 1.100 4.917 -2.963 1.00 0.00 H new ATOM 0 HE22 GLN A 54 2.529 5.300 -1.998 1.00 0.00 H new ATOM 912 N LEU A 55 -3.386 5.354 1.950 1.00 0.00 N ATOM 913 CA LEU A 55 -3.720 5.253 3.420 1.00 0.00 C ATOM 914 C LEU A 55 -3.613 3.791 3.893 1.00 0.00 C ATOM 915 O LEU A 55 -3.251 3.532 5.025 1.00 0.00 O ATOM 916 CB LEU A 55 -5.170 5.741 3.583 1.00 0.00 C ATOM 917 CG LEU A 55 -5.185 7.248 3.841 1.00 0.00 C ATOM 918 CD1 LEU A 55 -6.621 7.769 3.730 1.00 0.00 C ATOM 919 CD2 LEU A 55 -4.650 7.528 5.248 1.00 0.00 C ATOM 0 H LEU A 55 -4.095 5.805 1.372 1.00 0.00 H new ATOM 0 HA LEU A 55 -3.029 5.852 4.013 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -5.744 5.511 2.685 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -5.649 5.217 4.410 1.00 0.00 H new ATOM 0 HG LEU A 55 -4.557 7.750 3.105 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -6.633 8.843 3.914 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -7.005 7.567 2.730 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -7.248 7.268 4.467 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -4.660 8.602 5.434 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.280 7.027 5.983 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -3.629 7.155 5.330 1.00 0.00 H new ATOM 931 N HIS A 56 -3.925 2.827 3.039 1.00 0.00 N ATOM 932 CA HIS A 56 -3.830 1.386 3.474 1.00 0.00 C ATOM 933 C HIS A 56 -2.415 1.080 3.993 1.00 0.00 C ATOM 934 O HIS A 56 -2.255 0.346 4.950 1.00 0.00 O ATOM 935 CB HIS A 56 -4.136 0.529 2.237 1.00 0.00 C ATOM 936 CG HIS A 56 -4.624 -0.822 2.677 1.00 0.00 C ATOM 937 ND1 HIS A 56 -5.972 -1.138 2.736 1.00 0.00 N ATOM 938 CD2 HIS A 56 -3.957 -1.944 3.092 1.00 0.00 C ATOM 939 CE1 HIS A 56 -6.071 -2.407 3.173 1.00 0.00 C ATOM 940 NE2 HIS A 56 -4.871 -2.945 3.406 1.00 0.00 N ATOM 0 H HIS A 56 -4.235 2.974 2.079 1.00 0.00 H new ATOM 0 HA HIS A 56 -4.532 1.174 4.281 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -4.890 1.017 1.620 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -3.241 0.423 1.623 1.00 0.00 H new ATOM 0 HD1 HIS A 56 -6.747 -0.522 2.493 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -2.884 -2.038 3.165 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -7.007 -2.927 3.318 1.00 0.00 H new ATOM 948 N HIS A 57 -1.386 1.645 3.385 1.00 0.00 N ATOM 949 CA HIS A 57 0.008 1.372 3.889 1.00 0.00 C ATOM 950 C HIS A 57 0.132 1.870 5.332 1.00 0.00 C ATOM 951 O HIS A 57 0.564 1.141 6.205 1.00 0.00 O ATOM 952 CB HIS A 57 0.978 2.138 2.977 1.00 0.00 C ATOM 953 CG HIS A 57 1.385 1.259 1.829 1.00 0.00 C ATOM 954 ND1 HIS A 57 2.522 1.504 1.078 1.00 0.00 N ATOM 955 CD2 HIS A 57 0.821 0.124 1.298 1.00 0.00 C ATOM 956 CE1 HIS A 57 2.607 0.538 0.147 1.00 0.00 C ATOM 957 NE2 HIS A 57 1.596 -0.329 0.237 1.00 0.00 N ATOM 0 H HIS A 57 -1.449 2.269 2.580 1.00 0.00 H new ATOM 0 HA HIS A 57 0.233 0.306 3.874 1.00 0.00 H new ATOM 0 HB2 HIS A 57 0.503 3.045 2.604 1.00 0.00 H new ATOM 0 HB3 HIS A 57 1.857 2.447 3.542 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -0.086 -0.344 1.651 1.00 0.00 H new ATOM 0 HE1 HIS A 57 3.398 0.471 -0.585 1.00 0.00 H new ATOM 0 HE2 HIS A 57 1.428 -1.148 -0.347 1.00 0.00 H new ATOM 965 N GLN A 58 -0.270 3.098 5.600 1.00 0.00 N ATOM 966 CA GLN A 58 -0.191 3.608 7.014 1.00 0.00 C ATOM 967 C GLN A 58 -1.060 2.716 7.920 1.00 0.00 C ATOM 968 O GLN A 58 -0.682 2.409 9.035 1.00 0.00 O ATOM 969 CB GLN A 58 -0.728 5.048 6.998 1.00 0.00 C ATOM 970 CG GLN A 58 -0.229 5.795 8.237 1.00 0.00 C ATOM 971 CD GLN A 58 -0.741 7.240 8.206 1.00 0.00 C ATOM 972 OE1 GLN A 58 -0.664 7.897 7.186 1.00 0.00 O ATOM 973 NE2 GLN A 58 -1.263 7.773 9.284 1.00 0.00 N ATOM 0 H GLN A 58 -0.642 3.757 4.916 1.00 0.00 H new ATOM 0 HA GLN A 58 0.830 3.588 7.396 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -0.398 5.560 6.094 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -1.818 5.040 6.980 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -0.577 5.294 9.141 1.00 0.00 H new ATOM 0 HG3 GLN A 58 0.861 5.785 8.266 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -1.330 7.226 10.142 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -1.602 8.735 9.264 1.00 0.00 H new ATOM 982 N ARG A 59 -2.213 2.276 7.440 1.00 0.00 N ATOM 983 CA ARG A 59 -3.075 1.378 8.289 1.00 0.00 C ATOM 984 C ARG A 59 -2.337 0.056 8.541 1.00 0.00 C ATOM 985 O ARG A 59 -2.198 -0.371 9.672 1.00 0.00 O ATOM 986 CB ARG A 59 -4.371 1.109 7.502 1.00 0.00 C ATOM 987 CG ARG A 59 -5.465 2.079 7.956 1.00 0.00 C ATOM 988 CD ARG A 59 -6.314 2.503 6.746 1.00 0.00 C ATOM 989 NE ARG A 59 -7.063 1.275 6.287 1.00 0.00 N ATOM 990 CZ ARG A 59 -8.180 1.381 5.581 1.00 0.00 C ATOM 991 NH1 ARG A 59 -8.662 2.551 5.225 1.00 0.00 N ATOM 992 NH2 ARG A 59 -8.817 0.297 5.214 1.00 0.00 N ATOM 0 H ARG A 59 -2.586 2.496 6.516 1.00 0.00 H new ATOM 0 HA ARG A 59 -3.298 1.842 9.250 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -4.189 1.226 6.434 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -4.696 0.081 7.659 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -6.096 1.605 8.708 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -5.017 2.956 8.423 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -7.007 3.299 7.020 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -5.682 2.891 5.947 1.00 0.00 H new ATOM 0 HE ARG A 59 -6.704 0.350 6.524 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -8.174 3.406 5.492 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -9.524 2.604 4.682 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -8.453 -0.620 5.472 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -9.677 0.370 4.671 1.00 0.00 H new ATOM 1006 N SER A 60 -1.849 -0.595 7.498 1.00 0.00 N ATOM 1007 CA SER A 60 -1.110 -1.888 7.711 1.00 0.00 C ATOM 1008 C SER A 60 0.122 -1.638 8.589 1.00 0.00 C ATOM 1009 O SER A 60 0.452 -2.451 9.424 1.00 0.00 O ATOM 1010 CB SER A 60 -0.679 -2.395 6.325 1.00 0.00 C ATOM 1011 OG SER A 60 -0.123 -1.318 5.583 1.00 0.00 O ATOM 0 H SER A 60 -1.930 -0.291 6.528 1.00 0.00 H new ATOM 0 HA SER A 60 -1.740 -2.624 8.211 1.00 0.00 H new ATOM 0 HB2 SER A 60 0.053 -3.196 6.429 1.00 0.00 H new ATOM 0 HB3 SER A 60 -1.535 -2.813 5.795 1.00 0.00 H new ATOM 0 HG SER A 60 -0.139 -0.503 6.127 1.00 0.00 H new ATOM 1017 N ARG A 61 0.800 -0.518 8.424 1.00 0.00 N ATOM 1018 CA ARG A 61 2.002 -0.249 9.292 1.00 0.00 C ATOM 1019 C ARG A 61 1.554 -0.102 10.755 1.00 0.00 C ATOM 1020 O ARG A 61 2.213 -0.582 11.656 1.00 0.00 O ATOM 1021 CB ARG A 61 2.633 1.060 8.792 1.00 0.00 C ATOM 1022 CG ARG A 61 4.018 1.234 9.419 1.00 0.00 C ATOM 1023 CD ARG A 61 5.090 0.703 8.454 1.00 0.00 C ATOM 1024 NE ARG A 61 5.287 1.773 7.409 1.00 0.00 N ATOM 1025 CZ ARG A 61 5.739 1.474 6.198 1.00 0.00 C ATOM 1026 NH1 ARG A 61 6.076 0.247 5.872 1.00 0.00 N ATOM 1027 NH2 ARG A 61 5.874 2.424 5.309 1.00 0.00 N ATOM 0 H ARG A 61 0.580 0.207 7.741 1.00 0.00 H new ATOM 0 HA ARG A 61 2.722 -1.065 9.238 1.00 0.00 H new ATOM 0 HB2 ARG A 61 2.714 1.045 7.705 1.00 0.00 H new ATOM 0 HB3 ARG A 61 1.996 1.905 9.052 1.00 0.00 H new ATOM 0 HG2 ARG A 61 4.200 2.286 9.638 1.00 0.00 H new ATOM 0 HG3 ARG A 61 4.069 0.698 10.367 1.00 0.00 H new ATOM 0 HD2 ARG A 61 6.022 0.499 8.982 1.00 0.00 H new ATOM 0 HD3 ARG A 61 4.771 -0.234 7.996 1.00 0.00 H new ATOM 0 HE ARG A 61 5.069 2.743 7.637 1.00 0.00 H new ATOM 0 HH11 ARG A 61 5.993 -0.504 6.557 1.00 0.00 H new ATOM 0 HH12 ARG A 61 6.421 0.045 4.933 1.00 0.00 H new ATOM 0 HH21 ARG A 61 5.633 3.385 5.549 1.00 0.00 H new ATOM 0 HH22 ARG A 61 6.221 2.203 4.375 1.00 0.00 H new ATOM 1041 N TYR A 62 0.433 0.550 11.002 1.00 0.00 N ATOM 1042 CA TYR A 62 -0.042 0.703 12.424 1.00 0.00 C ATOM 1043 C TYR A 62 -0.309 -0.686 13.028 1.00 0.00 C ATOM 1044 O TYR A 62 0.161 -0.997 14.109 1.00 0.00 O ATOM 1045 CB TYR A 62 -1.345 1.521 12.363 1.00 0.00 C ATOM 1046 CG TYR A 62 -1.902 1.715 13.755 1.00 0.00 C ATOM 1047 CD1 TYR A 62 -2.608 0.678 14.374 1.00 0.00 C ATOM 1048 CD2 TYR A 62 -1.713 2.930 14.424 1.00 0.00 C ATOM 1049 CE1 TYR A 62 -3.126 0.854 15.660 1.00 0.00 C ATOM 1050 CE2 TYR A 62 -2.231 3.107 15.712 1.00 0.00 C ATOM 1051 CZ TYR A 62 -2.938 2.068 16.331 1.00 0.00 C ATOM 1052 OH TYR A 62 -3.448 2.243 17.602 1.00 0.00 O ATOM 0 H TYR A 62 -0.164 0.976 10.293 1.00 0.00 H new ATOM 0 HA TYR A 62 0.701 1.202 13.046 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -1.154 2.490 11.901 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -2.076 1.008 11.738 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -2.753 -0.259 13.858 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -1.168 3.731 13.946 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -3.672 0.053 16.136 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -2.086 4.044 16.229 1.00 0.00 H new ATOM 0 HH TYR A 62 -3.227 3.142 17.922 1.00 0.00 H new ATOM 1062 N ILE A 63 -1.043 -1.533 12.332 1.00 0.00 N ATOM 1063 CA ILE A 63 -1.313 -2.909 12.883 1.00 0.00 C ATOM 1064 C ILE A 63 -0.032 -3.751 12.776 1.00 0.00 C ATOM 1065 O ILE A 63 0.316 -4.476 13.689 1.00 0.00 O ATOM 1066 CB ILE A 63 -2.435 -3.516 12.025 1.00 0.00 C ATOM 1067 CG1 ILE A 63 -3.696 -2.655 12.144 1.00 0.00 C ATOM 1068 CG2 ILE A 63 -2.749 -4.931 12.513 1.00 0.00 C ATOM 1069 CD1 ILE A 63 -4.664 -3.015 11.015 1.00 0.00 C ATOM 0 H ILE A 63 -1.460 -1.336 11.422 1.00 0.00 H new ATOM 0 HA ILE A 63 -1.612 -2.878 13.931 1.00 0.00 H new ATOM 0 HB ILE A 63 -2.110 -3.551 10.985 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -4.171 -2.818 13.111 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -3.435 -1.598 12.091 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -3.545 -5.358 11.903 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -1.856 -5.551 12.431 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -3.070 -4.894 13.554 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -5.563 -2.404 11.097 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -4.186 -2.830 10.053 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -4.934 -4.068 11.089 1.00 0.00 H new ATOM 1081 N TYR A 64 0.679 -3.651 11.673 1.00 0.00 N ATOM 1082 CA TYR A 64 1.950 -4.443 11.526 1.00 0.00 C ATOM 1083 C TYR A 64 2.952 -4.000 12.597 1.00 0.00 C ATOM 1084 O TYR A 64 3.644 -4.813 13.174 1.00 0.00 O ATOM 1085 CB TYR A 64 2.503 -4.122 10.127 1.00 0.00 C ATOM 1086 CG TYR A 64 3.676 -5.016 9.814 1.00 0.00 C ATOM 1087 CD1 TYR A 64 3.455 -6.336 9.416 1.00 0.00 C ATOM 1088 CD2 TYR A 64 4.983 -4.524 9.910 1.00 0.00 C ATOM 1089 CE1 TYR A 64 4.533 -7.168 9.112 1.00 0.00 C ATOM 1090 CE2 TYR A 64 6.067 -5.356 9.605 1.00 0.00 C ATOM 1091 CZ TYR A 64 5.841 -6.680 9.205 1.00 0.00 C ATOM 1092 OH TYR A 64 6.909 -7.501 8.903 1.00 0.00 O ATOM 0 H TYR A 64 0.438 -3.062 10.876 1.00 0.00 H new ATOM 0 HA TYR A 64 1.774 -5.512 11.644 1.00 0.00 H new ATOM 0 HB2 TYR A 64 1.722 -4.259 9.379 1.00 0.00 H new ATOM 0 HB3 TYR A 64 2.810 -3.077 10.080 1.00 0.00 H new ATOM 0 HD1 TYR A 64 2.446 -6.714 9.343 1.00 0.00 H new ATOM 0 HD2 TYR A 64 5.155 -3.504 10.219 1.00 0.00 H new ATOM 0 HE1 TYR A 64 4.358 -8.189 8.805 1.00 0.00 H new ATOM 0 HE2 TYR A 64 7.076 -4.978 9.678 1.00 0.00 H new ATOM 0 HH TYR A 64 7.746 -7.005 9.018 1.00 0.00 H new ATOM 1102 N THR A 65 3.043 -2.714 12.872 1.00 0.00 N ATOM 1103 CA THR A 65 4.023 -2.255 13.913 1.00 0.00 C ATOM 1104 C THR A 65 3.611 -2.767 15.302 1.00 0.00 C ATOM 1105 O THR A 65 4.453 -3.162 16.084 1.00 0.00 O ATOM 1106 CB THR A 65 4.016 -0.714 13.886 1.00 0.00 C ATOM 1107 OG1 THR A 65 4.376 -0.266 12.586 1.00 0.00 O ATOM 1108 CG2 THR A 65 5.021 -0.173 14.905 1.00 0.00 C ATOM 0 H THR A 65 2.493 -1.978 12.430 1.00 0.00 H new ATOM 0 HA THR A 65 5.020 -2.644 13.705 1.00 0.00 H new ATOM 0 HB THR A 65 3.019 -0.353 14.138 1.00 0.00 H new ATOM 0 HG1 THR A 65 3.565 -0.099 12.061 1.00 0.00 H new ATOM 0 HG21 THR A 65 5.012 0.917 14.882 1.00 0.00 H new ATOM 0 HG22 THR A 65 4.748 -0.517 15.903 1.00 0.00 H new ATOM 0 HG23 THR A 65 6.020 -0.533 14.657 1.00 0.00 H new ATOM 1116 N LEU A 66 2.336 -2.747 15.633 1.00 0.00 N ATOM 1117 CA LEU A 66 1.929 -3.221 17.003 1.00 0.00 C ATOM 1118 C LEU A 66 1.779 -4.759 17.081 1.00 0.00 C ATOM 1119 O LEU A 66 2.029 -5.341 18.121 1.00 0.00 O ATOM 1120 CB LEU A 66 0.605 -2.502 17.351 1.00 0.00 C ATOM 1121 CG LEU A 66 -0.561 -3.040 16.507 1.00 0.00 C ATOM 1122 CD1 LEU A 66 -1.175 -4.269 17.193 1.00 0.00 C ATOM 1123 CD2 LEU A 66 -1.627 -1.946 16.363 1.00 0.00 C ATOM 0 H LEU A 66 1.576 -2.431 15.031 1.00 0.00 H new ATOM 0 HA LEU A 66 2.707 -2.977 17.726 1.00 0.00 H new ATOM 0 HB2 LEU A 66 0.383 -2.637 18.410 1.00 0.00 H new ATOM 0 HB3 LEU A 66 0.715 -1.431 17.182 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.194 -3.327 15.522 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -2.001 -4.647 16.591 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -0.417 -5.045 17.296 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -1.544 -3.989 18.180 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.457 -2.323 15.765 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -1.991 -1.661 17.350 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.191 -1.076 15.872 1.00 0.00 H new ATOM 1135 N TYR A 67 1.361 -5.426 16.020 1.00 0.00 N ATOM 1136 CA TYR A 67 1.193 -6.927 16.108 1.00 0.00 C ATOM 1137 C TYR A 67 2.509 -7.673 15.808 1.00 0.00 C ATOM 1138 O TYR A 67 2.740 -8.741 16.346 1.00 0.00 O ATOM 1139 CB TYR A 67 0.108 -7.314 15.082 1.00 0.00 C ATOM 1140 CG TYR A 67 -0.135 -8.813 15.140 1.00 0.00 C ATOM 1141 CD1 TYR A 67 0.734 -9.684 14.471 1.00 0.00 C ATOM 1142 CD2 TYR A 67 -1.217 -9.330 15.869 1.00 0.00 C ATOM 1143 CE1 TYR A 67 0.523 -11.068 14.529 1.00 0.00 C ATOM 1144 CE2 TYR A 67 -1.427 -10.715 15.927 1.00 0.00 C ATOM 1145 CZ TYR A 67 -0.556 -11.583 15.258 1.00 0.00 C ATOM 1146 OH TYR A 67 -0.762 -12.946 15.314 1.00 0.00 O ATOM 0 H TYR A 67 1.133 -5.010 15.117 1.00 0.00 H new ATOM 0 HA TYR A 67 0.905 -7.211 17.120 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -0.816 -6.777 15.295 1.00 0.00 H new ATOM 0 HB3 TYR A 67 0.421 -7.024 14.079 1.00 0.00 H new ATOM 0 HD1 TYR A 67 1.568 -9.289 13.910 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -1.889 -8.660 16.386 1.00 0.00 H new ATOM 0 HE1 TYR A 67 1.193 -11.738 14.011 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -2.260 -11.112 16.488 1.00 0.00 H new ATOM 0 HH TYR A 67 -1.552 -13.135 15.862 1.00 0.00 H new ATOM 1156 N TYR A 68 3.363 -7.156 14.947 1.00 0.00 N ATOM 1157 CA TYR A 68 4.634 -7.899 14.632 1.00 0.00 C ATOM 1158 C TYR A 68 5.846 -7.375 15.437 1.00 0.00 C ATOM 1159 O TYR A 68 6.840 -8.069 15.548 1.00 0.00 O ATOM 1160 CB TYR A 68 4.863 -7.729 13.122 1.00 0.00 C ATOM 1161 CG TYR A 68 4.179 -8.854 12.376 1.00 0.00 C ATOM 1162 CD1 TYR A 68 4.645 -10.167 12.520 1.00 0.00 C ATOM 1163 CD2 TYR A 68 3.081 -8.588 11.540 1.00 0.00 C ATOM 1164 CE1 TYR A 68 4.017 -11.213 11.833 1.00 0.00 C ATOM 1165 CE2 TYR A 68 2.456 -9.636 10.854 1.00 0.00 C ATOM 1166 CZ TYR A 68 2.924 -10.948 11.001 1.00 0.00 C ATOM 1167 OH TYR A 68 2.306 -11.980 10.324 1.00 0.00 O ATOM 0 H TYR A 68 3.239 -6.270 14.458 1.00 0.00 H new ATOM 0 HA TYR A 68 4.536 -8.948 14.913 1.00 0.00 H new ATOM 0 HB2 TYR A 68 4.471 -6.768 12.790 1.00 0.00 H new ATOM 0 HB3 TYR A 68 5.931 -7.730 12.903 1.00 0.00 H new ATOM 0 HD1 TYR A 68 5.489 -10.373 13.161 1.00 0.00 H new ATOM 0 HD2 TYR A 68 2.720 -7.576 11.427 1.00 0.00 H new ATOM 0 HE1 TYR A 68 4.377 -12.225 11.945 1.00 0.00 H new ATOM 0 HE2 TYR A 68 1.612 -9.433 10.211 1.00 0.00 H new ATOM 0 HH TYR A 68 1.564 -11.624 9.792 1.00 0.00 H new ATOM 1177 N LYS A 69 5.793 -6.181 16.002 1.00 0.00 N ATOM 1178 CA LYS A 69 6.975 -5.683 16.785 1.00 0.00 C ATOM 1179 C LYS A 69 6.588 -5.434 18.254 1.00 0.00 C ATOM 1180 O LYS A 69 7.165 -6.016 19.152 1.00 0.00 O ATOM 1181 CB LYS A 69 7.397 -4.364 16.131 1.00 0.00 C ATOM 1182 CG LYS A 69 7.690 -4.569 14.644 1.00 0.00 C ATOM 1183 CD LYS A 69 7.519 -3.235 13.919 1.00 0.00 C ATOM 1184 CE LYS A 69 7.031 -3.485 12.490 1.00 0.00 C ATOM 1185 NZ LYS A 69 8.262 -3.459 11.652 1.00 0.00 N ATOM 0 H LYS A 69 4.998 -5.544 15.955 1.00 0.00 H new ATOM 0 HA LYS A 69 7.782 -6.415 16.778 1.00 0.00 H new ATOM 0 HB2 LYS A 69 6.607 -3.623 16.253 1.00 0.00 H new ATOM 0 HB3 LYS A 69 8.282 -3.971 16.631 1.00 0.00 H new ATOM 0 HG2 LYS A 69 8.704 -4.945 14.508 1.00 0.00 H new ATOM 0 HG3 LYS A 69 7.014 -5.315 14.226 1.00 0.00 H new ATOM 0 HD2 LYS A 69 6.805 -2.608 14.453 1.00 0.00 H new ATOM 0 HD3 LYS A 69 8.466 -2.695 13.901 1.00 0.00 H new ATOM 0 HE2 LYS A 69 6.519 -4.444 12.410 1.00 0.00 H new ATOM 0 HE3 LYS A 69 6.323 -2.719 12.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 8.000 -3.521 10.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 8.778 -2.572 11.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 8.869 -4.266 11.902 1.00 0.00 H new ATOM 1199 N ARG A 70 5.623 -4.571 18.508 1.00 0.00 N ATOM 1200 CA ARG A 70 5.226 -4.297 19.938 1.00 0.00 C ATOM 1201 C ARG A 70 4.566 -5.533 20.573 1.00 0.00 C ATOM 1202 O ARG A 70 4.643 -5.722 21.772 1.00 0.00 O ATOM 1203 CB ARG A 70 4.227 -3.129 19.903 1.00 0.00 C ATOM 1204 CG ARG A 70 4.035 -2.579 21.319 1.00 0.00 C ATOM 1205 CD ARG A 70 5.294 -1.823 21.754 1.00 0.00 C ATOM 1206 NE ARG A 70 5.503 -2.212 23.182 1.00 0.00 N ATOM 1207 CZ ARG A 70 4.683 -1.796 24.137 1.00 0.00 C ATOM 1208 NH1 ARG A 70 3.656 -1.022 23.867 1.00 0.00 N ATOM 1209 NH2 ARG A 70 4.894 -2.160 25.374 1.00 0.00 N ATOM 0 H ARG A 70 5.101 -4.052 17.802 1.00 0.00 H new ATOM 0 HA ARG A 70 6.103 -4.055 20.538 1.00 0.00 H new ATOM 0 HB2 ARG A 70 4.593 -2.343 19.243 1.00 0.00 H new ATOM 0 HB3 ARG A 70 3.272 -3.465 19.499 1.00 0.00 H new ATOM 0 HG2 ARG A 70 3.172 -1.914 21.347 1.00 0.00 H new ATOM 0 HG3 ARG A 70 3.831 -3.395 22.012 1.00 0.00 H new ATOM 0 HD2 ARG A 70 6.152 -2.098 21.140 1.00 0.00 H new ATOM 0 HD3 ARG A 70 5.162 -0.746 21.653 1.00 0.00 H new ATOM 0 HE ARG A 70 6.293 -2.810 23.427 1.00 0.00 H new ATOM 0 HH11 ARG A 70 3.477 -0.729 22.907 1.00 0.00 H new ATOM 0 HH12 ARG A 70 3.038 -0.714 24.618 1.00 0.00 H new ATOM 0 HH21 ARG A 70 5.686 -2.761 25.601 1.00 0.00 H new ATOM 0 HH22 ARG A 70 4.266 -1.843 26.113 1.00 0.00 H new ATOM 1223 N LYS A 71 3.903 -6.374 19.794 1.00 0.00 N ATOM 1224 CA LYS A 71 3.234 -7.585 20.373 1.00 0.00 C ATOM 1225 C LYS A 71 2.247 -7.164 21.472 1.00 0.00 C ATOM 1226 O LYS A 71 2.166 -7.789 22.513 1.00 0.00 O ATOM 1227 CB LYS A 71 4.355 -8.462 20.948 1.00 0.00 C ATOM 1228 CG LYS A 71 5.350 -8.817 19.839 1.00 0.00 C ATOM 1229 CD LYS A 71 5.930 -10.209 20.098 1.00 0.00 C ATOM 1230 CE LYS A 71 6.238 -10.891 18.763 1.00 0.00 C ATOM 1231 NZ LYS A 71 5.915 -12.329 18.982 1.00 0.00 N ATOM 0 H LYS A 71 3.801 -6.268 18.785 1.00 0.00 H new ATOM 0 HA LYS A 71 2.664 -8.130 19.621 1.00 0.00 H new ATOM 0 HB2 LYS A 71 4.866 -7.935 21.754 1.00 0.00 H new ATOM 0 HB3 LYS A 71 3.935 -9.371 21.378 1.00 0.00 H new ATOM 0 HG2 LYS A 71 4.853 -8.793 18.869 1.00 0.00 H new ATOM 0 HG3 LYS A 71 6.151 -8.079 19.805 1.00 0.00 H new ATOM 0 HD2 LYS A 71 6.838 -10.131 20.696 1.00 0.00 H new ATOM 0 HD3 LYS A 71 5.222 -10.809 20.670 1.00 0.00 H new ATOM 0 HE2 LYS A 71 5.638 -10.470 17.957 1.00 0.00 H new ATOM 0 HE3 LYS A 71 7.283 -10.759 18.484 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 6.101 -12.863 18.109 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 6.507 -12.705 19.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 4.912 -12.424 19.239 1.00 0.00 H new ATOM 1245 N ALA A 72 1.483 -6.117 21.237 1.00 0.00 N ATOM 1246 CA ALA A 72 0.488 -5.669 22.261 1.00 0.00 C ATOM 1247 C ALA A 72 -0.941 -5.944 21.757 1.00 0.00 C ATOM 1248 O ALA A 72 -1.853 -5.186 22.031 1.00 0.00 O ATOM 1249 CB ALA A 72 0.722 -4.165 22.423 1.00 0.00 C ATOM 0 H ALA A 72 1.508 -5.559 20.384 1.00 0.00 H new ATOM 0 HA ALA A 72 0.603 -6.197 23.208 1.00 0.00 H new ATOM 0 HB1 ALA A 72 0.026 -3.766 23.161 1.00 0.00 H new ATOM 0 HB2 ALA A 72 1.745 -3.990 22.757 1.00 0.00 H new ATOM 0 HB3 ALA A 72 0.562 -3.667 21.467 1.00 0.00 H new ATOM 1255 N ILE A 73 -1.145 -7.022 21.023 1.00 0.00 N ATOM 1256 CA ILE A 73 -2.515 -7.337 20.507 1.00 0.00 C ATOM 1257 C ILE A 73 -2.661 -8.859 20.312 1.00 0.00 C ATOM 1258 O ILE A 73 -1.673 -9.569 20.261 1.00 0.00 O ATOM 1259 CB ILE A 73 -2.618 -6.592 19.166 1.00 0.00 C ATOM 1260 CG1 ILE A 73 -3.987 -6.861 18.530 1.00 0.00 C ATOM 1261 CG2 ILE A 73 -1.514 -7.065 18.214 1.00 0.00 C ATOM 1262 CD1 ILE A 73 -4.146 -6.007 17.269 1.00 0.00 C ATOM 0 H ILE A 73 -0.421 -7.692 20.763 1.00 0.00 H new ATOM 0 HA ILE A 73 -3.305 -7.030 21.193 1.00 0.00 H new ATOM 0 HB ILE A 73 -2.502 -5.523 19.347 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -4.081 -7.918 18.280 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -4.781 -6.630 19.240 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -1.596 -6.531 17.267 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -0.539 -6.866 18.659 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -1.620 -8.135 18.037 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -5.120 -6.200 16.819 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -4.071 -4.952 17.532 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -3.361 -6.260 16.557 1.00 0.00 H new ATOM 1274 N SER A 74 -3.869 -9.367 20.203 1.00 0.00 N ATOM 1275 CA SER A 74 -4.037 -10.841 20.013 1.00 0.00 C ATOM 1276 C SER A 74 -4.496 -11.148 18.580 1.00 0.00 C ATOM 1277 O SER A 74 -5.246 -10.391 17.994 1.00 0.00 O ATOM 1278 CB SER A 74 -5.107 -11.263 21.022 1.00 0.00 C ATOM 1279 OG SER A 74 -4.483 -11.603 22.253 1.00 0.00 O ATOM 0 H SER A 74 -4.735 -8.829 20.237 1.00 0.00 H new ATOM 0 HA SER A 74 -3.102 -11.379 20.168 1.00 0.00 H new ATOM 0 HB2 SER A 74 -5.820 -10.453 21.174 1.00 0.00 H new ATOM 0 HB3 SER A 74 -5.669 -12.114 20.639 1.00 0.00 H new ATOM 0 HG SER A 74 -5.166 -11.872 22.902 1.00 0.00 H new ATOM 1285 N LYS A 75 -4.048 -12.253 18.006 1.00 0.00 N ATOM 1286 CA LYS A 75 -4.463 -12.613 16.594 1.00 0.00 C ATOM 1287 C LYS A 75 -5.981 -12.440 16.386 1.00 0.00 C ATOM 1288 O LYS A 75 -6.415 -12.100 15.303 1.00 0.00 O ATOM 1289 CB LYS A 75 -4.078 -14.086 16.388 1.00 0.00 C ATOM 1290 CG LYS A 75 -3.943 -14.374 14.891 1.00 0.00 C ATOM 1291 CD LYS A 75 -2.984 -15.546 14.682 1.00 0.00 C ATOM 1292 CE LYS A 75 -2.407 -15.488 13.266 1.00 0.00 C ATOM 1293 NZ LYS A 75 -1.145 -14.707 13.396 1.00 0.00 N ATOM 0 H LYS A 75 -3.416 -12.919 18.451 1.00 0.00 H new ATOM 0 HA LYS A 75 -3.967 -11.956 15.879 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -3.139 -14.302 16.897 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -4.835 -14.736 16.827 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -4.919 -14.608 14.465 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -3.573 -13.490 14.372 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -2.179 -15.506 15.416 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -3.508 -16.490 14.834 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -2.214 -16.488 12.877 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -3.100 -15.006 12.577 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -1.021 -14.105 12.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -1.192 -14.110 14.246 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -0.339 -15.360 13.476 1.00 0.00 H new ATOM 1307 N ASP A 76 -6.795 -12.660 17.404 1.00 0.00 N ATOM 1308 CA ASP A 76 -8.279 -12.482 17.213 1.00 0.00 C ATOM 1309 C ASP A 76 -8.571 -11.023 16.838 1.00 0.00 C ATOM 1310 O ASP A 76 -9.256 -10.761 15.867 1.00 0.00 O ATOM 1311 CB ASP A 76 -8.952 -12.836 18.549 1.00 0.00 C ATOM 1312 CG ASP A 76 -8.983 -14.356 18.719 1.00 0.00 C ATOM 1313 OD1 ASP A 76 -7.999 -14.991 18.373 1.00 0.00 O ATOM 1314 OD2 ASP A 76 -9.988 -14.860 19.190 1.00 0.00 O ATOM 0 H ASP A 76 -6.503 -12.949 18.338 1.00 0.00 H new ATOM 0 HA ASP A 76 -8.658 -13.121 16.416 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -8.408 -12.378 19.375 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -9.966 -12.436 18.575 1.00 0.00 H new ATOM 1319 N LEU A 77 -8.041 -10.069 17.580 1.00 0.00 N ATOM 1320 CA LEU A 77 -8.291 -8.630 17.213 1.00 0.00 C ATOM 1321 C LEU A 77 -7.564 -8.336 15.894 1.00 0.00 C ATOM 1322 O LEU A 77 -8.120 -7.731 14.999 1.00 0.00 O ATOM 1323 CB LEU A 77 -7.722 -7.761 18.349 1.00 0.00 C ATOM 1324 CG LEU A 77 -7.944 -6.280 18.020 1.00 0.00 C ATOM 1325 CD1 LEU A 77 -9.433 -5.944 18.138 1.00 0.00 C ATOM 1326 CD2 LEU A 77 -7.143 -5.410 18.996 1.00 0.00 C ATOM 0 H LEU A 77 -7.460 -10.219 18.405 1.00 0.00 H new ATOM 0 HA LEU A 77 -9.353 -8.420 17.085 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -8.208 -8.012 19.292 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -6.658 -7.961 18.476 1.00 0.00 H new ATOM 0 HG LEU A 77 -7.609 -6.084 17.002 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -9.588 -4.891 17.904 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -10.001 -6.559 17.440 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -9.771 -6.143 19.155 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -7.302 -4.358 18.760 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -7.474 -5.608 20.016 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -6.082 -5.645 18.907 1.00 0.00 H new ATOM 1338 N TYR A 78 -6.328 -8.780 15.759 1.00 0.00 N ATOM 1339 CA TYR A 78 -5.584 -8.532 14.473 1.00 0.00 C ATOM 1340 C TYR A 78 -6.352 -9.178 13.302 1.00 0.00 C ATOM 1341 O TYR A 78 -6.422 -8.616 12.223 1.00 0.00 O ATOM 1342 CB TYR A 78 -4.185 -9.169 14.639 1.00 0.00 C ATOM 1343 CG TYR A 78 -3.380 -9.046 13.358 1.00 0.00 C ATOM 1344 CD1 TYR A 78 -3.398 -7.855 12.617 1.00 0.00 C ATOM 1345 CD2 TYR A 78 -2.607 -10.128 12.919 1.00 0.00 C ATOM 1346 CE1 TYR A 78 -2.646 -7.749 11.441 1.00 0.00 C ATOM 1347 CE2 TYR A 78 -1.856 -10.020 11.741 1.00 0.00 C ATOM 1348 CZ TYR A 78 -1.876 -8.832 11.003 1.00 0.00 C ATOM 1349 OH TYR A 78 -1.134 -8.727 9.845 1.00 0.00 O ATOM 0 H TYR A 78 -5.810 -9.295 16.471 1.00 0.00 H new ATOM 0 HA TYR A 78 -5.491 -7.468 14.257 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -3.653 -8.681 15.456 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -4.289 -10.220 14.909 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -3.993 -7.019 12.954 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -2.590 -11.046 13.488 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -2.660 -6.831 10.872 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -1.261 -10.855 11.402 1.00 0.00 H new ATOM 0 HH TYR A 78 -0.657 -9.568 9.685 1.00 0.00 H new ATOM 1359 N ASP A 79 -6.949 -10.340 13.504 1.00 0.00 N ATOM 1360 CA ASP A 79 -7.726 -10.980 12.384 1.00 0.00 C ATOM 1361 C ASP A 79 -9.014 -10.178 12.150 1.00 0.00 C ATOM 1362 O ASP A 79 -9.397 -9.931 11.021 1.00 0.00 O ATOM 1363 CB ASP A 79 -8.060 -12.412 12.829 1.00 0.00 C ATOM 1364 CG ASP A 79 -8.554 -13.220 11.627 1.00 0.00 C ATOM 1365 OD1 ASP A 79 -9.608 -12.890 11.109 1.00 0.00 O ATOM 1366 OD2 ASP A 79 -7.870 -14.155 11.245 1.00 0.00 O ATOM 0 H ASP A 79 -6.932 -10.863 14.380 1.00 0.00 H new ATOM 0 HA ASP A 79 -7.156 -10.996 11.455 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -7.178 -12.885 13.260 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -8.824 -12.393 13.606 1.00 0.00 H new ATOM 1371 N TRP A 80 -9.682 -9.751 13.208 1.00 0.00 N ATOM 1372 CA TRP A 80 -10.943 -8.941 13.025 1.00 0.00 C ATOM 1373 C TRP A 80 -10.633 -7.690 12.182 1.00 0.00 C ATOM 1374 O TRP A 80 -11.411 -7.309 11.328 1.00 0.00 O ATOM 1375 CB TRP A 80 -11.411 -8.536 14.436 1.00 0.00 C ATOM 1376 CG TRP A 80 -12.686 -7.758 14.354 1.00 0.00 C ATOM 1377 CD1 TRP A 80 -13.903 -8.282 14.079 1.00 0.00 C ATOM 1378 CD2 TRP A 80 -12.892 -6.329 14.552 1.00 0.00 C ATOM 1379 NE1 TRP A 80 -14.842 -7.265 14.094 1.00 0.00 N ATOM 1380 CE2 TRP A 80 -14.266 -6.042 14.381 1.00 0.00 C ATOM 1381 CE3 TRP A 80 -12.027 -5.265 14.858 1.00 0.00 C ATOM 1382 CZ2 TRP A 80 -14.763 -4.744 14.510 1.00 0.00 C ATOM 1383 CZ3 TRP A 80 -12.523 -3.958 14.987 1.00 0.00 C ATOM 1384 CH2 TRP A 80 -13.888 -3.698 14.813 1.00 0.00 C ATOM 0 H TRP A 80 -9.413 -9.925 14.176 1.00 0.00 H new ATOM 0 HA TRP A 80 -11.716 -9.510 12.508 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -11.558 -9.426 15.048 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -10.642 -7.937 14.924 1.00 0.00 H new ATOM 0 HD1 TRP A 80 -14.108 -9.324 13.880 1.00 0.00 H new ATOM 0 HE1 TRP A 80 -15.837 -7.402 13.915 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -10.973 -5.454 14.995 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 -15.817 -4.550 14.376 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 -11.848 -3.148 15.222 1.00 0.00 H new ATOM 0 HH2 TRP A 80 -14.264 -2.690 14.913 1.00 0.00 H new ATOM 1395 N LEU A 81 -9.495 -7.058 12.402 1.00 0.00 N ATOM 1396 CA LEU A 81 -9.153 -5.843 11.581 1.00 0.00 C ATOM 1397 C LEU A 81 -8.947 -6.264 10.118 1.00 0.00 C ATOM 1398 O LEU A 81 -9.534 -5.695 9.218 1.00 0.00 O ATOM 1399 CB LEU A 81 -7.845 -5.269 12.153 1.00 0.00 C ATOM 1400 CG LEU A 81 -8.164 -4.276 13.272 1.00 0.00 C ATOM 1401 CD1 LEU A 81 -8.296 -5.023 14.599 1.00 0.00 C ATOM 1402 CD2 LEU A 81 -7.033 -3.252 13.379 1.00 0.00 C ATOM 0 H LEU A 81 -8.801 -7.325 13.101 1.00 0.00 H new ATOM 0 HA LEU A 81 -9.949 -5.099 11.618 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -7.220 -6.075 12.536 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.278 -4.774 11.365 1.00 0.00 H new ATOM 0 HG LEU A 81 -9.101 -3.767 13.047 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -8.523 -4.314 15.395 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -9.100 -5.756 14.526 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -7.359 -5.533 14.824 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -7.258 -2.543 14.176 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -6.098 -3.765 13.603 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -6.936 -2.717 12.434 1.00 0.00 H new ATOM 1414 N ILE A 82 -8.128 -7.270 9.870 1.00 0.00 N ATOM 1415 CA ILE A 82 -7.907 -7.722 8.444 1.00 0.00 C ATOM 1416 C ILE A 82 -9.258 -8.089 7.790 1.00 0.00 C ATOM 1417 O ILE A 82 -9.448 -7.875 6.606 1.00 0.00 O ATOM 1418 CB ILE A 82 -6.975 -8.960 8.506 1.00 0.00 C ATOM 1419 CG1 ILE A 82 -5.583 -8.552 9.026 1.00 0.00 C ATOM 1420 CG2 ILE A 82 -6.826 -9.588 7.112 1.00 0.00 C ATOM 1421 CD1 ILE A 82 -4.949 -7.500 8.104 1.00 0.00 C ATOM 0 H ILE A 82 -7.611 -7.791 10.578 1.00 0.00 H new ATOM 0 HA ILE A 82 -7.457 -6.931 7.843 1.00 0.00 H new ATOM 0 HB ILE A 82 -7.419 -9.688 9.185 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -5.669 -8.153 10.037 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -4.939 -9.429 9.083 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -6.169 -10.456 7.172 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -7.805 -9.899 6.746 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -6.398 -8.856 6.427 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -3.967 -7.225 8.488 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -4.844 -7.912 7.100 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -5.586 -6.616 8.069 1.00 0.00 H new ATOM 1433 N LYS A 83 -10.196 -8.640 8.540 1.00 0.00 N ATOM 1434 CA LYS A 83 -11.522 -9.010 7.924 1.00 0.00 C ATOM 1435 C LYS A 83 -12.548 -7.853 7.986 1.00 0.00 C ATOM 1436 O LYS A 83 -13.627 -7.973 7.436 1.00 0.00 O ATOM 1437 CB LYS A 83 -12.039 -10.214 8.723 1.00 0.00 C ATOM 1438 CG LYS A 83 -11.146 -11.427 8.457 1.00 0.00 C ATOM 1439 CD LYS A 83 -11.621 -12.144 7.191 1.00 0.00 C ATOM 1440 CE LYS A 83 -10.459 -12.936 6.587 1.00 0.00 C ATOM 1441 NZ LYS A 83 -11.087 -14.157 6.007 1.00 0.00 N ATOM 0 H LYS A 83 -10.103 -8.846 9.535 1.00 0.00 H new ATOM 0 HA LYS A 83 -11.390 -9.237 6.866 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -12.046 -9.981 9.788 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -13.067 -10.437 8.439 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -10.110 -11.110 8.341 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -11.178 -12.108 9.307 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -12.447 -12.814 7.428 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -11.996 -11.419 6.468 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -9.941 -12.357 5.822 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -9.720 -13.194 7.346 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -10.353 -14.752 5.573 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -11.566 -14.692 6.759 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -11.781 -13.880 5.283 1.00 0.00 H new ATOM 1455 N GLU A 84 -12.248 -6.741 8.640 1.00 0.00 N ATOM 1456 CA GLU A 84 -13.250 -5.623 8.701 1.00 0.00 C ATOM 1457 C GLU A 84 -12.752 -4.356 7.966 1.00 0.00 C ATOM 1458 O GLU A 84 -13.194 -3.264 8.261 1.00 0.00 O ATOM 1459 CB GLU A 84 -13.409 -5.333 10.183 1.00 0.00 C ATOM 1460 CG GLU A 84 -14.015 -6.544 10.887 1.00 0.00 C ATOM 1461 CD GLU A 84 -15.504 -6.640 10.551 1.00 0.00 C ATOM 1462 OE1 GLU A 84 -16.227 -5.716 10.887 1.00 0.00 O ATOM 1463 OE2 GLU A 84 -15.895 -7.635 9.964 1.00 0.00 O ATOM 0 H GLU A 84 -11.367 -6.566 9.124 1.00 0.00 H new ATOM 0 HA GLU A 84 -14.184 -5.904 8.215 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -12.440 -5.094 10.622 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -14.048 -4.461 10.325 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -13.502 -7.454 10.575 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -13.880 -6.456 11.965 1.00 0.00 H new ATOM 1470 N LYS A 85 -11.844 -4.493 7.010 1.00 0.00 N ATOM 1471 CA LYS A 85 -11.305 -3.317 6.227 1.00 0.00 C ATOM 1472 C LYS A 85 -10.308 -2.495 7.052 1.00 0.00 C ATOM 1473 O LYS A 85 -10.590 -1.382 7.455 1.00 0.00 O ATOM 1474 CB LYS A 85 -12.503 -2.457 5.791 1.00 0.00 C ATOM 1475 CG LYS A 85 -12.220 -1.846 4.418 1.00 0.00 C ATOM 1476 CD LYS A 85 -13.199 -0.701 4.155 1.00 0.00 C ATOM 1477 CE LYS A 85 -12.573 0.292 3.174 1.00 0.00 C ATOM 1478 NZ LYS A 85 -13.012 1.633 3.650 1.00 0.00 N ATOM 0 H LYS A 85 -11.447 -5.391 6.735 1.00 0.00 H new ATOM 0 HA LYS A 85 -10.758 -3.676 5.355 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -13.406 -3.066 5.750 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -12.683 -1.668 6.522 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -11.195 -1.478 4.377 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -12.317 -2.606 3.643 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -14.131 -1.092 3.747 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -13.446 -0.198 5.090 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -11.486 0.211 3.170 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -12.910 0.105 2.154 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -12.622 2.368 3.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -14.051 1.683 3.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -12.671 1.786 4.620 1.00 0.00 H new ATOM 1492 N TYR A 86 -9.130 -3.037 7.294 1.00 0.00 N ATOM 1493 CA TYR A 86 -8.100 -2.296 8.075 1.00 0.00 C ATOM 1494 C TYR A 86 -6.760 -2.356 7.330 1.00 0.00 C ATOM 1495 O TYR A 86 -6.229 -1.344 6.913 1.00 0.00 O ATOM 1496 CB TYR A 86 -7.998 -3.042 9.406 1.00 0.00 C ATOM 1497 CG TYR A 86 -9.173 -2.681 10.282 1.00 0.00 C ATOM 1498 CD1 TYR A 86 -10.463 -3.133 9.961 1.00 0.00 C ATOM 1499 CD2 TYR A 86 -8.970 -1.892 11.420 1.00 0.00 C ATOM 1500 CE1 TYR A 86 -11.543 -2.787 10.785 1.00 0.00 C ATOM 1501 CE2 TYR A 86 -10.050 -1.551 12.240 1.00 0.00 C ATOM 1502 CZ TYR A 86 -11.337 -1.997 11.921 1.00 0.00 C ATOM 1503 OH TYR A 86 -12.402 -1.661 12.730 1.00 0.00 O ATOM 0 H TYR A 86 -8.845 -3.964 6.979 1.00 0.00 H new ATOM 0 HA TYR A 86 -8.355 -1.246 8.218 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -7.980 -4.118 9.231 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -7.065 -2.785 9.908 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -10.622 -3.744 9.085 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -7.977 -1.546 11.665 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -12.537 -3.131 10.542 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -9.891 -0.944 13.119 1.00 0.00 H new ATOM 0 HH TYR A 86 -12.564 -2.382 13.373 1.00 0.00 H new ATOM 1513 N ALA A 87 -6.218 -3.540 7.150 1.00 0.00 N ATOM 1514 CA ALA A 87 -4.923 -3.679 6.424 1.00 0.00 C ATOM 1515 C ALA A 87 -5.006 -4.862 5.448 1.00 0.00 C ATOM 1516 O ALA A 87 -6.000 -5.565 5.417 1.00 0.00 O ATOM 1517 CB ALA A 87 -3.883 -3.947 7.512 1.00 0.00 C ATOM 0 H ALA A 87 -6.623 -4.417 7.478 1.00 0.00 H new ATOM 0 HA ALA A 87 -4.672 -2.794 5.839 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -2.900 -4.061 7.055 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -3.863 -3.111 8.211 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -4.143 -4.860 8.047 1.00 0.00 H new ATOM 1523 N ASP A 88 -3.982 -5.094 4.654 1.00 0.00 N ATOM 1524 CA ASP A 88 -4.032 -6.237 3.692 1.00 0.00 C ATOM 1525 C ASP A 88 -2.973 -7.290 4.055 1.00 0.00 C ATOM 1526 O ASP A 88 -1.790 -7.067 3.874 1.00 0.00 O ATOM 1527 CB ASP A 88 -3.728 -5.625 2.324 1.00 0.00 C ATOM 1528 CG ASP A 88 -3.966 -6.672 1.234 1.00 0.00 C ATOM 1529 OD1 ASP A 88 -3.441 -7.766 1.366 1.00 0.00 O ATOM 1530 OD2 ASP A 88 -4.670 -6.363 0.286 1.00 0.00 O ATOM 0 H ASP A 88 -3.123 -4.544 4.633 1.00 0.00 H new ATOM 0 HA ASP A 88 -4.999 -6.740 3.708 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -4.363 -4.756 2.153 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -2.695 -5.277 2.290 1.00 0.00 H new ATOM 1535 N LYS A 89 -3.382 -8.440 4.557 1.00 0.00 N ATOM 1536 CA LYS A 89 -2.368 -9.498 4.917 1.00 0.00 C ATOM 1537 C LYS A 89 -1.554 -9.882 3.671 1.00 0.00 C ATOM 1538 O LYS A 89 -0.354 -10.073 3.748 1.00 0.00 O ATOM 1539 CB LYS A 89 -3.157 -10.715 5.430 1.00 0.00 C ATOM 1540 CG LYS A 89 -3.348 -10.599 6.942 1.00 0.00 C ATOM 1541 CD LYS A 89 -4.137 -11.806 7.452 1.00 0.00 C ATOM 1542 CE LYS A 89 -3.190 -12.991 7.647 1.00 0.00 C ATOM 1543 NZ LYS A 89 -2.849 -12.975 9.097 1.00 0.00 N ATOM 0 H LYS A 89 -4.356 -8.690 4.731 1.00 0.00 H new ATOM 0 HA LYS A 89 -1.673 -9.138 5.676 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -4.126 -10.769 4.934 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -2.624 -11.635 5.190 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -2.379 -10.549 7.439 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -3.878 -9.677 7.182 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -4.628 -11.561 8.394 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -4.922 -12.067 6.742 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -3.668 -13.929 7.364 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -2.297 -12.889 7.030 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -2.201 -13.760 9.310 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -2.390 -12.073 9.336 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -3.718 -13.081 9.659 1.00 0.00 H new ATOM 1557 N LEU A 90 -2.192 -9.993 2.520 1.00 0.00 N ATOM 1558 CA LEU A 90 -1.423 -10.361 1.276 1.00 0.00 C ATOM 1559 C LEU A 90 -0.340 -9.305 0.997 1.00 0.00 C ATOM 1560 O LEU A 90 0.754 -9.640 0.580 1.00 0.00 O ATOM 1561 CB LEU A 90 -2.436 -10.405 0.122 1.00 0.00 C ATOM 1562 CG LEU A 90 -1.784 -11.042 -1.107 1.00 0.00 C ATOM 1563 CD1 LEU A 90 -1.691 -12.556 -0.910 1.00 0.00 C ATOM 1564 CD2 LEU A 90 -2.628 -10.741 -2.349 1.00 0.00 C ATOM 0 H LEU A 90 -3.193 -9.848 2.389 1.00 0.00 H new ATOM 0 HA LEU A 90 -0.926 -11.324 1.391 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -3.315 -10.977 0.418 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -2.777 -9.397 -0.115 1.00 0.00 H new ATOM 0 HG LEU A 90 -0.783 -10.630 -1.239 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -1.226 -13.009 -1.786 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -1.089 -12.772 -0.027 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -2.691 -12.968 -0.776 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -2.163 -11.195 -3.224 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -3.629 -11.151 -2.217 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -2.694 -9.662 -2.492 1.00 0.00 H new ATOM 1576 N LEU A 91 -0.620 -8.034 1.231 1.00 0.00 N ATOM 1577 CA LEU A 91 0.433 -6.988 0.978 1.00 0.00 C ATOM 1578 C LEU A 91 1.554 -7.155 2.011 1.00 0.00 C ATOM 1579 O LEU A 91 2.716 -7.235 1.657 1.00 0.00 O ATOM 1580 CB LEU A 91 -0.244 -5.613 1.124 1.00 0.00 C ATOM 1581 CG LEU A 91 0.785 -4.499 0.889 1.00 0.00 C ATOM 1582 CD1 LEU A 91 1.346 -4.587 -0.541 1.00 0.00 C ATOM 1583 CD2 LEU A 91 0.109 -3.140 1.096 1.00 0.00 C ATOM 0 H LEU A 91 -1.513 -7.684 1.579 1.00 0.00 H new ATOM 0 HA LEU A 91 0.867 -7.083 -0.017 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -1.061 -5.522 0.409 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -0.679 -5.515 2.119 1.00 0.00 H new ATOM 0 HG LEU A 91 1.608 -4.614 1.595 1.00 0.00 H new ATOM 0 HD11 LEU A 91 2.075 -3.791 -0.695 1.00 0.00 H new ATOM 0 HD12 LEU A 91 1.828 -5.554 -0.684 1.00 0.00 H new ATOM 0 HD13 LEU A 91 0.533 -4.478 -1.258 1.00 0.00 H new ATOM 0 HD21 LEU A 91 0.835 -2.344 0.931 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -0.715 -3.032 0.391 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -0.274 -3.076 2.114 1.00 0.00 H new ATOM 1595 N ILE A 92 1.220 -7.240 3.287 1.00 0.00 N ATOM 1596 CA ILE A 92 2.297 -7.441 4.325 1.00 0.00 C ATOM 1597 C ILE A 92 3.072 -8.735 3.994 1.00 0.00 C ATOM 1598 O ILE A 92 4.276 -8.794 4.159 1.00 0.00 O ATOM 1599 CB ILE A 92 1.583 -7.531 5.698 1.00 0.00 C ATOM 1600 CG1 ILE A 92 1.029 -6.141 6.059 1.00 0.00 C ATOM 1601 CG2 ILE A 92 2.568 -7.986 6.785 1.00 0.00 C ATOM 1602 CD1 ILE A 92 0.314 -6.182 7.419 1.00 0.00 C ATOM 0 H ILE A 92 0.268 -7.180 3.649 1.00 0.00 H new ATOM 0 HA ILE A 92 3.018 -6.623 4.343 1.00 0.00 H new ATOM 0 HB ILE A 92 0.772 -8.257 5.636 1.00 0.00 H new ATOM 0 HG12 ILE A 92 1.842 -5.416 6.091 1.00 0.00 H new ATOM 0 HG13 ILE A 92 0.335 -5.808 5.287 1.00 0.00 H new ATOM 0 HG21 ILE A 92 2.051 -8.044 7.743 1.00 0.00 H new ATOM 0 HG22 ILE A 92 2.966 -8.967 6.527 1.00 0.00 H new ATOM 0 HG23 ILE A 92 3.386 -7.270 6.857 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -0.071 -5.191 7.658 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -0.512 -6.891 7.374 1.00 0.00 H new ATOM 0 HD13 ILE A 92 1.018 -6.493 8.191 1.00 0.00 H new ATOM 1614 N ALA A 93 2.397 -9.761 3.502 1.00 0.00 N ATOM 1615 CA ALA A 93 3.132 -11.024 3.139 1.00 0.00 C ATOM 1616 C ALA A 93 4.072 -10.741 1.956 1.00 0.00 C ATOM 1617 O ALA A 93 5.188 -11.222 1.926 1.00 0.00 O ATOM 1618 CB ALA A 93 2.069 -12.060 2.738 1.00 0.00 C ATOM 0 H ALA A 93 1.390 -9.777 3.340 1.00 0.00 H new ATOM 0 HA ALA A 93 3.731 -11.392 3.972 1.00 0.00 H new ATOM 0 HB1 ALA A 93 2.557 -12.996 2.466 1.00 0.00 H new ATOM 0 HB2 ALA A 93 1.395 -12.233 3.577 1.00 0.00 H new ATOM 0 HB3 ALA A 93 1.500 -11.687 1.887 1.00 0.00 H new ATOM 1624 N LYS A 94 3.641 -9.950 0.983 1.00 0.00 N ATOM 1625 CA LYS A 94 4.548 -9.641 -0.185 1.00 0.00 C ATOM 1626 C LYS A 94 5.843 -9.002 0.331 1.00 0.00 C ATOM 1627 O LYS A 94 6.925 -9.384 -0.069 1.00 0.00 O ATOM 1628 CB LYS A 94 3.807 -8.636 -1.089 1.00 0.00 C ATOM 1629 CG LYS A 94 2.969 -9.366 -2.144 1.00 0.00 C ATOM 1630 CD LYS A 94 3.875 -10.214 -3.037 1.00 0.00 C ATOM 1631 CE LYS A 94 3.254 -10.318 -4.433 1.00 0.00 C ATOM 1632 NZ LYS A 94 3.490 -11.728 -4.854 1.00 0.00 N ATOM 0 H LYS A 94 2.719 -9.514 0.948 1.00 0.00 H new ATOM 0 HA LYS A 94 4.797 -10.549 -0.735 1.00 0.00 H new ATOM 0 HB2 LYS A 94 3.162 -8.001 -0.482 1.00 0.00 H new ATOM 0 HB3 LYS A 94 4.528 -7.982 -1.580 1.00 0.00 H new ATOM 0 HG2 LYS A 94 2.228 -10.000 -1.657 1.00 0.00 H new ATOM 0 HG3 LYS A 94 2.421 -8.643 -2.749 1.00 0.00 H new ATOM 0 HD2 LYS A 94 4.866 -9.765 -3.100 1.00 0.00 H new ATOM 0 HD3 LYS A 94 4.001 -11.208 -2.608 1.00 0.00 H new ATOM 0 HE2 LYS A 94 2.189 -10.086 -4.410 1.00 0.00 H new ATOM 0 HE3 LYS A 94 3.719 -9.616 -5.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 2.937 -11.932 -5.711 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 4.501 -11.866 -5.053 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 3.196 -12.372 -4.092 1.00 0.00 H new ATOM 1646 N TRP A 95 5.744 -8.040 1.228 1.00 0.00 N ATOM 1647 CA TRP A 95 7.000 -7.403 1.764 1.00 0.00 C ATOM 1648 C TRP A 95 7.909 -8.466 2.415 1.00 0.00 C ATOM 1649 O TRP A 95 9.112 -8.289 2.474 1.00 0.00 O ATOM 1650 CB TRP A 95 6.564 -6.351 2.803 1.00 0.00 C ATOM 1651 CG TRP A 95 6.254 -5.051 2.115 1.00 0.00 C ATOM 1652 CD1 TRP A 95 6.965 -4.514 1.093 1.00 0.00 C ATOM 1653 CD2 TRP A 95 5.170 -4.113 2.388 1.00 0.00 C ATOM 1654 NE1 TRP A 95 6.384 -3.316 0.721 1.00 0.00 N ATOM 1655 CE2 TRP A 95 5.277 -3.025 1.489 1.00 0.00 C ATOM 1656 CE3 TRP A 95 4.113 -4.101 3.318 1.00 0.00 C ATOM 1657 CZ2 TRP A 95 4.371 -1.965 1.510 1.00 0.00 C ATOM 1658 CZ3 TRP A 95 3.199 -3.034 3.342 1.00 0.00 C ATOM 1659 CH2 TRP A 95 3.328 -1.969 2.439 1.00 0.00 C ATOM 0 H TRP A 95 4.869 -7.675 1.605 1.00 0.00 H new ATOM 0 HA TRP A 95 7.572 -6.937 0.961 1.00 0.00 H new ATOM 0 HB2 TRP A 95 5.687 -6.704 3.345 1.00 0.00 H new ATOM 0 HB3 TRP A 95 7.355 -6.204 3.538 1.00 0.00 H new ATOM 0 HD1 TRP A 95 7.844 -4.952 0.642 1.00 0.00 H new ATOM 0 HE1 TRP A 95 6.732 -2.720 -0.030 1.00 0.00 H new ATOM 0 HE3 TRP A 95 4.004 -4.917 4.017 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 4.475 -1.147 0.813 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 2.392 -3.034 4.060 1.00 0.00 H new ATOM 0 HH2 TRP A 95 2.621 -1.152 2.462 1.00 0.00 H new ATOM 1670 N ARG A 96 7.360 -9.570 2.894 1.00 0.00 N ATOM 1671 CA ARG A 96 8.227 -10.621 3.519 1.00 0.00 C ATOM 1672 C ARG A 96 8.349 -11.866 2.612 1.00 0.00 C ATOM 1673 O ARG A 96 8.627 -12.947 3.100 1.00 0.00 O ATOM 1674 CB ARG A 96 7.533 -10.989 4.835 1.00 0.00 C ATOM 1675 CG ARG A 96 7.919 -9.982 5.922 1.00 0.00 C ATOM 1676 CD ARG A 96 6.714 -9.717 6.835 1.00 0.00 C ATOM 1677 NE ARG A 96 7.171 -10.097 8.209 1.00 0.00 N ATOM 1678 CZ ARG A 96 7.236 -11.364 8.588 1.00 0.00 C ATOM 1679 NH1 ARG A 96 6.912 -12.342 7.773 1.00 0.00 N ATOM 1680 NH2 ARG A 96 7.634 -11.656 9.800 1.00 0.00 N ATOM 0 H ARG A 96 6.362 -9.781 2.877 1.00 0.00 H new ATOM 0 HA ARG A 96 9.242 -10.254 3.674 1.00 0.00 H new ATOM 0 HB2 ARG A 96 6.452 -10.994 4.698 1.00 0.00 H new ATOM 0 HB3 ARG A 96 7.820 -11.995 5.140 1.00 0.00 H new ATOM 0 HG2 ARG A 96 8.753 -10.367 6.508 1.00 0.00 H new ATOM 0 HG3 ARG A 96 8.253 -9.050 5.466 1.00 0.00 H new ATOM 0 HD2 ARG A 96 6.413 -8.670 6.796 1.00 0.00 H new ATOM 0 HD3 ARG A 96 5.851 -10.309 6.529 1.00 0.00 H new ATOM 0 HE ARG A 96 7.438 -9.365 8.867 1.00 0.00 H new ATOM 0 HH11 ARG A 96 6.602 -12.133 6.824 1.00 0.00 H new ATOM 0 HH12 ARG A 96 6.971 -13.310 8.089 1.00 0.00 H new ATOM 0 HH21 ARG A 96 7.892 -10.910 10.446 1.00 0.00 H new ATOM 0 HH22 ARG A 96 7.686 -12.630 10.099 1.00 0.00 H new ATOM 1694 N LYS A 97 8.164 -11.741 1.306 1.00 0.00 N ATOM 1695 CA LYS A 97 8.300 -12.951 0.422 1.00 0.00 C ATOM 1696 C LYS A 97 9.747 -13.053 -0.111 1.00 0.00 C ATOM 1697 O LYS A 97 10.557 -13.762 0.454 1.00 0.00 O ATOM 1698 CB LYS A 97 7.292 -12.768 -0.727 1.00 0.00 C ATOM 1699 CG LYS A 97 5.947 -13.379 -0.363 1.00 0.00 C ATOM 1700 CD LYS A 97 6.097 -14.891 -0.183 1.00 0.00 C ATOM 1701 CE LYS A 97 4.727 -15.559 -0.311 1.00 0.00 C ATOM 1702 NZ LYS A 97 4.993 -16.852 -1.000 1.00 0.00 N ATOM 0 H LYS A 97 7.930 -10.871 0.827 1.00 0.00 H new ATOM 0 HA LYS A 97 8.094 -13.874 0.964 1.00 0.00 H new ATOM 0 HB2 LYS A 97 7.169 -11.707 -0.944 1.00 0.00 H new ATOM 0 HB3 LYS A 97 7.677 -13.236 -1.633 1.00 0.00 H new ATOM 0 HG2 LYS A 97 5.570 -12.930 0.556 1.00 0.00 H new ATOM 0 HG3 LYS A 97 5.217 -13.167 -1.145 1.00 0.00 H new ATOM 0 HD2 LYS A 97 6.780 -15.291 -0.933 1.00 0.00 H new ATOM 0 HD3 LYS A 97 6.531 -15.110 0.793 1.00 0.00 H new ATOM 0 HE2 LYS A 97 4.273 -15.719 0.667 1.00 0.00 H new ATOM 0 HE3 LYS A 97 4.038 -14.940 -0.885 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 4.099 -17.369 -1.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 5.419 -16.668 -1.931 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 5.647 -17.423 -0.427 1.00 0.00 H new ATOM 1716 N THR A 98 10.089 -12.350 -1.181 1.00 0.00 N ATOM 1717 CA THR A 98 11.493 -12.418 -1.722 1.00 0.00 C ATOM 1718 C THR A 98 11.661 -11.471 -2.926 1.00 0.00 C ATOM 1719 O THR A 98 10.877 -11.505 -3.857 1.00 0.00 O ATOM 1720 CB THR A 98 11.710 -13.874 -2.168 1.00 0.00 C ATOM 1721 OG1 THR A 98 13.000 -13.996 -2.749 1.00 0.00 O ATOM 1722 CG2 THR A 98 10.648 -14.271 -3.200 1.00 0.00 C ATOM 0 H THR A 98 9.458 -11.737 -1.697 1.00 0.00 H new ATOM 0 HA THR A 98 12.217 -12.113 -0.966 1.00 0.00 H new ATOM 0 HB THR A 98 11.628 -14.531 -1.302 1.00 0.00 H new ATOM 0 HG1 THR A 98 13.144 -14.923 -3.034 1.00 0.00 H new ATOM 0 HG21 THR A 98 10.810 -15.303 -3.510 1.00 0.00 H new ATOM 0 HG22 THR A 98 9.657 -14.176 -2.757 1.00 0.00 H new ATOM 0 HG23 THR A 98 10.721 -13.616 -4.068 1.00 0.00 H new ATOM 1730 N GLY A 99 12.672 -10.630 -2.915 1.00 0.00 N ATOM 1731 CA GLY A 99 12.879 -9.693 -4.057 1.00 0.00 C ATOM 1732 C GLY A 99 11.835 -8.554 -4.053 1.00 0.00 C ATOM 1733 O GLY A 99 11.735 -7.825 -5.023 1.00 0.00 O ATOM 0 H GLY A 99 13.358 -10.556 -2.164 1.00 0.00 H new ATOM 0 HA2 GLY A 99 13.882 -9.269 -4.003 1.00 0.00 H new ATOM 0 HA3 GLY A 99 12.815 -10.243 -4.996 1.00 0.00 H new ATOM 1737 N TYR A 100 11.065 -8.371 -2.989 1.00 0.00 N ATOM 1738 CA TYR A 100 10.062 -7.250 -2.992 1.00 0.00 C ATOM 1739 C TYR A 100 10.603 -6.050 -2.197 1.00 0.00 C ATOM 1740 O TYR A 100 9.901 -5.480 -1.383 1.00 0.00 O ATOM 1741 CB TYR A 100 8.797 -7.799 -2.321 1.00 0.00 C ATOM 1742 CG TYR A 100 8.061 -8.720 -3.268 1.00 0.00 C ATOM 1743 CD1 TYR A 100 7.757 -8.308 -4.572 1.00 0.00 C ATOM 1744 CD2 TYR A 100 7.680 -9.990 -2.832 1.00 0.00 C ATOM 1745 CE1 TYR A 100 7.072 -9.173 -5.435 1.00 0.00 C ATOM 1746 CE2 TYR A 100 6.997 -10.856 -3.689 1.00 0.00 C ATOM 1747 CZ TYR A 100 6.692 -10.448 -4.993 1.00 0.00 C ATOM 1748 OH TYR A 100 6.017 -11.300 -5.845 1.00 0.00 O ATOM 0 H TYR A 100 11.090 -8.937 -2.141 1.00 0.00 H new ATOM 0 HA TYR A 100 9.857 -6.908 -4.006 1.00 0.00 H new ATOM 0 HB2 TYR A 100 9.064 -8.338 -1.412 1.00 0.00 H new ATOM 0 HB3 TYR A 100 8.147 -6.976 -2.025 1.00 0.00 H new ATOM 0 HD1 TYR A 100 8.050 -7.325 -4.911 1.00 0.00 H new ATOM 0 HD2 TYR A 100 7.915 -10.305 -1.826 1.00 0.00 H new ATOM 0 HE1 TYR A 100 6.837 -8.858 -6.441 1.00 0.00 H new ATOM 0 HE2 TYR A 100 6.705 -11.838 -3.347 1.00 0.00 H new ATOM 0 HH TYR A 100 6.235 -12.228 -5.620 1.00 0.00 H new ATOM 1758 N GLU A 101 11.839 -5.654 -2.428 1.00 0.00 N ATOM 1759 CA GLU A 101 12.393 -4.473 -1.669 1.00 0.00 C ATOM 1760 C GLU A 101 11.582 -3.214 -2.014 1.00 0.00 C ATOM 1761 O GLU A 101 11.288 -2.409 -1.150 1.00 0.00 O ATOM 1762 CB GLU A 101 13.856 -4.302 -2.110 1.00 0.00 C ATOM 1763 CG GLU A 101 14.732 -5.316 -1.373 1.00 0.00 C ATOM 1764 CD GLU A 101 16.029 -5.535 -2.154 1.00 0.00 C ATOM 1765 OE1 GLU A 101 15.983 -6.226 -3.158 1.00 0.00 O ATOM 1766 OE2 GLU A 101 17.046 -5.005 -1.737 1.00 0.00 O ATOM 0 H GLU A 101 12.478 -6.086 -3.095 1.00 0.00 H new ATOM 0 HA GLU A 101 12.333 -4.630 -0.592 1.00 0.00 H new ATOM 0 HB2 GLU A 101 13.942 -4.446 -3.187 1.00 0.00 H new ATOM 0 HB3 GLU A 101 14.196 -3.289 -1.896 1.00 0.00 H new ATOM 0 HG2 GLU A 101 14.956 -4.956 -0.369 1.00 0.00 H new ATOM 0 HG3 GLU A 101 14.199 -6.260 -1.262 1.00 0.00 H new ATOM 1773 N LYS A 102 11.206 -3.041 -3.265 1.00 0.00 N ATOM 1774 CA LYS A 102 10.403 -1.840 -3.650 1.00 0.00 C ATOM 1775 C LYS A 102 8.986 -2.272 -4.049 1.00 0.00 C ATOM 1776 O LYS A 102 8.767 -2.747 -5.148 1.00 0.00 O ATOM 1777 CB LYS A 102 11.139 -1.228 -4.846 1.00 0.00 C ATOM 1778 CG LYS A 102 12.377 -0.458 -4.359 1.00 0.00 C ATOM 1779 CD LYS A 102 12.203 1.044 -4.632 1.00 0.00 C ATOM 1780 CE LYS A 102 13.509 1.627 -5.181 1.00 0.00 C ATOM 1781 NZ LYS A 102 14.138 2.321 -4.021 1.00 0.00 N ATOM 0 H LYS A 102 11.422 -3.680 -4.030 1.00 0.00 H new ATOM 0 HA LYS A 102 10.305 -1.125 -2.833 1.00 0.00 H new ATOM 0 HB2 LYS A 102 11.438 -2.013 -5.541 1.00 0.00 H new ATOM 0 HB3 LYS A 102 10.473 -0.558 -5.390 1.00 0.00 H new ATOM 0 HG2 LYS A 102 12.524 -0.627 -3.292 1.00 0.00 H new ATOM 0 HG3 LYS A 102 13.268 -0.827 -4.867 1.00 0.00 H new ATOM 0 HD2 LYS A 102 11.395 1.202 -5.346 1.00 0.00 H new ATOM 0 HD3 LYS A 102 11.922 1.560 -3.714 1.00 0.00 H new ATOM 0 HE2 LYS A 102 14.158 0.843 -5.571 1.00 0.00 H new ATOM 0 HE3 LYS A 102 13.318 2.320 -6.000 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 15.039 2.747 -4.318 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 13.500 3.066 -3.675 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 14.314 1.635 -3.260 1.00 0.00 H new ATOM 1795 N LEU A 103 8.021 -2.126 -3.163 1.00 0.00 N ATOM 1796 CA LEU A 103 6.628 -2.544 -3.498 1.00 0.00 C ATOM 1797 C LEU A 103 5.625 -1.482 -2.997 1.00 0.00 C ATOM 1798 O LEU A 103 5.705 -1.034 -1.867 1.00 0.00 O ATOM 1799 CB LEU A 103 6.465 -3.900 -2.777 1.00 0.00 C ATOM 1800 CG LEU A 103 4.986 -4.238 -2.539 1.00 0.00 C ATOM 1801 CD1 LEU A 103 4.255 -4.327 -3.882 1.00 0.00 C ATOM 1802 CD2 LEU A 103 4.886 -5.575 -1.804 1.00 0.00 C ATOM 0 H LEU A 103 8.144 -1.737 -2.228 1.00 0.00 H new ATOM 0 HA LEU A 103 6.440 -2.639 -4.568 1.00 0.00 H new ATOM 0 HB2 LEU A 103 6.928 -4.687 -3.372 1.00 0.00 H new ATOM 0 HB3 LEU A 103 6.991 -3.871 -1.823 1.00 0.00 H new ATOM 0 HG LEU A 103 4.525 -3.457 -1.935 1.00 0.00 H new ATOM 0 HD11 LEU A 103 3.206 -4.567 -3.710 1.00 0.00 H new ATOM 0 HD12 LEU A 103 4.328 -3.371 -4.400 1.00 0.00 H new ATOM 0 HD13 LEU A 103 4.710 -5.107 -4.493 1.00 0.00 H new ATOM 0 HD21 LEU A 103 3.837 -5.819 -1.633 1.00 0.00 H new ATOM 0 HD22 LEU A 103 5.347 -6.357 -2.407 1.00 0.00 H new ATOM 0 HD23 LEU A 103 5.403 -5.504 -0.847 1.00 0.00 H new ATOM 1814 N CYS A 104 4.683 -1.079 -3.829 1.00 0.00 N ATOM 1815 CA CYS A 104 3.687 -0.051 -3.384 1.00 0.00 C ATOM 1816 C CYS A 104 2.273 -0.651 -3.193 1.00 0.00 C ATOM 1817 O CYS A 104 1.580 -0.273 -2.270 1.00 0.00 O ATOM 1818 CB CYS A 104 3.715 1.072 -4.438 1.00 0.00 C ATOM 1819 SG CYS A 104 3.255 0.483 -6.092 1.00 0.00 S ATOM 0 H CYS A 104 4.565 -1.415 -4.785 1.00 0.00 H new ATOM 0 HA CYS A 104 3.951 0.343 -2.403 1.00 0.00 H new ATOM 0 HB2 CYS A 104 3.033 1.867 -4.136 1.00 0.00 H new ATOM 0 HB3 CYS A 104 4.714 1.506 -4.475 1.00 0.00 H new ATOM 0 HG CYS A 104 4.330 0.231 -6.777 1.00 0.00 H new ATOM 1824 N CYS A 105 1.832 -1.580 -4.022 1.00 0.00 N ATOM 1825 CA CYS A 105 0.462 -2.173 -3.813 1.00 0.00 C ATOM 1826 C CYS A 105 0.494 -3.688 -4.098 1.00 0.00 C ATOM 1827 O CYS A 105 1.551 -4.269 -4.238 1.00 0.00 O ATOM 1828 CB CYS A 105 -0.488 -1.500 -4.815 1.00 0.00 C ATOM 1829 SG CYS A 105 -0.229 0.294 -4.915 1.00 0.00 S ATOM 0 H CYS A 105 2.351 -1.947 -4.820 1.00 0.00 H new ATOM 0 HA CYS A 105 0.134 -2.014 -2.786 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -0.343 -1.941 -5.801 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -1.519 -1.700 -4.525 1.00 0.00 H new ATOM 0 HG CYS A 105 0.974 0.535 -5.343 1.00 0.00 H new ATOM 1834 N LEU A 106 -0.656 -4.332 -4.201 1.00 0.00 N ATOM 1835 CA LEU A 106 -0.665 -5.809 -4.495 1.00 0.00 C ATOM 1836 C LEU A 106 -0.885 -6.058 -5.999 1.00 0.00 C ATOM 1837 O LEU A 106 -0.267 -6.933 -6.575 1.00 0.00 O ATOM 1838 CB LEU A 106 -1.817 -6.400 -3.677 1.00 0.00 C ATOM 1839 CG LEU A 106 -1.308 -6.825 -2.299 1.00 0.00 C ATOM 1840 CD1 LEU A 106 -2.486 -7.330 -1.467 1.00 0.00 C ATOM 1841 CD2 LEU A 106 -0.269 -7.945 -2.448 1.00 0.00 C ATOM 0 H LEU A 106 -1.576 -3.904 -4.095 1.00 0.00 H new ATOM 0 HA LEU A 106 0.286 -6.272 -4.231 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -2.614 -5.664 -3.570 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -2.243 -7.257 -4.198 1.00 0.00 H new ATOM 0 HG LEU A 106 -0.843 -5.972 -1.804 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -2.132 -7.635 -0.482 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -3.222 -6.533 -1.357 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.946 -8.182 -1.967 1.00 0.00 H new ATOM 0 HD21 LEU A 106 0.089 -8.243 -1.462 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -0.726 -8.802 -2.942 1.00 0.00 H new ATOM 0 HD23 LEU A 106 0.569 -7.587 -3.046 1.00 0.00 H new ATOM 1853 N ARG A 107 -1.731 -5.279 -6.652 1.00 0.00 N ATOM 1854 CA ARG A 107 -1.940 -5.471 -8.129 1.00 0.00 C ATOM 1855 C ARG A 107 -1.161 -4.386 -8.909 1.00 0.00 C ATOM 1856 O ARG A 107 -1.579 -3.952 -9.965 1.00 0.00 O ATOM 1857 CB ARG A 107 -3.448 -5.323 -8.360 1.00 0.00 C ATOM 1858 CG ARG A 107 -3.815 -5.903 -9.727 1.00 0.00 C ATOM 1859 CD ARG A 107 -5.292 -6.303 -9.733 1.00 0.00 C ATOM 1860 NE ARG A 107 -5.498 -7.003 -11.038 1.00 0.00 N ATOM 1861 CZ ARG A 107 -5.054 -8.235 -11.234 1.00 0.00 C ATOM 1862 NH1 ARG A 107 -4.417 -8.892 -10.292 1.00 0.00 N ATOM 1863 NH2 ARG A 107 -5.253 -8.817 -12.389 1.00 0.00 N ATOM 0 H ARG A 107 -2.278 -4.529 -6.229 1.00 0.00 H new ATOM 0 HA ARG A 107 -1.582 -6.442 -8.472 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -3.999 -5.840 -7.574 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -3.733 -4.272 -8.311 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -3.623 -5.168 -10.509 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -3.192 -6.770 -9.945 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -5.527 -6.957 -8.893 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -5.938 -5.429 -9.648 1.00 0.00 H new ATOM 0 HE ARG A 107 -5.990 -6.523 -11.791 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -4.255 -8.454 -9.385 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -4.085 -9.840 -10.467 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -5.747 -8.322 -13.131 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -4.914 -9.766 -12.547 1.00 0.00 H new ATOM 1877 N CYS A 108 -0.038 -3.939 -8.384 1.00 0.00 N ATOM 1878 CA CYS A 108 0.775 -2.879 -9.058 1.00 0.00 C ATOM 1879 C CYS A 108 2.243 -3.383 -9.207 1.00 0.00 C ATOM 1880 O CYS A 108 3.140 -2.600 -9.450 1.00 0.00 O ATOM 1881 CB CYS A 108 0.679 -1.743 -8.027 1.00 0.00 C ATOM 1882 SG CYS A 108 0.738 -0.070 -8.716 1.00 0.00 S ATOM 0 H CYS A 108 0.352 -4.273 -7.502 1.00 0.00 H new ATOM 0 HA CYS A 108 0.448 -2.594 -10.058 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -0.251 -1.857 -7.470 1.00 0.00 H new ATOM 0 HB3 CYS A 108 1.494 -1.853 -7.312 1.00 0.00 H new ATOM 0 HG CYS A 108 1.069 -0.129 -9.972 1.00 0.00 H new ATOM 1887 N ILE A 109 2.497 -4.689 -9.046 1.00 0.00 N ATOM 1888 CA ILE A 109 3.899 -5.230 -9.148 1.00 0.00 C ATOM 1889 C ILE A 109 3.883 -6.747 -9.459 1.00 0.00 C ATOM 1890 O ILE A 109 4.700 -7.485 -8.939 1.00 0.00 O ATOM 1891 CB ILE A 109 4.518 -5.034 -7.746 1.00 0.00 C ATOM 1892 CG1 ILE A 109 3.602 -5.671 -6.674 1.00 0.00 C ATOM 1893 CG2 ILE A 109 4.700 -3.545 -7.449 1.00 0.00 C ATOM 1894 CD1 ILE A 109 4.398 -6.651 -5.798 1.00 0.00 C ATOM 0 H ILE A 109 1.784 -5.391 -8.849 1.00 0.00 H new ATOM 0 HA ILE A 109 4.452 -4.725 -9.940 1.00 0.00 H new ATOM 0 HB ILE A 109 5.493 -5.520 -7.723 1.00 0.00 H new ATOM 0 HG12 ILE A 109 3.164 -4.891 -6.051 1.00 0.00 H new ATOM 0 HG13 ILE A 109 2.777 -6.194 -7.157 1.00 0.00 H new ATOM 0 HG21 ILE A 109 5.137 -3.422 -6.458 1.00 0.00 H new ATOM 0 HG22 ILE A 109 5.361 -3.104 -8.194 1.00 0.00 H new ATOM 0 HG23 ILE A 109 3.731 -3.046 -7.483 1.00 0.00 H new ATOM 0 HD11 ILE A 109 3.737 -7.089 -5.050 1.00 0.00 H new ATOM 0 HD12 ILE A 109 4.814 -7.442 -6.422 1.00 0.00 H new ATOM 0 HD13 ILE A 109 5.208 -6.118 -5.300 1.00 0.00 H new ATOM 1906 N GLN A 110 2.959 -7.228 -10.269 1.00 0.00 N ATOM 1907 CA GLN A 110 2.918 -8.701 -10.552 1.00 0.00 C ATOM 1908 C GLN A 110 3.042 -8.991 -12.057 1.00 0.00 C ATOM 1909 O GLN A 110 2.428 -8.330 -12.870 1.00 0.00 O ATOM 1910 CB GLN A 110 1.555 -9.158 -10.033 1.00 0.00 C ATOM 1911 CG GLN A 110 1.525 -9.047 -8.507 1.00 0.00 C ATOM 1912 CD GLN A 110 0.206 -9.620 -7.976 1.00 0.00 C ATOM 1913 OE1 GLN A 110 -0.856 -9.245 -8.435 1.00 0.00 O ATOM 1914 NE2 GLN A 110 0.221 -10.520 -7.023 1.00 0.00 N ATOM 0 H GLN A 110 2.244 -6.672 -10.738 1.00 0.00 H new ATOM 0 HA GLN A 110 3.747 -9.224 -10.075 1.00 0.00 H new ATOM 0 HB2 GLN A 110 0.765 -8.546 -10.468 1.00 0.00 H new ATOM 0 HB3 GLN A 110 1.365 -10.187 -10.337 1.00 0.00 H new ATOM 0 HG2 GLN A 110 2.368 -9.588 -8.076 1.00 0.00 H new ATOM 0 HG3 GLN A 110 1.628 -8.004 -8.206 1.00 0.00 H new ATOM 0 HE21 GLN A 110 1.109 -10.837 -6.635 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -0.656 -10.903 -6.669 1.00 0.00 H new ATOM 2034 N THR A 119 1.182 -6.704 -15.273 1.00 0.00 N ATOM 2035 CA THR A 119 1.998 -5.979 -14.248 1.00 0.00 C ATOM 2036 C THR A 119 1.837 -4.463 -14.413 1.00 0.00 C ATOM 2037 O THR A 119 1.218 -4.000 -15.352 1.00 0.00 O ATOM 2038 CB THR A 119 3.449 -6.389 -14.520 1.00 0.00 C ATOM 2039 OG1 THR A 119 3.477 -7.712 -15.037 1.00 0.00 O ATOM 2040 CG2 THR A 119 4.261 -6.326 -13.222 1.00 0.00 C ATOM 0 HA THR A 119 1.687 -6.227 -13.233 1.00 0.00 H new ATOM 0 HB THR A 119 3.886 -5.704 -15.247 1.00 0.00 H new ATOM 0 HG1 THR A 119 3.065 -8.324 -14.392 1.00 0.00 H new ATOM 0 HG21 THR A 119 5.292 -6.619 -13.423 1.00 0.00 H new ATOM 0 HG22 THR A 119 4.243 -5.309 -12.830 1.00 0.00 H new ATOM 0 HG23 THR A 119 3.827 -7.005 -12.488 1.00 0.00 H new ATOM 2048 N CYS A 120 2.401 -3.685 -13.512 1.00 0.00 N ATOM 2049 CA CYS A 120 2.287 -2.201 -13.632 1.00 0.00 C ATOM 2050 C CYS A 120 3.625 -1.619 -14.120 1.00 0.00 C ATOM 2051 O CYS A 120 4.664 -2.224 -13.937 1.00 0.00 O ATOM 2052 CB CYS A 120 1.953 -1.699 -12.227 1.00 0.00 C ATOM 2053 SG CYS A 120 1.656 0.077 -12.297 1.00 0.00 S ATOM 0 H CYS A 120 2.931 -4.016 -12.706 1.00 0.00 H new ATOM 0 HA CYS A 120 1.523 -1.899 -14.348 1.00 0.00 H new ATOM 0 HB2 CYS A 120 1.072 -2.214 -11.842 1.00 0.00 H new ATOM 0 HB3 CYS A 120 2.774 -1.917 -11.544 1.00 0.00 H new ATOM 0 HG CYS A 120 2.488 0.688 -11.506 1.00 0.00 H new ATOM 2058 N ILE A 121 3.612 -0.461 -14.750 1.00 0.00 N ATOM 2059 CA ILE A 121 4.906 0.125 -15.251 1.00 0.00 C ATOM 2060 C ILE A 121 5.783 0.604 -14.077 1.00 0.00 C ATOM 2061 O ILE A 121 6.993 0.495 -14.134 1.00 0.00 O ATOM 2062 CB ILE A 121 4.524 1.293 -16.198 1.00 0.00 C ATOM 2063 CG1 ILE A 121 5.753 1.727 -17.027 1.00 0.00 C ATOM 2064 CG2 ILE A 121 3.955 2.484 -15.409 1.00 0.00 C ATOM 2065 CD1 ILE A 121 6.821 2.415 -16.157 1.00 0.00 C ATOM 0 H ILE A 121 2.778 0.095 -14.937 1.00 0.00 H new ATOM 0 HA ILE A 121 5.498 -0.619 -15.784 1.00 0.00 H new ATOM 0 HB ILE A 121 3.747 0.943 -16.877 1.00 0.00 H new ATOM 0 HG12 ILE A 121 6.189 0.854 -17.514 1.00 0.00 H new ATOM 0 HG13 ILE A 121 5.436 2.407 -17.817 1.00 0.00 H new ATOM 0 HG21 ILE A 121 3.696 3.287 -16.099 1.00 0.00 H new ATOM 0 HG22 ILE A 121 3.063 2.169 -14.868 1.00 0.00 H new ATOM 0 HG23 ILE A 121 4.702 2.841 -14.700 1.00 0.00 H new ATOM 0 HD11 ILE A 121 7.667 2.704 -16.780 1.00 0.00 H new ATOM 0 HD12 ILE A 121 6.394 3.303 -15.691 1.00 0.00 H new ATOM 0 HD13 ILE A 121 7.159 1.726 -15.383 1.00 0.00 H new ATOM 2077 N CYS A 122 5.201 1.143 -13.020 1.00 0.00 N ATOM 2078 CA CYS A 122 6.061 1.630 -11.878 1.00 0.00 C ATOM 2079 C CYS A 122 6.989 0.505 -11.367 1.00 0.00 C ATOM 2080 O CYS A 122 8.105 0.769 -10.959 1.00 0.00 O ATOM 2081 CB CYS A 122 5.105 2.183 -10.785 1.00 0.00 C ATOM 2082 SG CYS A 122 4.363 0.861 -9.770 1.00 0.00 S ATOM 0 H CYS A 122 4.196 1.265 -12.899 1.00 0.00 H new ATOM 0 HA CYS A 122 6.732 2.428 -12.197 1.00 0.00 H new ATOM 0 HB2 CYS A 122 5.655 2.867 -10.139 1.00 0.00 H new ATOM 0 HB3 CYS A 122 4.312 2.761 -11.259 1.00 0.00 H new ATOM 0 HG CYS A 122 5.187 0.528 -8.821 1.00 0.00 H new ATOM 2087 N ARG A 123 6.562 -0.743 -11.419 1.00 0.00 N ATOM 2088 CA ARG A 123 7.477 -1.854 -10.964 1.00 0.00 C ATOM 2089 C ARG A 123 8.741 -1.869 -11.844 1.00 0.00 C ATOM 2090 O ARG A 123 9.822 -2.158 -11.369 1.00 0.00 O ATOM 2091 CB ARG A 123 6.705 -3.170 -11.139 1.00 0.00 C ATOM 2092 CG ARG A 123 7.183 -4.186 -10.099 1.00 0.00 C ATOM 2093 CD ARG A 123 7.004 -5.607 -10.646 1.00 0.00 C ATOM 2094 NE ARG A 123 8.306 -6.293 -10.381 1.00 0.00 N ATOM 2095 CZ ARG A 123 9.369 -6.068 -11.138 1.00 0.00 C ATOM 2096 NH1 ARG A 123 9.328 -5.227 -12.146 1.00 0.00 N ATOM 2097 NH2 ARG A 123 10.488 -6.693 -10.881 1.00 0.00 N ATOM 0 H ARG A 123 5.642 -1.037 -11.748 1.00 0.00 H new ATOM 0 HA ARG A 123 7.780 -1.717 -9.926 1.00 0.00 H new ATOM 0 HB2 ARG A 123 5.635 -2.994 -11.026 1.00 0.00 H new ATOM 0 HB3 ARG A 123 6.859 -3.563 -12.144 1.00 0.00 H new ATOM 0 HG2 ARG A 123 8.231 -4.008 -9.857 1.00 0.00 H new ATOM 0 HG3 ARG A 123 6.618 -4.068 -9.174 1.00 0.00 H new ATOM 0 HD2 ARG A 123 6.180 -6.120 -10.150 1.00 0.00 H new ATOM 0 HD3 ARG A 123 6.775 -5.593 -11.712 1.00 0.00 H new ATOM 0 HE ARG A 123 8.377 -6.947 -9.602 1.00 0.00 H new ATOM 0 HH11 ARG A 123 8.464 -4.730 -12.361 1.00 0.00 H new ATOM 0 HH12 ARG A 123 10.161 -5.071 -12.714 1.00 0.00 H new ATOM 0 HH21 ARG A 123 10.538 -7.349 -10.102 1.00 0.00 H new ATOM 0 HH22 ARG A 123 11.311 -6.525 -11.460 1.00 0.00 H new ATOM 2111 N VAL A 124 8.619 -1.552 -13.122 1.00 0.00 N ATOM 2112 CA VAL A 124 9.834 -1.548 -14.009 1.00 0.00 C ATOM 2113 C VAL A 124 10.627 -0.244 -13.798 1.00 0.00 C ATOM 2114 O VAL A 124 10.072 0.830 -13.921 1.00 0.00 O ATOM 2115 CB VAL A 124 9.320 -1.623 -15.458 1.00 0.00 C ATOM 2116 CG1 VAL A 124 10.508 -1.692 -16.419 1.00 0.00 C ATOM 2117 CG2 VAL A 124 8.451 -2.871 -15.631 1.00 0.00 C ATOM 0 H VAL A 124 7.743 -1.300 -13.580 1.00 0.00 H new ATOM 0 HA VAL A 124 10.494 -2.385 -13.783 1.00 0.00 H new ATOM 0 HB VAL A 124 8.726 -0.735 -15.677 1.00 0.00 H new ATOM 0 HG11 VAL A 124 10.144 -1.745 -17.445 1.00 0.00 H new ATOM 0 HG12 VAL A 124 11.125 -0.802 -16.299 1.00 0.00 H new ATOM 0 HG13 VAL A 124 11.103 -2.578 -16.199 1.00 0.00 H new ATOM 0 HG21 VAL A 124 8.088 -2.922 -16.658 1.00 0.00 H new ATOM 0 HG22 VAL A 124 9.042 -3.760 -15.410 1.00 0.00 H new ATOM 0 HG23 VAL A 124 7.603 -2.821 -14.948 1.00 0.00 H new ATOM 2127 N PRO A 125 11.903 -0.365 -13.494 1.00 0.00 N ATOM 2128 CA PRO A 125 12.746 0.844 -13.280 1.00 0.00 C ATOM 2129 C PRO A 125 12.891 1.647 -14.585 1.00 0.00 C ATOM 2130 O PRO A 125 12.472 1.204 -15.637 1.00 0.00 O ATOM 2131 CB PRO A 125 14.093 0.271 -12.834 1.00 0.00 C ATOM 2132 CG PRO A 125 14.108 -1.119 -13.377 1.00 0.00 C ATOM 2133 CD PRO A 125 12.683 -1.600 -13.321 1.00 0.00 C ATOM 0 HA PRO A 125 12.321 1.535 -12.552 1.00 0.00 H new ATOM 0 HB2 PRO A 125 14.923 0.859 -13.226 1.00 0.00 H new ATOM 0 HB3 PRO A 125 14.185 0.274 -11.748 1.00 0.00 H new ATOM 0 HG2 PRO A 125 14.485 -1.135 -14.399 1.00 0.00 H new ATOM 0 HG3 PRO A 125 14.761 -1.762 -12.786 1.00 0.00 H new ATOM 0 HD2 PRO A 125 12.471 -2.323 -14.108 1.00 0.00 H new ATOM 0 HD3 PRO A 125 12.460 -2.087 -12.372 1.00 0.00 H new ATOM 2141 N ARG A 126 13.480 2.827 -14.524 1.00 0.00 N ATOM 2142 CA ARG A 126 13.640 3.647 -15.779 1.00 0.00 C ATOM 2143 C ARG A 126 14.761 3.072 -16.660 1.00 0.00 C ATOM 2144 O ARG A 126 14.653 3.073 -17.872 1.00 0.00 O ATOM 2145 CB ARG A 126 13.996 5.077 -15.336 1.00 0.00 C ATOM 2146 CG ARG A 126 12.713 5.885 -15.130 1.00 0.00 C ATOM 2147 CD ARG A 126 12.287 6.521 -16.457 1.00 0.00 C ATOM 2148 NE ARG A 126 11.881 7.917 -16.104 1.00 0.00 N ATOM 2149 CZ ARG A 126 12.779 8.829 -15.764 1.00 0.00 C ATOM 2150 NH1 ARG A 126 14.062 8.548 -15.728 1.00 0.00 N ATOM 2151 NH2 ARG A 126 12.386 10.039 -15.458 1.00 0.00 N ATOM 0 H ARG A 126 13.851 3.252 -13.674 1.00 0.00 H new ATOM 0 HA ARG A 126 12.722 3.635 -16.367 1.00 0.00 H new ATOM 0 HB2 ARG A 126 14.573 5.049 -14.411 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.623 5.556 -16.088 1.00 0.00 H new ATOM 0 HG2 ARG A 126 11.920 5.238 -14.754 1.00 0.00 H new ATOM 0 HG3 ARG A 126 12.875 6.659 -14.380 1.00 0.00 H new ATOM 0 HD2 ARG A 126 13.105 6.518 -17.177 1.00 0.00 H new ATOM 0 HD3 ARG A 126 11.461 5.973 -16.911 1.00 0.00 H new ATOM 0 HE ARG A 126 10.893 8.171 -16.126 1.00 0.00 H new ATOM 0 HH11 ARG A 126 14.386 7.610 -15.965 1.00 0.00 H new ATOM 0 HH12 ARG A 126 14.734 9.268 -15.463 1.00 0.00 H new ATOM 0 HH21 ARG A 126 11.394 10.274 -15.482 1.00 0.00 H new ATOM 0 HH22 ARG A 126 13.072 10.747 -15.195 1.00 0.00 H new ATOM 2165 N ALA A 127 15.839 2.585 -16.072 1.00 0.00 N ATOM 2166 CA ALA A 127 16.956 2.019 -16.916 1.00 0.00 C ATOM 2167 C ALA A 127 16.423 0.885 -17.802 1.00 0.00 C ATOM 2168 O ALA A 127 16.774 0.787 -18.963 1.00 0.00 O ATOM 2169 CB ALA A 127 18.019 1.479 -15.947 1.00 0.00 C ATOM 0 H ALA A 127 15.993 2.554 -15.064 1.00 0.00 H new ATOM 0 HA ALA A 127 17.378 2.783 -17.569 1.00 0.00 H new ATOM 0 HB1 ALA A 127 18.849 1.058 -16.515 1.00 0.00 H new ATOM 0 HB2 ALA A 127 18.384 2.291 -15.318 1.00 0.00 H new ATOM 0 HB3 ALA A 127 17.579 0.704 -15.319 1.00 0.00 H new ATOM 2175 N GLN A 128 15.564 0.034 -17.274 1.00 0.00 N ATOM 2176 CA GLN A 128 15.011 -1.078 -18.123 1.00 0.00 C ATOM 2177 C GLN A 128 14.073 -0.485 -19.182 1.00 0.00 C ATOM 2178 O GLN A 128 14.103 -0.885 -20.331 1.00 0.00 O ATOM 2179 CB GLN A 128 14.237 -2.018 -17.183 1.00 0.00 C ATOM 2180 CG GLN A 128 13.824 -3.281 -17.945 1.00 0.00 C ATOM 2181 CD GLN A 128 13.977 -4.506 -17.034 1.00 0.00 C ATOM 2182 OE1 GLN A 128 14.719 -5.416 -17.350 1.00 0.00 O ATOM 2183 NE2 GLN A 128 13.308 -4.575 -15.910 1.00 0.00 N ATOM 0 H GLN A 128 15.228 0.060 -16.311 1.00 0.00 H new ATOM 0 HA GLN A 128 15.803 -1.623 -18.637 1.00 0.00 H new ATOM 0 HB2 GLN A 128 14.857 -2.284 -16.327 1.00 0.00 H new ATOM 0 HB3 GLN A 128 13.354 -1.512 -16.792 1.00 0.00 H new ATOM 0 HG2 GLN A 128 12.791 -3.193 -18.282 1.00 0.00 H new ATOM 0 HG3 GLN A 128 14.441 -3.398 -18.836 1.00 0.00 H new ATOM 0 HE21 GLN A 128 12.684 -3.814 -15.640 1.00 0.00 H new ATOM 0 HE22 GLN A 128 13.411 -5.389 -15.304 1.00 0.00 H new ATOM 2192 N LEU A 129 13.251 0.479 -18.814 1.00 0.00 N ATOM 2193 CA LEU A 129 12.331 1.098 -19.833 1.00 0.00 C ATOM 2194 C LEU A 129 13.163 1.848 -20.885 1.00 0.00 C ATOM 2195 O LEU A 129 12.854 1.807 -22.062 1.00 0.00 O ATOM 2196 CB LEU A 129 11.422 2.080 -19.076 1.00 0.00 C ATOM 2197 CG LEU A 129 10.208 1.330 -18.524 1.00 0.00 C ATOM 2198 CD1 LEU A 129 9.820 1.916 -17.165 1.00 0.00 C ATOM 2199 CD2 LEU A 129 9.033 1.475 -19.494 1.00 0.00 C ATOM 0 H LEU A 129 13.178 0.858 -17.870 1.00 0.00 H new ATOM 0 HA LEU A 129 11.737 0.341 -20.345 1.00 0.00 H new ATOM 0 HB2 LEU A 129 11.974 2.549 -18.262 1.00 0.00 H new ATOM 0 HB3 LEU A 129 11.097 2.879 -19.743 1.00 0.00 H new ATOM 0 HG LEU A 129 10.456 0.275 -18.408 1.00 0.00 H new ATOM 0 HD11 LEU A 129 8.955 1.382 -16.772 1.00 0.00 H new ATOM 0 HD12 LEU A 129 10.656 1.813 -16.473 1.00 0.00 H new ATOM 0 HD13 LEU A 129 9.573 2.971 -17.281 1.00 0.00 H new ATOM 0 HD21 LEU A 129 8.168 0.941 -19.101 1.00 0.00 H new ATOM 0 HD22 LEU A 129 8.785 2.530 -19.610 1.00 0.00 H new ATOM 0 HD23 LEU A 129 9.307 1.058 -20.463 1.00 0.00 H new ATOM 2211 N GLU A 130 14.220 2.529 -20.478 1.00 0.00 N ATOM 2212 CA GLU A 130 15.060 3.269 -21.488 1.00 0.00 C ATOM 2213 C GLU A 130 15.647 2.277 -22.505 1.00 0.00 C ATOM 2214 O GLU A 130 15.709 2.567 -23.685 1.00 0.00 O ATOM 2215 CB GLU A 130 16.191 3.958 -20.708 1.00 0.00 C ATOM 2216 CG GLU A 130 15.685 5.287 -20.143 1.00 0.00 C ATOM 2217 CD GLU A 130 16.877 6.165 -19.758 1.00 0.00 C ATOM 2218 OE1 GLU A 130 17.796 5.647 -19.145 1.00 0.00 O ATOM 2219 OE2 GLU A 130 16.852 7.340 -20.085 1.00 0.00 O ATOM 0 H GLU A 130 14.532 2.604 -19.510 1.00 0.00 H new ATOM 0 HA GLU A 130 14.465 3.999 -22.036 1.00 0.00 H new ATOM 0 HB2 GLU A 130 16.534 3.314 -19.899 1.00 0.00 H new ATOM 0 HB3 GLU A 130 17.046 4.131 -21.362 1.00 0.00 H new ATOM 0 HG2 GLU A 130 15.068 5.797 -20.883 1.00 0.00 H new ATOM 0 HG3 GLU A 130 15.055 5.108 -19.271 1.00 0.00 H new ATOM 2226 N GLU A 131 16.077 1.109 -22.064 1.00 0.00 N ATOM 2227 CA GLU A 131 16.656 0.116 -23.040 1.00 0.00 C ATOM 2228 C GLU A 131 15.612 -0.248 -24.109 1.00 0.00 C ATOM 2229 O GLU A 131 15.946 -0.415 -25.268 1.00 0.00 O ATOM 2230 CB GLU A 131 17.040 -1.133 -22.230 1.00 0.00 C ATOM 2231 CG GLU A 131 18.164 -1.882 -22.950 1.00 0.00 C ATOM 2232 CD GLU A 131 18.718 -2.976 -22.036 1.00 0.00 C ATOM 2233 OE1 GLU A 131 19.429 -2.637 -21.104 1.00 0.00 O ATOM 2234 OE2 GLU A 131 18.423 -4.133 -22.284 1.00 0.00 O ATOM 0 H GLU A 131 16.053 0.805 -21.091 1.00 0.00 H new ATOM 0 HA GLU A 131 17.524 0.533 -23.551 1.00 0.00 H new ATOM 0 HB2 GLU A 131 17.363 -0.846 -21.229 1.00 0.00 H new ATOM 0 HB3 GLU A 131 16.173 -1.783 -22.111 1.00 0.00 H new ATOM 0 HG2 GLU A 131 17.788 -2.322 -23.874 1.00 0.00 H new ATOM 0 HG3 GLU A 131 18.958 -1.188 -23.227 1.00 0.00 H new ATOM 2241 N GLU A 132 14.355 -0.374 -23.736 1.00 0.00 N ATOM 2242 CA GLU A 132 13.307 -0.730 -24.758 1.00 0.00 C ATOM 2243 C GLU A 132 13.240 0.358 -25.840 1.00 0.00 C ATOM 2244 O GLU A 132 13.178 0.056 -27.017 1.00 0.00 O ATOM 2245 CB GLU A 132 11.966 -0.816 -24.011 1.00 0.00 C ATOM 2246 CG GLU A 132 11.758 -2.242 -23.498 1.00 0.00 C ATOM 2247 CD GLU A 132 10.266 -2.578 -23.510 1.00 0.00 C ATOM 2248 OE1 GLU A 132 9.521 -1.901 -22.822 1.00 0.00 O ATOM 2249 OE2 GLU A 132 9.894 -3.506 -24.209 1.00 0.00 O ATOM 0 H GLU A 132 14.012 -0.248 -22.784 1.00 0.00 H new ATOM 0 HA GLU A 132 13.541 -1.675 -25.247 1.00 0.00 H new ATOM 0 HB2 GLU A 132 11.956 -0.113 -23.178 1.00 0.00 H new ATOM 0 HB3 GLU A 132 11.149 -0.534 -24.675 1.00 0.00 H new ATOM 0 HG2 GLU A 132 12.305 -2.948 -24.123 1.00 0.00 H new ATOM 0 HG3 GLU A 132 12.155 -2.337 -22.487 1.00 0.00 H new ATOM 2256 N ALA A 133 13.250 1.622 -25.460 1.00 0.00 N ATOM 2257 CA ALA A 133 13.185 2.710 -26.502 1.00 0.00 C ATOM 2258 C ALA A 133 14.391 2.603 -27.448 1.00 0.00 C ATOM 2259 O ALA A 133 14.253 2.756 -28.647 1.00 0.00 O ATOM 2260 CB ALA A 133 13.217 4.051 -25.752 1.00 0.00 C ATOM 0 H ALA A 133 13.299 1.943 -24.493 1.00 0.00 H new ATOM 0 HA ALA A 133 12.280 2.623 -27.103 1.00 0.00 H new ATOM 0 HB1 ALA A 133 13.172 4.870 -26.469 1.00 0.00 H new ATOM 0 HB2 ALA A 133 12.363 4.111 -25.078 1.00 0.00 H new ATOM 0 HB3 ALA A 133 14.139 4.124 -25.176 1.00 0.00 H new ATOM 2266 N ARG A 134 15.572 2.336 -26.925 1.00 0.00 N ATOM 2267 CA ARG A 134 16.777 2.216 -27.826 1.00 0.00 C ATOM 2268 C ARG A 134 16.554 1.108 -28.873 1.00 0.00 C ATOM 2269 O ARG A 134 16.998 1.225 -29.999 1.00 0.00 O ATOM 2270 CB ARG A 134 17.969 1.857 -26.925 1.00 0.00 C ATOM 2271 CG ARG A 134 19.265 2.359 -27.568 1.00 0.00 C ATOM 2272 CD ARG A 134 19.539 1.566 -28.848 1.00 0.00 C ATOM 2273 NE ARG A 134 21.025 1.593 -29.007 1.00 0.00 N ATOM 2274 CZ ARG A 134 21.810 0.827 -28.267 1.00 0.00 C ATOM 2275 NH1 ARG A 134 21.318 0.014 -27.360 1.00 0.00 N ATOM 2276 NH2 ARG A 134 23.107 0.875 -28.437 1.00 0.00 N ATOM 0 H ARG A 134 15.754 2.198 -25.931 1.00 0.00 H new ATOM 0 HA ARG A 134 16.956 3.147 -28.363 1.00 0.00 H new ATOM 0 HB2 ARG A 134 17.842 2.306 -25.940 1.00 0.00 H new ATOM 0 HB3 ARG A 134 18.017 0.778 -26.780 1.00 0.00 H new ATOM 0 HG2 ARG A 134 19.183 3.422 -27.796 1.00 0.00 H new ATOM 0 HG3 ARG A 134 20.096 2.246 -26.872 1.00 0.00 H new ATOM 0 HD2 ARG A 134 19.169 0.544 -28.766 1.00 0.00 H new ATOM 0 HD3 ARG A 134 19.042 2.017 -29.706 1.00 0.00 H new ATOM 0 HE ARG A 134 21.442 2.214 -29.700 1.00 0.00 H new ATOM 0 HH11 ARG A 134 20.310 -0.037 -27.214 1.00 0.00 H new ATOM 0 HH12 ARG A 134 21.944 -0.567 -26.802 1.00 0.00 H new ATOM 0 HH21 ARG A 134 23.507 1.500 -29.137 1.00 0.00 H new ATOM 0 HH22 ARG A 134 23.718 0.287 -27.870 1.00 0.00 H new ATOM 2290 N LYS A 135 15.875 0.033 -28.516 1.00 0.00 N ATOM 2291 CA LYS A 135 15.643 -1.069 -29.518 1.00 0.00 C ATOM 2292 C LYS A 135 14.624 -0.634 -30.589 1.00 0.00 C ATOM 2293 O LYS A 135 14.718 -1.048 -31.729 1.00 0.00 O ATOM 2294 CB LYS A 135 15.101 -2.274 -28.733 1.00 0.00 C ATOM 2295 CG LYS A 135 16.265 -3.023 -28.080 1.00 0.00 C ATOM 2296 CD LYS A 135 15.873 -4.485 -27.859 1.00 0.00 C ATOM 2297 CE LYS A 135 16.761 -5.092 -26.771 1.00 0.00 C ATOM 2298 NZ LYS A 135 17.975 -5.571 -27.490 1.00 0.00 N ATOM 0 H LYS A 135 15.478 -0.127 -27.590 1.00 0.00 H new ATOM 0 HA LYS A 135 16.570 -1.316 -30.036 1.00 0.00 H new ATOM 0 HB2 LYS A 135 14.397 -1.939 -27.971 1.00 0.00 H new ATOM 0 HB3 LYS A 135 14.554 -2.940 -29.400 1.00 0.00 H new ATOM 0 HG2 LYS A 135 17.150 -2.965 -28.714 1.00 0.00 H new ATOM 0 HG3 LYS A 135 16.523 -2.557 -27.129 1.00 0.00 H new ATOM 0 HD2 LYS A 135 14.825 -4.552 -27.567 1.00 0.00 H new ATOM 0 HD3 LYS A 135 15.982 -5.046 -28.787 1.00 0.00 H new ATOM 0 HE2 LYS A 135 17.017 -4.353 -26.012 1.00 0.00 H new ATOM 0 HE3 LYS A 135 16.255 -5.911 -26.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 18.634 -6.001 -26.810 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 17.701 -6.278 -28.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 18.439 -4.768 -27.961 1.00 0.00 H new ATOM 2312 N LYS A 136 13.653 0.193 -30.245 1.00 0.00 N ATOM 2313 CA LYS A 136 12.649 0.627 -31.280 1.00 0.00 C ATOM 2314 C LYS A 136 12.993 2.013 -31.868 1.00 0.00 C ATOM 2315 O LYS A 136 12.138 2.660 -32.444 1.00 0.00 O ATOM 2316 CB LYS A 136 11.299 0.678 -30.554 1.00 0.00 C ATOM 2317 CG LYS A 136 10.760 -0.743 -30.376 1.00 0.00 C ATOM 2318 CD LYS A 136 9.643 -0.738 -29.331 1.00 0.00 C ATOM 2319 CE LYS A 136 9.073 -2.151 -29.185 1.00 0.00 C ATOM 2320 NZ LYS A 136 7.973 -2.226 -30.185 1.00 0.00 N ATOM 0 H LYS A 136 13.515 0.579 -29.311 1.00 0.00 H new ATOM 0 HA LYS A 136 12.639 -0.066 -32.121 1.00 0.00 H new ATOM 0 HB2 LYS A 136 11.415 1.159 -29.583 1.00 0.00 H new ATOM 0 HB3 LYS A 136 10.590 1.278 -31.124 1.00 0.00 H new ATOM 0 HG2 LYS A 136 10.382 -1.122 -31.326 1.00 0.00 H new ATOM 0 HG3 LYS A 136 11.562 -1.411 -30.063 1.00 0.00 H new ATOM 0 HD2 LYS A 136 10.029 -0.389 -28.373 1.00 0.00 H new ATOM 0 HD3 LYS A 136 8.855 -0.046 -29.629 1.00 0.00 H new ATOM 0 HE2 LYS A 136 9.835 -2.906 -29.378 1.00 0.00 H new ATOM 0 HE3 LYS A 136 8.701 -2.325 -28.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 7.532 -3.167 -30.146 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 7.260 -1.500 -29.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 8.358 -2.064 -31.137 1.00 0.00 H new ATOM 2334 N GLY A 137 14.225 2.481 -31.748 1.00 0.00 N ATOM 2335 CA GLY A 137 14.585 3.817 -32.323 1.00 0.00 C ATOM 2336 C GLY A 137 13.637 4.905 -31.792 1.00 0.00 C ATOM 2337 O GLY A 137 13.181 5.749 -32.541 1.00 0.00 O ATOM 0 H GLY A 137 14.988 1.993 -31.278 1.00 0.00 H new ATOM 0 HA2 GLY A 137 15.614 4.065 -32.064 1.00 0.00 H new ATOM 0 HA3 GLY A 137 14.530 3.778 -33.411 1.00 0.00 H new ATOM 2341 N THR A 138 13.338 4.900 -30.509 1.00 0.00 N ATOM 2342 CA THR A 138 12.423 5.940 -29.950 1.00 0.00 C ATOM 2343 C THR A 138 12.890 6.354 -28.544 1.00 0.00 C ATOM 2344 O THR A 138 14.007 6.070 -28.155 1.00 0.00 O ATOM 2345 CB THR A 138 11.041 5.275 -29.894 1.00 0.00 C ATOM 2346 OG1 THR A 138 10.102 6.187 -29.343 1.00 0.00 O ATOM 2347 CG2 THR A 138 11.095 4.013 -29.025 1.00 0.00 C ATOM 0 H THR A 138 13.689 4.222 -29.833 1.00 0.00 H new ATOM 0 HA THR A 138 12.407 6.846 -30.556 1.00 0.00 H new ATOM 0 HB THR A 138 10.739 4.997 -30.904 1.00 0.00 H new ATOM 0 HG1 THR A 138 9.218 5.765 -29.308 1.00 0.00 H new ATOM 0 HG21 THR A 138 10.108 3.551 -28.993 1.00 0.00 H new ATOM 0 HG22 THR A 138 11.812 3.310 -29.449 1.00 0.00 H new ATOM 0 HG23 THR A 138 11.403 4.280 -28.014 1.00 0.00 H new ATOM 2355 N GLN A 139 12.050 7.024 -27.779 1.00 0.00 N ATOM 2356 CA GLN A 139 12.465 7.446 -26.408 1.00 0.00 C ATOM 2357 C GLN A 139 11.318 7.227 -25.410 1.00 0.00 C ATOM 2358 O GLN A 139 10.157 7.309 -25.768 1.00 0.00 O ATOM 2359 CB GLN A 139 12.787 8.937 -26.534 1.00 0.00 C ATOM 2360 CG GLN A 139 14.083 9.116 -27.331 1.00 0.00 C ATOM 2361 CD GLN A 139 13.751 9.408 -28.799 1.00 0.00 C ATOM 2362 OE1 GLN A 139 12.691 9.047 -29.273 1.00 0.00 O ATOM 2363 NE2 GLN A 139 14.611 10.052 -29.549 1.00 0.00 N ATOM 0 H GLN A 139 11.103 7.292 -28.048 1.00 0.00 H new ATOM 0 HA GLN A 139 13.316 6.872 -26.041 1.00 0.00 H new ATOM 0 HB2 GLN A 139 11.967 9.456 -27.031 1.00 0.00 H new ATOM 0 HB3 GLN A 139 12.892 9.382 -25.544 1.00 0.00 H new ATOM 0 HG2 GLN A 139 14.669 9.933 -26.911 1.00 0.00 H new ATOM 0 HG3 GLN A 139 14.693 8.216 -27.258 1.00 0.00 H new ATOM 0 HE21 GLN A 139 15.502 10.357 -29.157 1.00 0.00 H new ATOM 0 HE22 GLN A 139 14.390 10.248 -30.525 1.00 0.00 H new ATOM 2372 N VAL A 140 11.628 6.950 -24.160 1.00 0.00 N ATOM 2373 CA VAL A 140 10.550 6.731 -23.148 1.00 0.00 C ATOM 2374 C VAL A 140 10.844 7.553 -21.882 1.00 0.00 C ATOM 2375 O VAL A 140 11.964 7.977 -21.665 1.00 0.00 O ATOM 2376 CB VAL A 140 10.580 5.226 -22.845 1.00 0.00 C ATOM 2377 CG1 VAL A 140 11.962 4.821 -22.313 1.00 0.00 C ATOM 2378 CG2 VAL A 140 9.510 4.899 -21.796 1.00 0.00 C ATOM 0 H VAL A 140 12.580 6.867 -23.803 1.00 0.00 H new ATOM 0 HA VAL A 140 9.571 7.045 -23.509 1.00 0.00 H new ATOM 0 HB VAL A 140 10.379 4.672 -23.762 1.00 0.00 H new ATOM 0 HG11 VAL A 140 11.971 3.752 -22.102 1.00 0.00 H new ATOM 0 HG12 VAL A 140 12.721 5.050 -23.061 1.00 0.00 H new ATOM 0 HG13 VAL A 140 12.176 5.374 -21.398 1.00 0.00 H new ATOM 0 HG21 VAL A 140 9.528 3.831 -21.578 1.00 0.00 H new ATOM 0 HG22 VAL A 140 9.712 5.459 -20.883 1.00 0.00 H new ATOM 0 HG23 VAL A 140 8.528 5.174 -22.180 1.00 0.00 H new ATOM 2388 N SER A 141 9.852 7.785 -21.044 1.00 0.00 N ATOM 2389 CA SER A 141 10.101 8.585 -19.804 1.00 0.00 C ATOM 2390 C SER A 141 8.934 8.444 -18.807 1.00 0.00 C ATOM 2391 O SER A 141 8.002 9.226 -18.827 1.00 0.00 O ATOM 2392 CB SER A 141 10.219 10.021 -20.297 1.00 0.00 C ATOM 2393 OG SER A 141 10.282 10.900 -19.182 1.00 0.00 O ATOM 0 H SER A 141 8.894 7.457 -21.167 1.00 0.00 H new ATOM 0 HA SER A 141 10.992 8.251 -19.272 1.00 0.00 H new ATOM 0 HB2 SER A 141 11.111 10.133 -20.913 1.00 0.00 H new ATOM 0 HB3 SER A 141 9.364 10.273 -20.925 1.00 0.00 H new ATOM 0 HG SER A 141 10.359 11.824 -19.498 1.00 0.00 H new ATOM 2399 N PHE A 142 8.981 7.457 -17.936 1.00 0.00 N ATOM 2400 CA PHE A 142 7.873 7.278 -16.943 1.00 0.00 C ATOM 2401 C PHE A 142 8.261 7.913 -15.589 1.00 0.00 C ATOM 2402 O PHE A 142 9.424 8.118 -15.300 1.00 0.00 O ATOM 2403 CB PHE A 142 7.693 5.751 -16.818 1.00 0.00 C ATOM 2404 CG PHE A 142 6.856 5.401 -15.601 1.00 0.00 C ATOM 2405 CD1 PHE A 142 5.464 5.562 -15.617 1.00 0.00 C ATOM 2406 CD2 PHE A 142 7.486 4.928 -14.450 1.00 0.00 C ATOM 2407 CE1 PHE A 142 4.711 5.241 -14.476 1.00 0.00 C ATOM 2408 CE2 PHE A 142 6.742 4.615 -13.322 1.00 0.00 C ATOM 2409 CZ PHE A 142 5.355 4.766 -13.326 1.00 0.00 C ATOM 0 H PHE A 142 9.735 6.773 -17.872 1.00 0.00 H new ATOM 0 HA PHE A 142 6.949 7.764 -17.255 1.00 0.00 H new ATOM 0 HB2 PHE A 142 7.215 5.363 -17.717 1.00 0.00 H new ATOM 0 HB3 PHE A 142 8.669 5.271 -16.743 1.00 0.00 H new ATOM 0 HD1 PHE A 142 4.972 5.932 -16.504 1.00 0.00 H new ATOM 0 HD2 PHE A 142 8.559 4.805 -14.437 1.00 0.00 H new ATOM 0 HE1 PHE A 142 3.638 5.360 -14.485 1.00 0.00 H new ATOM 0 HE2 PHE A 142 7.240 4.252 -12.435 1.00 0.00 H new ATOM 0 HZ PHE A 142 4.780 4.518 -12.446 1.00 0.00 H new ATOM 2419 N HIS A 143 7.284 8.204 -14.756 1.00 0.00 N ATOM 2420 CA HIS A 143 7.575 8.801 -13.417 1.00 0.00 C ATOM 2421 C HIS A 143 6.694 8.116 -12.362 1.00 0.00 C ATOM 2422 O HIS A 143 7.187 7.471 -11.456 1.00 0.00 O ATOM 2423 CB HIS A 143 7.211 10.281 -13.550 1.00 0.00 C ATOM 2424 CG HIS A 143 8.214 10.968 -14.435 1.00 0.00 C ATOM 2425 ND1 HIS A 143 9.194 11.809 -13.929 1.00 0.00 N ATOM 2426 CD2 HIS A 143 8.403 10.950 -15.795 1.00 0.00 C ATOM 2427 CE1 HIS A 143 9.921 12.257 -14.969 1.00 0.00 C ATOM 2428 NE2 HIS A 143 9.480 11.764 -16.130 1.00 0.00 N ATOM 0 H HIS A 143 6.295 8.051 -14.951 1.00 0.00 H new ATOM 0 HA HIS A 143 8.614 8.675 -13.112 1.00 0.00 H new ATOM 0 HB2 HIS A 143 6.210 10.384 -13.969 1.00 0.00 H new ATOM 0 HB3 HIS A 143 7.195 10.752 -12.567 1.00 0.00 H new ATOM 0 HD2 HIS A 143 7.806 10.389 -16.498 1.00 0.00 H new ATOM 0 HE1 HIS A 143 10.759 12.933 -14.877 1.00 0.00 H new ATOM 0 HE2 HIS A 143 9.853 11.946 -17.062 1.00 0.00 H new ATOM 2436 N GLN A 144 5.391 8.228 -12.493 1.00 0.00 N ATOM 2437 CA GLN A 144 4.469 7.564 -11.525 1.00 0.00 C ATOM 2438 C GLN A 144 3.360 6.845 -12.307 1.00 0.00 C ATOM 2439 O GLN A 144 3.022 7.248 -13.406 1.00 0.00 O ATOM 2440 CB GLN A 144 3.892 8.694 -10.659 1.00 0.00 C ATOM 2441 CG GLN A 144 3.165 9.718 -11.537 1.00 0.00 C ATOM 2442 CD GLN A 144 2.459 10.745 -10.643 1.00 0.00 C ATOM 2443 OE1 GLN A 144 1.274 10.973 -10.787 1.00 0.00 O ATOM 2444 NE2 GLN A 144 3.136 11.381 -9.718 1.00 0.00 N ATOM 0 H GLN A 144 4.929 8.755 -13.234 1.00 0.00 H new ATOM 0 HA GLN A 144 4.970 6.821 -10.905 1.00 0.00 H new ATOM 0 HB2 GLN A 144 3.202 8.281 -9.923 1.00 0.00 H new ATOM 0 HB3 GLN A 144 4.694 9.183 -10.106 1.00 0.00 H new ATOM 0 HG2 GLN A 144 3.875 10.219 -12.195 1.00 0.00 H new ATOM 0 HG3 GLN A 144 2.439 9.215 -12.176 1.00 0.00 H new ATOM 0 HE21 GLN A 144 4.131 11.193 -9.594 1.00 0.00 H new ATOM 0 HE22 GLN A 144 2.668 12.064 -9.122 1.00 0.00 H new ATOM 2453 N CYS A 145 2.797 5.785 -11.768 1.00 0.00 N ATOM 2454 CA CYS A 145 1.718 5.063 -12.527 1.00 0.00 C ATOM 2455 C CYS A 145 0.325 5.584 -12.142 1.00 0.00 C ATOM 2456 O CYS A 145 0.121 6.082 -11.051 1.00 0.00 O ATOM 2457 CB CYS A 145 1.861 3.560 -12.217 1.00 0.00 C ATOM 2458 SG CYS A 145 1.528 3.197 -10.466 1.00 0.00 S ATOM 0 H CYS A 145 3.031 5.394 -10.855 1.00 0.00 H new ATOM 0 HA CYS A 145 1.826 5.238 -13.598 1.00 0.00 H new ATOM 0 HB2 CYS A 145 1.172 2.993 -12.843 1.00 0.00 H new ATOM 0 HB3 CYS A 145 2.868 3.231 -12.471 1.00 0.00 H new ATOM 0 HG CYS A 145 2.439 2.390 -10.009 1.00 0.00 H new ATOM 2463 N VAL A 146 -0.636 5.477 -13.039 1.00 0.00 N ATOM 2464 CA VAL A 146 -2.020 5.980 -12.718 1.00 0.00 C ATOM 2465 C VAL A 146 -2.723 5.073 -11.691 1.00 0.00 C ATOM 2466 O VAL A 146 -3.595 5.529 -10.974 1.00 0.00 O ATOM 2467 CB VAL A 146 -2.814 6.014 -14.042 1.00 0.00 C ATOM 2468 CG1 VAL A 146 -2.095 6.919 -15.047 1.00 0.00 C ATOM 2469 CG2 VAL A 146 -2.940 4.601 -14.631 1.00 0.00 C ATOM 0 H VAL A 146 -0.525 5.069 -13.967 1.00 0.00 H new ATOM 0 HA VAL A 146 -1.962 6.973 -12.273 1.00 0.00 H new ATOM 0 HB VAL A 146 -3.812 6.403 -13.840 1.00 0.00 H new ATOM 0 HG11 VAL A 146 -2.656 6.943 -15.981 1.00 0.00 H new ATOM 0 HG12 VAL A 146 -2.023 7.928 -14.641 1.00 0.00 H new ATOM 0 HG13 VAL A 146 -1.094 6.531 -15.235 1.00 0.00 H new ATOM 0 HG21 VAL A 146 -3.502 4.644 -15.564 1.00 0.00 H new ATOM 0 HG22 VAL A 146 -1.946 4.198 -14.825 1.00 0.00 H new ATOM 0 HG23 VAL A 146 -3.461 3.957 -13.923 1.00 0.00 H new ATOM 2479 N HIS A 147 -2.368 3.796 -11.601 1.00 0.00 N ATOM 2480 CA HIS A 147 -3.051 2.893 -10.595 1.00 0.00 C ATOM 2481 C HIS A 147 -3.038 3.549 -9.201 1.00 0.00 C ATOM 2482 O HIS A 147 -4.074 3.729 -8.588 1.00 0.00 O ATOM 2483 CB HIS A 147 -2.251 1.574 -10.560 1.00 0.00 C ATOM 2484 CG HIS A 147 -2.302 0.866 -11.900 1.00 0.00 C ATOM 2485 ND1 HIS A 147 -3.163 1.241 -12.930 1.00 0.00 N ATOM 2486 CD2 HIS A 147 -1.593 -0.210 -12.387 1.00 0.00 C ATOM 2487 CE1 HIS A 147 -2.947 0.407 -13.963 1.00 0.00 C ATOM 2488 NE2 HIS A 147 -2.002 -0.494 -13.686 1.00 0.00 N ATOM 0 H HIS A 147 -1.649 3.349 -12.170 1.00 0.00 H new ATOM 0 HA HIS A 147 -4.089 2.715 -10.875 1.00 0.00 H new ATOM 0 HB2 HIS A 147 -1.214 1.781 -10.295 1.00 0.00 H new ATOM 0 HB3 HIS A 147 -2.654 0.922 -9.785 1.00 0.00 H new ATOM 0 HD2 HIS A 147 -0.834 -0.752 -11.842 1.00 0.00 H new ATOM 0 HE1 HIS A 147 -3.475 0.460 -14.904 1.00 0.00 H new ATOM 0 HE2 HIS A 147 -1.654 -1.233 -14.297 1.00 0.00 H new ATOM 2496 N CYS A 148 -1.875 3.912 -8.700 1.00 0.00 N ATOM 2497 CA CYS A 148 -1.801 4.557 -7.359 1.00 0.00 C ATOM 2498 C CYS A 148 -0.938 5.835 -7.419 1.00 0.00 C ATOM 2499 O CYS A 148 -0.619 6.320 -8.489 1.00 0.00 O ATOM 2500 CB CYS A 148 -1.151 3.487 -6.467 1.00 0.00 C ATOM 2501 SG CYS A 148 0.580 3.196 -6.957 1.00 0.00 S ATOM 0 H CYS A 148 -0.978 3.786 -9.168 1.00 0.00 H new ATOM 0 HA CYS A 148 -2.775 4.871 -6.984 1.00 0.00 H new ATOM 0 HB2 CYS A 148 -1.190 3.804 -5.425 1.00 0.00 H new ATOM 0 HB3 CYS A 148 -1.715 2.557 -6.538 1.00 0.00 H new ATOM 0 HG CYS A 148 0.674 3.220 -8.253 1.00 0.00 H new ATOM 2506 N GLY A 149 -0.535 6.361 -6.282 1.00 0.00 N ATOM 2507 CA GLY A 149 0.331 7.577 -6.281 1.00 0.00 C ATOM 2508 C GLY A 149 1.779 7.127 -6.037 1.00 0.00 C ATOM 2509 O GLY A 149 2.420 7.562 -5.099 1.00 0.00 O ATOM 0 H GLY A 149 -0.771 5.997 -5.359 1.00 0.00 H new ATOM 0 HA2 GLY A 149 0.250 8.103 -7.232 1.00 0.00 H new ATOM 0 HA3 GLY A 149 0.012 8.272 -5.504 1.00 0.00 H new ATOM 2513 N CYS A 150 2.293 6.243 -6.868 1.00 0.00 N ATOM 2514 CA CYS A 150 3.695 5.748 -6.677 1.00 0.00 C ATOM 2515 C CYS A 150 4.644 6.485 -7.636 1.00 0.00 C ATOM 2516 O CYS A 150 4.294 6.750 -8.769 1.00 0.00 O ATOM 2517 CB CYS A 150 3.615 4.240 -6.994 1.00 0.00 C ATOM 2518 SG CYS A 150 5.259 3.480 -7.085 1.00 0.00 S ATOM 0 H CYS A 150 1.801 5.845 -7.668 1.00 0.00 H new ATOM 0 HA CYS A 150 4.083 5.924 -5.674 1.00 0.00 H new ATOM 0 HB2 CYS A 150 3.025 3.739 -6.227 1.00 0.00 H new ATOM 0 HB3 CYS A 150 3.095 4.095 -7.941 1.00 0.00 H new ATOM 0 HG CYS A 150 5.249 2.530 -7.972 1.00 0.00 H new ATOM 2523 N ARG A 151 5.846 6.802 -7.199 1.00 0.00 N ATOM 2524 CA ARG A 151 6.808 7.507 -8.109 1.00 0.00 C ATOM 2525 C ARG A 151 7.734 6.478 -8.777 1.00 0.00 C ATOM 2526 O ARG A 151 8.943 6.591 -8.713 1.00 0.00 O ATOM 2527 CB ARG A 151 7.613 8.465 -7.220 1.00 0.00 C ATOM 2528 CG ARG A 151 6.832 9.767 -7.032 1.00 0.00 C ATOM 2529 CD ARG A 151 7.201 10.395 -5.686 1.00 0.00 C ATOM 2530 NE ARG A 151 7.082 11.869 -5.902 1.00 0.00 N ATOM 2531 CZ ARG A 151 7.975 12.535 -6.619 1.00 0.00 C ATOM 2532 NH1 ARG A 151 9.002 11.926 -7.168 1.00 0.00 N ATOM 2533 NH2 ARG A 151 7.838 13.824 -6.788 1.00 0.00 N ATOM 0 H ARG A 151 6.197 6.605 -6.262 1.00 0.00 H new ATOM 0 HA ARG A 151 6.295 8.051 -8.902 1.00 0.00 H new ATOM 0 HB2 ARG A 151 7.808 8.003 -6.252 1.00 0.00 H new ATOM 0 HB3 ARG A 151 8.582 8.672 -7.675 1.00 0.00 H new ATOM 0 HG2 ARG A 151 7.059 10.460 -7.843 1.00 0.00 H new ATOM 0 HG3 ARG A 151 5.761 9.570 -7.072 1.00 0.00 H new ATOM 0 HD2 ARG A 151 6.531 10.056 -4.896 1.00 0.00 H new ATOM 0 HD3 ARG A 151 8.212 10.120 -5.386 1.00 0.00 H new ATOM 0 HE ARG A 151 6.297 12.373 -5.489 1.00 0.00 H new ATOM 0 HH11 ARG A 151 9.124 10.921 -7.046 1.00 0.00 H new ATOM 0 HH12 ARG A 151 9.677 12.459 -7.716 1.00 0.00 H new ATOM 0 HH21 ARG A 151 7.047 14.312 -6.369 1.00 0.00 H new ATOM 0 HH22 ARG A 151 8.523 14.342 -7.339 1.00 0.00 H new ATOM 2547 N GLY A 152 7.173 5.471 -9.417 1.00 0.00 N ATOM 2548 CA GLY A 152 8.015 4.441 -10.082 1.00 0.00 C ATOM 2549 C GLY A 152 8.830 3.676 -9.033 1.00 0.00 C ATOM 2550 O GLY A 152 9.887 4.119 -8.621 1.00 0.00 O ATOM 0 H GLY A 152 6.167 5.327 -9.502 1.00 0.00 H new ATOM 0 HA2 GLY A 152 7.385 3.749 -10.641 1.00 0.00 H new ATOM 0 HA3 GLY A 152 8.684 4.914 -10.801 1.00 0.00 H new ATOM 2554 N CYS A 153 8.356 2.523 -8.603 1.00 0.00 N ATOM 2555 CA CYS A 153 9.122 1.734 -7.589 1.00 0.00 C ATOM 2556 C CYS A 153 9.779 0.510 -8.258 1.00 0.00 C ATOM 2557 O CYS A 153 9.118 -0.283 -8.900 1.00 0.00 O ATOM 2558 CB CYS A 153 8.105 1.329 -6.498 1.00 0.00 C ATOM 2559 SG CYS A 153 6.867 0.154 -7.128 1.00 0.00 S ATOM 0 H CYS A 153 7.479 2.102 -8.910 1.00 0.00 H new ATOM 0 HA CYS A 153 9.934 2.311 -7.146 1.00 0.00 H new ATOM 0 HB2 CYS A 153 8.634 0.882 -5.656 1.00 0.00 H new ATOM 0 HB3 CYS A 153 7.602 2.220 -6.122 1.00 0.00 H new ATOM 0 HG CYS A 153 7.359 -0.493 -8.143 1.00 0.00 H new ATOM 2564 N ALA A 154 11.082 0.361 -8.125 1.00 0.00 N ATOM 2565 CA ALA A 154 11.775 -0.799 -8.763 1.00 0.00 C ATOM 2566 C ALA A 154 12.753 -1.440 -7.770 1.00 0.00 C ATOM 2567 O ALA A 154 13.494 -0.750 -7.098 1.00 0.00 O ATOM 2568 CB ALA A 154 12.530 -0.201 -9.949 1.00 0.00 C ATOM 0 H ALA A 154 11.688 0.993 -7.603 1.00 0.00 H new ATOM 0 HA ALA A 154 11.080 -1.579 -9.073 1.00 0.00 H new ATOM 0 HB1 ALA A 154 13.068 -0.991 -10.473 1.00 0.00 H new ATOM 0 HB2 ALA A 154 11.822 0.270 -10.631 1.00 0.00 H new ATOM 0 HB3 ALA A 154 13.239 0.545 -9.590 1.00 0.00 H new ATOM 2574 N SER A 155 12.772 -2.754 -7.677 1.00 0.00 N ATOM 2575 CA SER A 155 13.717 -3.421 -6.726 1.00 0.00 C ATOM 2576 C SER A 155 14.895 -4.030 -7.502 1.00 0.00 C ATOM 2577 O SER A 155 15.329 -5.130 -7.213 1.00 0.00 O ATOM 2578 CB SER A 155 12.904 -4.516 -6.032 1.00 0.00 C ATOM 2579 OG SER A 155 11.540 -4.111 -5.951 1.00 0.00 O ATOM 0 H SER A 155 12.178 -3.385 -8.215 1.00 0.00 H new ATOM 0 HA SER A 155 14.134 -2.719 -6.003 1.00 0.00 H new ATOM 0 HB2 SER A 155 12.985 -5.451 -6.586 1.00 0.00 H new ATOM 0 HB3 SER A 155 13.300 -4.701 -5.034 1.00 0.00 H new ATOM 0 HG SER A 155 10.991 -4.868 -5.657 1.00 0.00 H new