USER MOD reduce.3.24.130724 H: found=0, std=0, add=788, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 788 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 110 HIS : no HE2:sc= -0.695 K(o=-0.7,f=-3.4!) USER MOD Set 1.2: A 129 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 48 GLN : amide:sc= -0.233 K(o=-2.1,f=-8!) USER MOD Set 2.2: A 55 GLN : amide:sc= -0.172 K(o=-2.1,f=-5.6) USER MOD Set 2.3: A 116 MET CE :methyl 172:sc= -1.35 (180deg=-1.14) USER MOD Set 2.4: A 120 ASN : amide:sc= -0.3 K(o=-2.1,f=-11!) USER MOD Single : A 38 THR OG1 : rot 33:sc= 0.277 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0.0416 USER MOD Single : A 52 TYR OH : rot 106:sc= 0.206 USER MOD Single : A 57 GLN : amide:sc= -0.707 K(o=-0.71,f=-3.2!) USER MOD Single : A 62 THR OG1 : rot 74:sc= 1.25 USER MOD Single : A 64 LYS NZ :NH3+ 174:sc= 1.14 (180deg=1.07) USER MOD Single : A 67 THR OG1 : rot -75:sc= 0.87 USER MOD Single : A 75 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 SER OG : rot 86:sc= 0.245 USER MOD Single : A 82 SER OG : rot -120:sc= 0.684 USER MOD Single : A 87 TYR OH : rot 180:sc= 0.0737 USER MOD Single : A 88 ASN : amide:sc= -0.474 K(o=-0.47,f=-4.5!) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0338) USER MOD Single : A 95 ASN : amide:sc= -1.23 K(o=-1.2,f=-0.0054) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 THR OG1 : rot 76:sc= 0.984 USER MOD Single : A 103 LYS NZ :NH3+ -151:sc= 1.18 (180deg=1.08) USER MOD Single : A 104 LYS NZ :NH3+ 169:sc= 1.23 (180deg=0.739) USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 114 THR OG1 : rot 82:sc= 1.07 USER MOD Single : A 124 LYS NZ :NH3+ 145:sc= 0.931 (180deg=0.275) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0.666 (180deg=0.666) USER MOD ----------------------------------------------------------------- ATOM 192 N THR A 38 -17.320 -13.105 2.200 1.00 0.00 N ATOM 193 CA THR A 38 -17.502 -11.711 1.993 1.00 0.00 C ATOM 194 C THR A 38 -18.784 -11.530 1.185 1.00 0.00 C ATOM 195 O THR A 38 -18.837 -11.892 0.006 1.00 0.00 O ATOM 196 CB THR A 38 -16.294 -11.166 1.203 1.00 0.00 C ATOM 197 OG1 THR A 38 -15.069 -11.607 1.843 1.00 0.00 O ATOM 198 CG2 THR A 38 -16.315 -9.646 1.149 1.00 0.00 C ATOM 0 HA THR A 38 -17.577 -11.174 2.938 1.00 0.00 H new ATOM 0 HB THR A 38 -16.347 -11.546 0.183 1.00 0.00 H new ATOM 0 HG1 THR A 38 -15.206 -12.494 2.237 1.00 0.00 H new ATOM 0 HG21 THR A 38 -15.452 -9.290 0.586 1.00 0.00 H new ATOM 0 HG22 THR A 38 -17.230 -9.312 0.660 1.00 0.00 H new ATOM 0 HG23 THR A 38 -16.278 -9.245 2.162 1.00 0.00 H new ATOM 206 N VAL A 39 -19.809 -11.013 1.817 1.00 0.00 N ATOM 207 CA VAL A 39 -21.090 -10.871 1.180 1.00 0.00 C ATOM 208 C VAL A 39 -21.443 -9.408 1.049 1.00 0.00 C ATOM 209 O VAL A 39 -21.570 -8.683 2.055 1.00 0.00 O ATOM 210 CB VAL A 39 -22.218 -11.629 1.951 1.00 0.00 C ATOM 211 CG1 VAL A 39 -23.558 -11.520 1.221 1.00 0.00 C ATOM 212 CG2 VAL A 39 -21.846 -13.097 2.161 1.00 0.00 C ATOM 0 H VAL A 39 -19.777 -10.681 2.781 1.00 0.00 H new ATOM 0 HA VAL A 39 -21.015 -11.319 0.189 1.00 0.00 H new ATOM 0 HB VAL A 39 -22.323 -11.156 2.927 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -24.323 -12.057 1.782 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -23.841 -10.471 1.135 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -23.466 -11.954 0.225 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -22.648 -13.602 2.700 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -21.700 -13.577 1.193 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -20.924 -13.160 2.740 1.00 0.00 H new ATOM 222 N ILE A 40 -21.558 -8.986 -0.178 1.00 0.00 N ATOM 223 CA ILE A 40 -21.930 -7.640 -0.524 1.00 0.00 C ATOM 224 C ILE A 40 -23.438 -7.478 -0.305 1.00 0.00 C ATOM 225 O ILE A 40 -24.234 -8.207 -0.911 1.00 0.00 O ATOM 226 CB ILE A 40 -21.586 -7.367 -2.011 1.00 0.00 C ATOM 227 CG1 ILE A 40 -20.092 -7.627 -2.254 1.00 0.00 C ATOM 228 CG2 ILE A 40 -21.947 -5.934 -2.388 1.00 0.00 C ATOM 229 CD1 ILE A 40 -19.700 -7.665 -3.708 1.00 0.00 C ATOM 0 H ILE A 40 -21.392 -9.583 -0.988 1.00 0.00 H new ATOM 0 HA ILE A 40 -21.384 -6.932 0.100 1.00 0.00 H new ATOM 0 HB ILE A 40 -22.169 -8.041 -2.639 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -19.514 -6.850 -1.754 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -19.820 -8.576 -1.791 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -21.699 -5.760 -3.435 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -23.015 -5.776 -2.237 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -21.386 -5.241 -1.762 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -18.630 -7.853 -3.791 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -20.249 -8.461 -4.212 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -19.938 -6.709 -4.174 1.00 0.00 H new ATOM 241 N PRO A 41 -23.851 -6.562 0.581 1.00 0.00 N ATOM 242 CA PRO A 41 -25.261 -6.353 0.884 1.00 0.00 C ATOM 243 C PRO A 41 -26.030 -5.729 -0.293 1.00 0.00 C ATOM 244 O PRO A 41 -25.488 -4.906 -1.036 1.00 0.00 O ATOM 245 CB PRO A 41 -25.245 -5.409 2.093 1.00 0.00 C ATOM 246 CG PRO A 41 -23.931 -4.717 2.034 1.00 0.00 C ATOM 247 CD PRO A 41 -22.973 -5.660 1.353 1.00 0.00 C ATOM 0 HA PRO A 41 -25.774 -7.294 1.082 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -26.068 -4.695 2.046 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -25.356 -5.962 3.025 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -24.011 -3.781 1.481 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -23.581 -4.466 3.035 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -22.280 -5.125 0.704 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -22.372 -6.210 2.077 1.00 0.00 H new ATOM 255 N PRO A 42 -27.291 -6.128 -0.487 1.00 0.00 N ATOM 256 CA PRO A 42 -28.114 -5.614 -1.577 1.00 0.00 C ATOM 257 C PRO A 42 -28.505 -4.140 -1.375 1.00 0.00 C ATOM 258 O PRO A 42 -28.692 -3.681 -0.230 1.00 0.00 O ATOM 259 CB PRO A 42 -29.357 -6.511 -1.540 1.00 0.00 C ATOM 260 CG PRO A 42 -29.435 -7.001 -0.138 1.00 0.00 C ATOM 261 CD PRO A 42 -28.016 -7.120 0.336 1.00 0.00 C ATOM 0 HA PRO A 42 -27.585 -5.636 -2.530 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -30.253 -5.955 -1.814 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -29.268 -7.339 -2.243 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -29.999 -6.308 0.487 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -29.945 -7.963 -0.088 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -27.929 -6.899 1.400 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -27.626 -8.127 0.186 1.00 0.00 H new ATOM 269 N GLY A 43 -28.622 -3.409 -2.467 1.00 0.00 N ATOM 270 CA GLY A 43 -29.023 -2.015 -2.394 1.00 0.00 C ATOM 271 C GLY A 43 -27.845 -1.063 -2.428 1.00 0.00 C ATOM 272 O GLY A 43 -27.989 0.131 -2.146 1.00 0.00 O ATOM 0 H GLY A 43 -28.446 -3.754 -3.411 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -29.691 -1.790 -3.226 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -29.590 -1.852 -1.477 1.00 0.00 H new ATOM 276 N LEU A 44 -26.684 -1.583 -2.755 1.00 0.00 N ATOM 277 CA LEU A 44 -25.499 -0.785 -2.844 1.00 0.00 C ATOM 278 C LEU A 44 -25.333 -0.233 -4.233 1.00 0.00 C ATOM 279 O LEU A 44 -25.780 -0.829 -5.229 1.00 0.00 O ATOM 280 CB LEU A 44 -24.246 -1.568 -2.459 1.00 0.00 C ATOM 281 CG LEU A 44 -24.116 -2.019 -1.008 1.00 0.00 C ATOM 282 CD1 LEU A 44 -22.771 -2.685 -0.798 1.00 0.00 C ATOM 283 CD2 LEU A 44 -24.269 -0.849 -0.061 1.00 0.00 C ATOM 0 H LEU A 44 -26.542 -2.571 -2.965 1.00 0.00 H new ATOM 0 HA LEU A 44 -25.619 0.034 -2.135 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -24.195 -2.454 -3.092 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -23.378 -0.954 -2.699 1.00 0.00 H new ATOM 0 HG LEU A 44 -24.912 -2.733 -0.796 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -22.682 -3.006 0.240 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -22.688 -3.551 -1.454 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -21.975 -1.977 -1.029 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -24.172 -1.198 0.967 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -23.495 -0.110 -0.268 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -25.250 -0.395 -0.199 1.00 0.00 H new ATOM 295 N THR A 45 -24.704 0.882 -4.300 1.00 0.00 N ATOM 296 CA THR A 45 -24.399 1.518 -5.528 1.00 0.00 C ATOM 297 C THR A 45 -23.036 1.010 -5.956 1.00 0.00 C ATOM 298 O THR A 45 -22.322 0.441 -5.120 1.00 0.00 O ATOM 299 CB THR A 45 -24.374 3.033 -5.291 1.00 0.00 C ATOM 300 OG1 THR A 45 -23.385 3.341 -4.292 1.00 0.00 O ATOM 301 CG2 THR A 45 -25.724 3.469 -4.772 1.00 0.00 C ATOM 0 H THR A 45 -24.378 1.392 -3.479 1.00 0.00 H new ATOM 0 HA THR A 45 -25.134 1.304 -6.304 1.00 0.00 H new ATOM 0 HB THR A 45 -24.139 3.545 -6.224 1.00 0.00 H new ATOM 0 HG1 THR A 45 -23.365 4.309 -4.139 1.00 0.00 H new ATOM 0 HG21 THR A 45 -25.717 4.545 -4.600 1.00 0.00 H new ATOM 0 HG22 THR A 45 -26.492 3.223 -5.505 1.00 0.00 H new ATOM 0 HG23 THR A 45 -25.938 2.953 -3.836 1.00 0.00 H new ATOM 309 N ARG A 46 -22.655 1.185 -7.215 1.00 0.00 N ATOM 310 CA ARG A 46 -21.367 0.685 -7.662 1.00 0.00 C ATOM 311 C ARG A 46 -20.228 1.347 -6.894 1.00 0.00 C ATOM 312 O ARG A 46 -19.206 0.715 -6.618 1.00 0.00 O ATOM 313 CB ARG A 46 -21.159 0.761 -9.203 1.00 0.00 C ATOM 314 CG ARG A 46 -20.792 2.115 -9.819 1.00 0.00 C ATOM 315 CD ARG A 46 -21.867 3.160 -9.672 1.00 0.00 C ATOM 316 NE ARG A 46 -23.156 2.759 -10.239 1.00 0.00 N ATOM 317 CZ ARG A 46 -24.344 3.247 -9.830 1.00 0.00 C ATOM 318 NH1 ARG A 46 -24.417 4.014 -8.737 1.00 0.00 N ATOM 319 NH2 ARG A 46 -25.447 2.918 -10.472 1.00 0.00 N ATOM 0 H ARG A 46 -23.208 1.659 -7.929 1.00 0.00 H new ATOM 0 HA ARG A 46 -21.359 -0.380 -7.432 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -20.375 0.051 -9.468 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -22.076 0.416 -9.680 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -19.877 2.480 -9.353 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -20.576 1.975 -10.878 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -22.000 3.386 -8.614 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -21.537 4.079 -10.156 1.00 0.00 H new ATOM 0 HE ARG A 46 -23.155 2.068 -10.989 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -23.572 4.232 -8.209 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -25.318 4.381 -8.431 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -25.401 2.294 -11.278 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -26.346 3.287 -10.163 1.00 0.00 H new ATOM 333 N GLU A 47 -20.436 2.602 -6.499 1.00 0.00 N ATOM 334 CA GLU A 47 -19.432 3.333 -5.759 1.00 0.00 C ATOM 335 C GLU A 47 -19.315 2.740 -4.367 1.00 0.00 C ATOM 336 O GLU A 47 -18.215 2.468 -3.885 1.00 0.00 O ATOM 337 CB GLU A 47 -19.772 4.835 -5.630 1.00 0.00 C ATOM 338 CG GLU A 47 -20.274 5.502 -6.897 1.00 0.00 C ATOM 339 CD GLU A 47 -21.778 5.486 -6.999 1.00 0.00 C ATOM 340 OE1 GLU A 47 -22.370 4.410 -7.077 1.00 0.00 O ATOM 341 OE2 GLU A 47 -22.396 6.567 -6.997 1.00 0.00 O ATOM 0 H GLU A 47 -21.292 3.125 -6.683 1.00 0.00 H new ATOM 0 HA GLU A 47 -18.494 3.248 -6.307 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -20.528 4.953 -4.854 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -18.881 5.363 -5.290 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -19.922 6.533 -6.925 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -19.849 4.996 -7.764 1.00 0.00 H new ATOM 348 N GLN A 48 -20.463 2.493 -3.750 1.00 0.00 N ATOM 349 CA GLN A 48 -20.512 1.994 -2.394 1.00 0.00 C ATOM 350 C GLN A 48 -19.969 0.573 -2.319 1.00 0.00 C ATOM 351 O GLN A 48 -19.293 0.215 -1.347 1.00 0.00 O ATOM 352 CB GLN A 48 -21.931 2.031 -1.855 1.00 0.00 C ATOM 353 CG GLN A 48 -22.010 1.843 -0.364 1.00 0.00 C ATOM 354 CD GLN A 48 -21.307 2.951 0.389 1.00 0.00 C ATOM 355 OE1 GLN A 48 -20.127 2.852 0.707 1.00 0.00 O ATOM 356 NE2 GLN A 48 -22.015 4.022 0.644 1.00 0.00 N ATOM 0 H GLN A 48 -21.378 2.634 -4.178 1.00 0.00 H new ATOM 0 HA GLN A 48 -19.886 2.642 -1.780 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -22.387 2.986 -2.118 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -22.517 1.253 -2.343 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -23.056 1.805 -0.059 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -21.565 0.885 -0.096 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -22.994 4.065 0.363 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -21.587 4.814 1.124 1.00 0.00 H new ATOM 365 N GLU A 49 -20.262 -0.238 -3.343 1.00 0.00 N ATOM 366 CA GLU A 49 -19.738 -1.596 -3.393 1.00 0.00 C ATOM 367 C GLU A 49 -18.261 -1.565 -3.388 1.00 0.00 C ATOM 368 O GLU A 49 -17.628 -2.210 -2.560 1.00 0.00 O ATOM 369 CB GLU A 49 -20.162 -2.363 -4.632 1.00 0.00 C ATOM 370 CG GLU A 49 -21.602 -2.726 -4.721 1.00 0.00 C ATOM 371 CD GLU A 49 -21.895 -3.452 -6.001 1.00 0.00 C ATOM 372 OE1 GLU A 49 -22.027 -2.809 -7.056 1.00 0.00 O ATOM 373 OE2 GLU A 49 -21.973 -4.691 -5.990 1.00 0.00 O ATOM 0 H GLU A 49 -20.851 0.023 -4.134 1.00 0.00 H new ATOM 0 HA GLU A 49 -20.144 -2.100 -2.516 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -19.904 -1.768 -5.508 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -19.574 -3.279 -4.685 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -21.876 -3.353 -3.872 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -22.212 -1.825 -4.662 1.00 0.00 H new ATOM 380 N ARG A 50 -17.707 -0.772 -4.285 1.00 0.00 N ATOM 381 CA ARG A 50 -16.285 -0.693 -4.418 1.00 0.00 C ATOM 382 C ARG A 50 -15.672 -0.195 -3.165 1.00 0.00 C ATOM 383 O ARG A 50 -14.740 -0.762 -2.708 1.00 0.00 O ATOM 384 CB ARG A 50 -15.840 0.134 -5.614 1.00 0.00 C ATOM 385 CG ARG A 50 -16.232 -0.444 -6.952 1.00 0.00 C ATOM 386 CD ARG A 50 -15.862 -1.905 -7.043 1.00 0.00 C ATOM 387 NE ARG A 50 -16.180 -2.478 -8.355 1.00 0.00 N ATOM 388 CZ ARG A 50 -15.953 -3.742 -8.709 1.00 0.00 C ATOM 389 NH1 ARG A 50 -15.190 -4.524 -7.937 1.00 0.00 N ATOM 390 NH2 ARG A 50 -16.425 -4.205 -9.865 1.00 0.00 N ATOM 0 H ARG A 50 -18.230 -0.177 -4.928 1.00 0.00 H new ATOM 0 HA ARG A 50 -15.931 -1.707 -4.605 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -16.263 1.135 -5.526 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -14.756 0.242 -5.582 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -17.305 -0.328 -7.101 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -15.737 0.110 -7.750 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -14.796 -2.021 -6.847 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -16.391 -2.461 -6.268 1.00 0.00 H new ATOM 0 HE ARG A 50 -16.607 -1.863 -9.048 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -14.783 -4.152 -7.079 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -15.015 -5.492 -8.207 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -16.960 -3.592 -10.480 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -16.251 -5.173 -10.136 1.00 0.00 H new ATOM 404 N ALA A 51 -16.271 0.810 -2.584 1.00 0.00 N ATOM 405 CA ALA A 51 -15.807 1.406 -1.330 1.00 0.00 C ATOM 406 C ALA A 51 -15.771 0.367 -0.198 1.00 0.00 C ATOM 407 O ALA A 51 -14.814 0.314 0.577 1.00 0.00 O ATOM 408 CB ALA A 51 -16.726 2.543 -0.959 1.00 0.00 C ATOM 0 H ALA A 51 -17.108 1.254 -2.962 1.00 0.00 H new ATOM 0 HA ALA A 51 -14.792 1.776 -1.472 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -16.389 2.994 -0.026 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -16.714 3.293 -1.750 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -17.740 2.165 -0.833 1.00 0.00 H new ATOM 414 N TYR A 52 -16.797 -0.452 -0.117 1.00 0.00 N ATOM 415 CA TYR A 52 -16.863 -1.501 0.864 1.00 0.00 C ATOM 416 C TYR A 52 -15.760 -2.535 0.602 1.00 0.00 C ATOM 417 O TYR A 52 -15.011 -2.911 1.512 1.00 0.00 O ATOM 418 CB TYR A 52 -18.283 -2.112 0.833 1.00 0.00 C ATOM 419 CG TYR A 52 -18.393 -3.536 1.300 1.00 0.00 C ATOM 420 CD1 TYR A 52 -18.415 -3.870 2.646 1.00 0.00 C ATOM 421 CD2 TYR A 52 -18.482 -4.546 0.367 1.00 0.00 C ATOM 422 CE1 TYR A 52 -18.518 -5.191 3.046 1.00 0.00 C ATOM 423 CE2 TYR A 52 -18.585 -5.866 0.750 1.00 0.00 C ATOM 424 CZ TYR A 52 -18.601 -6.186 2.091 1.00 0.00 C ATOM 425 OH TYR A 52 -18.699 -7.504 2.481 1.00 0.00 O ATOM 0 H TYR A 52 -17.608 -0.405 -0.733 1.00 0.00 H new ATOM 0 HA TYR A 52 -16.687 -1.111 1.867 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -18.937 -1.496 1.450 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -18.661 -2.054 -0.188 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -18.351 -3.090 3.391 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -18.471 -4.299 -0.684 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -18.533 -5.442 4.096 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -18.653 -6.645 0.005 1.00 0.00 H new ATOM 0 HH TYR A 52 -19.617 -7.818 2.344 1.00 0.00 H new ATOM 435 N ILE A 53 -15.640 -2.930 -0.648 1.00 0.00 N ATOM 436 CA ILE A 53 -14.645 -3.896 -1.085 1.00 0.00 C ATOM 437 C ILE A 53 -13.227 -3.355 -0.852 1.00 0.00 C ATOM 438 O ILE A 53 -12.394 -4.026 -0.228 1.00 0.00 O ATOM 439 CB ILE A 53 -14.879 -4.248 -2.591 1.00 0.00 C ATOM 440 CG1 ILE A 53 -16.255 -4.938 -2.738 1.00 0.00 C ATOM 441 CG2 ILE A 53 -13.758 -5.131 -3.153 1.00 0.00 C ATOM 442 CD1 ILE A 53 -16.768 -5.076 -4.161 1.00 0.00 C ATOM 0 H ILE A 53 -16.236 -2.587 -1.401 1.00 0.00 H new ATOM 0 HA ILE A 53 -14.748 -4.808 -0.497 1.00 0.00 H new ATOM 0 HB ILE A 53 -14.868 -3.325 -3.171 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -16.193 -5.932 -2.295 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -16.988 -4.376 -2.159 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -13.960 -5.352 -4.201 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -12.806 -4.607 -3.069 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -13.711 -6.062 -2.589 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -17.738 -5.572 -4.151 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -16.871 -4.087 -4.608 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -16.064 -5.667 -4.746 1.00 0.00 H new ATOM 454 N VAL A 54 -12.989 -2.125 -1.285 1.00 0.00 N ATOM 455 CA VAL A 54 -11.695 -1.498 -1.148 1.00 0.00 C ATOM 456 C VAL A 54 -11.315 -1.297 0.319 1.00 0.00 C ATOM 457 O VAL A 54 -10.175 -1.499 0.668 1.00 0.00 O ATOM 458 CB VAL A 54 -11.534 -0.171 -1.977 1.00 0.00 C ATOM 459 CG1 VAL A 54 -11.662 -0.414 -3.471 1.00 0.00 C ATOM 460 CG2 VAL A 54 -12.511 0.863 -1.552 1.00 0.00 C ATOM 0 H VAL A 54 -13.690 -1.540 -1.739 1.00 0.00 H new ATOM 0 HA VAL A 54 -10.987 -2.201 -1.587 1.00 0.00 H new ATOM 0 HB VAL A 54 -10.528 0.195 -1.774 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -11.544 0.529 -4.004 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -10.890 -1.112 -3.794 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -12.644 -0.834 -3.689 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -12.369 1.765 -2.147 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -13.524 0.488 -1.698 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -12.359 1.096 -0.498 1.00 0.00 H new ATOM 470 N GLN A 55 -12.286 -0.960 1.191 1.00 0.00 N ATOM 471 CA GLN A 55 -11.986 -0.792 2.621 1.00 0.00 C ATOM 472 C GLN A 55 -11.537 -2.107 3.250 1.00 0.00 C ATOM 473 O GLN A 55 -10.591 -2.132 4.052 1.00 0.00 O ATOM 474 CB GLN A 55 -13.155 -0.176 3.413 1.00 0.00 C ATOM 475 CG GLN A 55 -12.829 0.001 4.902 1.00 0.00 C ATOM 476 CD GLN A 55 -13.924 0.659 5.721 1.00 0.00 C ATOM 477 OE1 GLN A 55 -14.684 1.490 5.236 1.00 0.00 O ATOM 478 NE2 GLN A 55 -14.005 0.292 6.968 1.00 0.00 N ATOM 0 H GLN A 55 -13.261 -0.803 0.936 1.00 0.00 H new ATOM 0 HA GLN A 55 -11.162 -0.081 2.677 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -13.410 0.792 2.983 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -14.034 -0.812 3.310 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -12.613 -0.978 5.331 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -11.920 0.596 4.992 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -13.356 -0.402 7.338 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -14.717 0.699 7.574 1.00 0.00 H new ATOM 487 N LEU A 56 -12.183 -3.196 2.865 1.00 0.00 N ATOM 488 CA LEU A 56 -11.814 -4.521 3.354 1.00 0.00 C ATOM 489 C LEU A 56 -10.401 -4.859 2.912 1.00 0.00 C ATOM 490 O LEU A 56 -9.631 -5.483 3.644 1.00 0.00 O ATOM 491 CB LEU A 56 -12.771 -5.588 2.850 1.00 0.00 C ATOM 492 CG LEU A 56 -14.238 -5.433 3.238 1.00 0.00 C ATOM 493 CD1 LEU A 56 -15.044 -6.556 2.639 1.00 0.00 C ATOM 494 CD2 LEU A 56 -14.406 -5.412 4.749 1.00 0.00 C ATOM 0 H LEU A 56 -12.968 -3.191 2.214 1.00 0.00 H new ATOM 0 HA LEU A 56 -11.868 -4.501 4.442 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -12.708 -5.615 1.762 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -12.424 -6.555 3.213 1.00 0.00 H new ATOM 0 HG LEU A 56 -14.599 -4.482 2.848 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -16.091 -6.442 2.919 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -14.953 -6.530 1.553 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -14.671 -7.510 3.011 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -15.462 -5.300 4.996 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -14.031 -6.345 5.170 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -13.845 -4.575 5.166 1.00 0.00 H new ATOM 506 N GLN A 57 -10.082 -4.476 1.705 1.00 0.00 N ATOM 507 CA GLN A 57 -8.756 -4.653 1.173 1.00 0.00 C ATOM 508 C GLN A 57 -7.751 -3.734 1.898 1.00 0.00 C ATOM 509 O GLN A 57 -6.648 -4.142 2.179 1.00 0.00 O ATOM 510 CB GLN A 57 -8.751 -4.407 -0.324 1.00 0.00 C ATOM 511 CG GLN A 57 -9.658 -5.337 -1.103 1.00 0.00 C ATOM 512 CD GLN A 57 -9.711 -4.987 -2.567 1.00 0.00 C ATOM 513 OE1 GLN A 57 -10.541 -4.197 -2.995 1.00 0.00 O ATOM 514 NE2 GLN A 57 -8.853 -5.569 -3.348 1.00 0.00 N ATOM 0 H GLN A 57 -10.736 -4.031 1.060 1.00 0.00 H new ATOM 0 HA GLN A 57 -8.444 -5.683 1.345 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -9.054 -3.377 -0.514 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -7.732 -4.513 -0.696 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -9.308 -6.363 -0.989 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -10.664 -5.295 -0.685 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -8.173 -6.223 -2.961 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -8.859 -5.372 -4.349 1.00 0.00 H new ATOM 523 N ILE A 58 -8.165 -2.497 2.208 1.00 0.00 N ATOM 524 CA ILE A 58 -7.325 -1.532 2.957 1.00 0.00 C ATOM 525 C ILE A 58 -6.927 -2.111 4.307 1.00 0.00 C ATOM 526 O ILE A 58 -5.756 -2.057 4.696 1.00 0.00 O ATOM 527 CB ILE A 58 -8.058 -0.163 3.195 1.00 0.00 C ATOM 528 CG1 ILE A 58 -8.309 0.558 1.877 1.00 0.00 C ATOM 529 CG2 ILE A 58 -7.261 0.743 4.144 1.00 0.00 C ATOM 530 CD1 ILE A 58 -9.179 1.792 1.992 1.00 0.00 C ATOM 0 H ILE A 58 -9.083 -2.133 1.952 1.00 0.00 H new ATOM 0 HA ILE A 58 -6.441 -1.349 2.346 1.00 0.00 H new ATOM 0 HB ILE A 58 -9.017 -0.388 3.661 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -7.350 0.844 1.446 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -8.777 -0.137 1.180 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -7.797 1.681 4.287 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -7.139 0.245 5.106 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -6.280 0.947 3.714 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -9.305 2.241 1.007 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -10.154 1.514 2.391 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -8.705 2.510 2.661 1.00 0.00 H new ATOM 542 N GLU A 59 -7.889 -2.671 5.006 1.00 0.00 N ATOM 543 CA GLU A 59 -7.625 -3.248 6.300 1.00 0.00 C ATOM 544 C GLU A 59 -6.767 -4.498 6.161 1.00 0.00 C ATOM 545 O GLU A 59 -5.888 -4.740 6.977 1.00 0.00 O ATOM 546 CB GLU A 59 -8.905 -3.521 7.107 1.00 0.00 C ATOM 547 CG GLU A 59 -9.917 -4.371 6.400 1.00 0.00 C ATOM 548 CD GLU A 59 -10.975 -4.889 7.309 1.00 0.00 C ATOM 549 OE1 GLU A 59 -11.834 -4.118 7.751 1.00 0.00 O ATOM 550 OE2 GLU A 59 -10.963 -6.106 7.599 1.00 0.00 O ATOM 0 H GLU A 59 -8.859 -2.738 4.698 1.00 0.00 H new ATOM 0 HA GLU A 59 -7.066 -2.509 6.874 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -8.632 -4.007 8.044 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -9.367 -2.568 7.365 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -10.382 -3.788 5.605 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -9.410 -5.211 5.925 1.00 0.00 H new ATOM 557 N ASP A 60 -7.014 -5.263 5.103 1.00 0.00 N ATOM 558 CA ASP A 60 -6.252 -6.486 4.807 1.00 0.00 C ATOM 559 C ASP A 60 -4.797 -6.095 4.566 1.00 0.00 C ATOM 560 O ASP A 60 -3.865 -6.699 5.098 1.00 0.00 O ATOM 561 CB ASP A 60 -6.765 -7.112 3.525 1.00 0.00 C ATOM 562 CG ASP A 60 -6.451 -8.579 3.404 1.00 0.00 C ATOM 563 OD1 ASP A 60 -5.355 -8.937 2.953 1.00 0.00 O ATOM 564 OD2 ASP A 60 -7.300 -9.417 3.794 1.00 0.00 O ATOM 0 H ASP A 60 -7.746 -5.059 4.423 1.00 0.00 H new ATOM 0 HA ASP A 60 -6.353 -7.185 5.638 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -7.845 -6.974 3.470 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -6.333 -6.585 2.675 1.00 0.00 H new ATOM 569 N LEU A 61 -4.633 -5.048 3.770 1.00 0.00 N ATOM 570 CA LEU A 61 -3.335 -4.501 3.439 1.00 0.00 C ATOM 571 C LEU A 61 -2.642 -3.981 4.657 1.00 0.00 C ATOM 572 O LEU A 61 -1.510 -4.337 4.912 1.00 0.00 O ATOM 573 CB LEU A 61 -3.442 -3.384 2.404 1.00 0.00 C ATOM 574 CG LEU A 61 -3.762 -3.807 0.977 1.00 0.00 C ATOM 575 CD1 LEU A 61 -4.115 -2.594 0.168 1.00 0.00 C ATOM 576 CD2 LEU A 61 -2.564 -4.502 0.347 1.00 0.00 C ATOM 0 H LEU A 61 -5.410 -4.552 3.333 1.00 0.00 H new ATOM 0 HA LEU A 61 -2.750 -5.316 3.014 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -4.212 -2.686 2.734 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -2.499 -2.837 2.394 1.00 0.00 H new ATOM 0 HG LEU A 61 -4.602 -4.501 0.995 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -4.345 -2.893 -0.855 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -4.984 -2.104 0.607 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -3.273 -1.902 0.163 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -2.810 -4.798 -0.673 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -1.714 -3.820 0.332 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -2.309 -5.387 0.930 1.00 0.00 H new ATOM 588 N THR A 62 -3.336 -3.180 5.436 1.00 0.00 N ATOM 589 CA THR A 62 -2.771 -2.563 6.565 1.00 0.00 C ATOM 590 C THR A 62 -2.392 -3.610 7.604 1.00 0.00 C ATOM 591 O THR A 62 -1.368 -3.496 8.228 1.00 0.00 O ATOM 592 CB THR A 62 -3.690 -1.455 7.123 1.00 0.00 C ATOM 593 OG1 THR A 62 -4.006 -0.536 6.056 1.00 0.00 O ATOM 594 CG2 THR A 62 -2.997 -0.680 8.213 1.00 0.00 C ATOM 0 H THR A 62 -4.318 -2.951 5.282 1.00 0.00 H new ATOM 0 HA THR A 62 -1.850 -2.060 6.270 1.00 0.00 H new ATOM 0 HB THR A 62 -4.588 -1.921 7.528 1.00 0.00 H new ATOM 0 HG1 THR A 62 -4.653 -0.951 5.448 1.00 0.00 H new ATOM 0 HG21 THR A 62 -3.665 0.095 8.590 1.00 0.00 H new ATOM 0 HG22 THR A 62 -2.729 -1.355 9.026 1.00 0.00 H new ATOM 0 HG23 THR A 62 -2.094 -0.218 7.813 1.00 0.00 H new ATOM 602 N ARG A 63 -3.192 -4.673 7.689 1.00 0.00 N ATOM 603 CA ARG A 63 -2.941 -5.815 8.576 1.00 0.00 C ATOM 604 C ARG A 63 -1.566 -6.385 8.241 1.00 0.00 C ATOM 605 O ARG A 63 -0.770 -6.675 9.111 1.00 0.00 O ATOM 606 CB ARG A 63 -3.972 -6.891 8.255 1.00 0.00 C ATOM 607 CG ARG A 63 -3.989 -8.097 9.164 1.00 0.00 C ATOM 608 CD ARG A 63 -4.673 -9.253 8.455 1.00 0.00 C ATOM 609 NE ARG A 63 -3.744 -9.935 7.536 1.00 0.00 N ATOM 610 CZ ARG A 63 -3.994 -10.192 6.247 1.00 0.00 C ATOM 611 NH1 ARG A 63 -5.200 -9.975 5.758 1.00 0.00 N ATOM 612 NH2 ARG A 63 -3.060 -10.746 5.477 1.00 0.00 N ATOM 0 H ARG A 63 -4.045 -4.769 7.137 1.00 0.00 H new ATOM 0 HA ARG A 63 -2.995 -5.511 9.621 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -4.961 -6.433 8.276 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -3.801 -7.234 7.235 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -2.971 -8.375 9.437 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -4.514 -7.861 10.089 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -5.049 -9.964 9.191 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -5.535 -8.884 7.899 1.00 0.00 H new ATOM 0 HE ARG A 63 -2.843 -10.233 7.911 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -5.938 -9.613 6.362 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -5.395 -10.170 4.776 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -2.147 -10.977 5.869 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -3.257 -10.939 4.495 1.00 0.00 H new ATOM 626 N LYS A 64 -1.302 -6.460 6.960 1.00 0.00 N ATOM 627 CA LYS A 64 -0.091 -6.954 6.405 1.00 0.00 C ATOM 628 C LYS A 64 1.099 -6.058 6.753 1.00 0.00 C ATOM 629 O LYS A 64 2.114 -6.553 7.200 1.00 0.00 O ATOM 630 CB LYS A 64 -0.325 -7.077 4.921 1.00 0.00 C ATOM 631 CG LYS A 64 0.844 -7.130 4.038 1.00 0.00 C ATOM 632 CD LYS A 64 0.388 -7.086 2.588 1.00 0.00 C ATOM 633 CE LYS A 64 -0.645 -8.172 2.264 1.00 0.00 C ATOM 634 NZ LYS A 64 -0.124 -9.551 2.476 1.00 0.00 N ATOM 0 H LYS A 64 -1.969 -6.159 6.249 1.00 0.00 H new ATOM 0 HA LYS A 64 0.171 -7.926 6.823 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -0.913 -7.979 4.750 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -0.940 -6.232 4.610 1.00 0.00 H new ATOM 0 HG2 LYS A 64 1.509 -6.292 4.247 1.00 0.00 H new ATOM 0 HG3 LYS A 64 1.412 -8.041 4.224 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -0.040 -6.107 2.375 1.00 0.00 H new ATOM 0 HD3 LYS A 64 1.252 -7.205 1.935 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -1.528 -8.023 2.886 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -0.964 -8.065 1.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -0.893 -10.237 2.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 0.637 -9.743 1.793 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 0.249 -9.636 3.443 1.00 0.00 H new ATOM 648 N LEU A 65 0.973 -4.747 6.583 1.00 0.00 N ATOM 649 CA LEU A 65 2.068 -3.854 6.983 1.00 0.00 C ATOM 650 C LEU A 65 2.196 -3.747 8.514 1.00 0.00 C ATOM 651 O LEU A 65 3.239 -3.346 9.035 1.00 0.00 O ATOM 652 CB LEU A 65 2.045 -2.450 6.304 1.00 0.00 C ATOM 653 CG LEU A 65 0.685 -1.766 6.127 1.00 0.00 C ATOM 654 CD1 LEU A 65 0.794 -0.292 6.378 1.00 0.00 C ATOM 655 CD2 LEU A 65 0.208 -1.940 4.709 1.00 0.00 C ATOM 0 H LEU A 65 0.155 -4.285 6.185 1.00 0.00 H new ATOM 0 HA LEU A 65 2.969 -4.335 6.602 1.00 0.00 H new ATOM 0 HB2 LEU A 65 2.681 -1.785 6.888 1.00 0.00 H new ATOM 0 HB3 LEU A 65 2.503 -2.546 5.319 1.00 0.00 H new ATOM 0 HG LEU A 65 -0.008 -2.220 6.836 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -0.183 0.173 6.247 1.00 0.00 H new ATOM 0 HD12 LEU A 65 1.143 -0.121 7.396 1.00 0.00 H new ATOM 0 HD13 LEU A 65 1.501 0.146 5.674 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -0.759 -1.452 4.588 1.00 0.00 H new ATOM 0 HD22 LEU A 65 0.929 -1.492 4.025 1.00 0.00 H new ATOM 0 HD23 LEU A 65 0.109 -3.002 4.486 1.00 0.00 H new ATOM 667 N ARG A 66 1.125 -4.081 9.208 1.00 0.00 N ATOM 668 CA ARG A 66 1.093 -4.094 10.665 1.00 0.00 C ATOM 669 C ARG A 66 1.812 -5.324 11.241 1.00 0.00 C ATOM 670 O ARG A 66 2.660 -5.188 12.135 1.00 0.00 O ATOM 671 CB ARG A 66 -0.366 -4.047 11.175 1.00 0.00 C ATOM 672 CG ARG A 66 -1.039 -2.673 11.097 1.00 0.00 C ATOM 673 CD ARG A 66 -2.564 -2.792 11.214 1.00 0.00 C ATOM 674 NE ARG A 66 -3.224 -1.488 11.436 1.00 0.00 N ATOM 675 CZ ARG A 66 -4.515 -1.333 11.818 1.00 0.00 C ATOM 676 NH1 ARG A 66 -5.305 -2.394 11.990 1.00 0.00 N ATOM 677 NH2 ARG A 66 -5.007 -0.110 11.996 1.00 0.00 N ATOM 0 H ARG A 66 0.242 -4.354 8.776 1.00 0.00 H new ATOM 0 HA ARG A 66 1.623 -3.206 11.009 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -0.959 -4.758 10.599 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -0.383 -4.384 12.211 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -0.660 -2.034 11.894 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -0.781 -2.192 10.153 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -2.960 -3.244 10.305 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -2.810 -3.463 12.037 1.00 0.00 H new ATOM 0 HE ARG A 66 -2.668 -0.645 11.291 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -4.939 -3.333 11.834 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -6.275 -2.266 12.278 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -4.413 0.706 11.845 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -5.978 0.012 12.283 1.00 0.00 H new ATOM 691 N THR A 67 1.516 -6.506 10.715 1.00 0.00 N ATOM 692 CA THR A 67 2.089 -7.740 11.249 1.00 0.00 C ATOM 693 C THR A 67 3.341 -8.186 10.478 1.00 0.00 C ATOM 694 O THR A 67 4.211 -8.886 11.017 1.00 0.00 O ATOM 695 CB THR A 67 1.041 -8.879 11.186 1.00 0.00 C ATOM 696 OG1 THR A 67 0.604 -9.052 9.826 1.00 0.00 O ATOM 697 CG2 THR A 67 -0.166 -8.559 12.053 1.00 0.00 C ATOM 0 H THR A 67 0.886 -6.639 9.924 1.00 0.00 H new ATOM 0 HA THR A 67 2.377 -7.534 12.280 1.00 0.00 H new ATOM 0 HB THR A 67 1.507 -9.792 11.556 1.00 0.00 H new ATOM 0 HG1 THR A 67 0.001 -8.320 9.581 1.00 0.00 H new ATOM 0 HG21 THR A 67 -0.886 -9.375 11.990 1.00 0.00 H new ATOM 0 HG22 THR A 67 0.152 -8.435 13.088 1.00 0.00 H new ATOM 0 HG23 THR A 67 -0.631 -7.637 11.703 1.00 0.00 H new ATOM 705 N GLY A 68 3.460 -7.743 9.251 1.00 0.00 N ATOM 706 CA GLY A 68 4.541 -8.187 8.404 1.00 0.00 C ATOM 707 C GLY A 68 4.122 -9.427 7.630 1.00 0.00 C ATOM 708 O GLY A 68 4.959 -10.168 7.105 1.00 0.00 O ATOM 0 H GLY A 68 2.823 -7.076 8.816 1.00 0.00 H new ATOM 0 HA2 GLY A 68 4.820 -7.393 7.711 1.00 0.00 H new ATOM 0 HA3 GLY A 68 5.421 -8.406 9.009 1.00 0.00 H new ATOM 712 N ASP A 69 2.812 -9.663 7.579 1.00 0.00 N ATOM 713 CA ASP A 69 2.243 -10.821 6.894 1.00 0.00 C ATOM 714 C ASP A 69 2.241 -10.647 5.390 1.00 0.00 C ATOM 715 O ASP A 69 1.340 -10.030 4.810 1.00 0.00 O ATOM 716 CB ASP A 69 0.829 -11.123 7.391 1.00 0.00 C ATOM 717 CG ASP A 69 0.170 -12.269 6.651 1.00 0.00 C ATOM 718 OD1 ASP A 69 0.539 -13.434 6.880 1.00 0.00 O ATOM 719 OD2 ASP A 69 -0.755 -12.025 5.851 1.00 0.00 O ATOM 0 H ASP A 69 2.116 -9.056 8.012 1.00 0.00 H new ATOM 0 HA ASP A 69 2.884 -11.670 7.132 1.00 0.00 H new ATOM 0 HB2 ASP A 69 0.867 -11.359 8.454 1.00 0.00 H new ATOM 0 HB3 ASP A 69 0.215 -10.229 7.285 1.00 0.00 H new ATOM 724 N LEU A 70 3.262 -11.136 4.771 1.00 0.00 N ATOM 725 CA LEU A 70 3.388 -11.066 3.341 1.00 0.00 C ATOM 726 C LEU A 70 3.108 -12.405 2.704 1.00 0.00 C ATOM 727 O LEU A 70 2.382 -12.485 1.720 1.00 0.00 O ATOM 728 CB LEU A 70 4.779 -10.551 2.938 1.00 0.00 C ATOM 729 CG LEU A 70 4.926 -9.045 2.673 1.00 0.00 C ATOM 730 CD1 LEU A 70 4.126 -8.648 1.446 1.00 0.00 C ATOM 731 CD2 LEU A 70 4.494 -8.213 3.875 1.00 0.00 C ATOM 0 H LEU A 70 4.041 -11.600 5.239 1.00 0.00 H new ATOM 0 HA LEU A 70 2.644 -10.358 2.975 1.00 0.00 H new ATOM 0 HB2 LEU A 70 5.481 -10.824 3.726 1.00 0.00 H new ATOM 0 HB3 LEU A 70 5.087 -11.083 2.038 1.00 0.00 H new ATOM 0 HG LEU A 70 5.982 -8.843 2.495 1.00 0.00 H new ATOM 0 HD11 LEU A 70 4.238 -7.578 1.269 1.00 0.00 H new ATOM 0 HD12 LEU A 70 4.491 -9.200 0.580 1.00 0.00 H new ATOM 0 HD13 LEU A 70 3.073 -8.880 1.607 1.00 0.00 H new ATOM 0 HD21 LEU A 70 4.614 -7.154 3.646 1.00 0.00 H new ATOM 0 HD22 LEU A 70 3.448 -8.419 4.103 1.00 0.00 H new ATOM 0 HD23 LEU A 70 5.111 -8.470 4.736 1.00 0.00 H new ATOM 743 N GLY A 71 3.639 -13.453 3.300 1.00 0.00 N ATOM 744 CA GLY A 71 3.495 -14.771 2.738 1.00 0.00 C ATOM 745 C GLY A 71 4.434 -14.958 1.568 1.00 0.00 C ATOM 746 O GLY A 71 4.206 -15.795 0.691 1.00 0.00 O ATOM 0 H GLY A 71 4.171 -13.414 4.169 1.00 0.00 H new ATOM 0 HA2 GLY A 71 3.702 -15.522 3.501 1.00 0.00 H new ATOM 0 HA3 GLY A 71 2.466 -14.923 2.413 1.00 0.00 H new ATOM 750 N ILE A 72 5.490 -14.171 1.553 1.00 0.00 N ATOM 751 CA ILE A 72 6.455 -14.193 0.475 1.00 0.00 C ATOM 752 C ILE A 72 7.679 -15.016 0.881 1.00 0.00 C ATOM 753 O ILE A 72 8.348 -14.704 1.877 1.00 0.00 O ATOM 754 CB ILE A 72 6.888 -12.746 0.059 1.00 0.00 C ATOM 755 CG1 ILE A 72 5.683 -11.936 -0.476 1.00 0.00 C ATOM 756 CG2 ILE A 72 8.025 -12.767 -0.969 1.00 0.00 C ATOM 757 CD1 ILE A 72 5.034 -12.505 -1.726 1.00 0.00 C ATOM 0 H ILE A 72 5.703 -13.498 2.289 1.00 0.00 H new ATOM 0 HA ILE A 72 5.980 -14.658 -0.389 1.00 0.00 H new ATOM 0 HB ILE A 72 7.262 -12.252 0.956 1.00 0.00 H new ATOM 0 HG12 ILE A 72 4.930 -11.871 0.309 1.00 0.00 H new ATOM 0 HG13 ILE A 72 6.012 -10.918 -0.686 1.00 0.00 H new ATOM 0 HG21 ILE A 72 8.297 -11.745 -1.232 1.00 0.00 H new ATOM 0 HG22 ILE A 72 8.891 -13.275 -0.544 1.00 0.00 H new ATOM 0 HG23 ILE A 72 7.697 -13.297 -1.863 1.00 0.00 H new ATOM 0 HD11 ILE A 72 4.200 -11.870 -2.024 1.00 0.00 H new ATOM 0 HD12 ILE A 72 5.767 -12.543 -2.531 1.00 0.00 H new ATOM 0 HD13 ILE A 72 4.668 -13.511 -1.520 1.00 0.00 H new ATOM 769 N PRO A 73 7.946 -16.108 0.169 1.00 0.00 N ATOM 770 CA PRO A 73 9.106 -16.938 0.416 1.00 0.00 C ATOM 771 C PRO A 73 10.346 -16.430 -0.359 1.00 0.00 C ATOM 772 O PRO A 73 10.212 -15.741 -1.389 1.00 0.00 O ATOM 773 CB PRO A 73 8.658 -18.299 -0.107 1.00 0.00 C ATOM 774 CG PRO A 73 7.722 -17.990 -1.227 1.00 0.00 C ATOM 775 CD PRO A 73 7.117 -16.640 -0.936 1.00 0.00 C ATOM 0 HA PRO A 73 9.409 -16.948 1.463 1.00 0.00 H new ATOM 0 HB2 PRO A 73 9.507 -18.888 -0.453 1.00 0.00 H new ATOM 0 HB3 PRO A 73 8.164 -18.879 0.673 1.00 0.00 H new ATOM 0 HG2 PRO A 73 8.251 -17.978 -2.180 1.00 0.00 H new ATOM 0 HG3 PRO A 73 6.946 -18.752 -1.303 1.00 0.00 H new ATOM 0 HD2 PRO A 73 7.152 -15.990 -1.810 1.00 0.00 H new ATOM 0 HD3 PRO A 73 6.070 -16.726 -0.644 1.00 0.00 H new ATOM 783 N PRO A 74 11.562 -16.713 0.144 1.00 0.00 N ATOM 784 CA PRO A 74 12.800 -16.329 -0.526 1.00 0.00 C ATOM 785 C PRO A 74 12.982 -17.085 -1.836 1.00 0.00 C ATOM 786 O PRO A 74 12.479 -18.219 -2.007 1.00 0.00 O ATOM 787 CB PRO A 74 13.897 -16.728 0.463 1.00 0.00 C ATOM 788 CG PRO A 74 13.278 -17.778 1.307 1.00 0.00 C ATOM 789 CD PRO A 74 11.827 -17.416 1.409 1.00 0.00 C ATOM 0 HA PRO A 74 12.812 -15.269 -0.781 1.00 0.00 H new ATOM 0 HB2 PRO A 74 14.779 -17.105 -0.055 1.00 0.00 H new ATOM 0 HB3 PRO A 74 14.219 -15.876 1.063 1.00 0.00 H new ATOM 0 HG2 PRO A 74 13.405 -18.764 0.860 1.00 0.00 H new ATOM 0 HG3 PRO A 74 13.743 -17.812 2.292 1.00 0.00 H new ATOM 0 HD2 PRO A 74 11.199 -18.300 1.517 1.00 0.00 H new ATOM 0 HD3 PRO A 74 11.631 -16.779 2.272 1.00 0.00 H new ATOM 797 N ASN A 75 13.687 -16.487 -2.743 1.00 0.00 N ATOM 798 CA ASN A 75 13.917 -17.088 -4.035 1.00 0.00 C ATOM 799 C ASN A 75 15.187 -17.886 -4.014 1.00 0.00 C ATOM 800 O ASN A 75 16.203 -17.415 -3.509 1.00 0.00 O ATOM 801 CB ASN A 75 14.036 -16.022 -5.142 1.00 0.00 C ATOM 802 CG ASN A 75 12.747 -15.297 -5.448 1.00 0.00 C ATOM 803 OD1 ASN A 75 12.423 -14.289 -4.819 1.00 0.00 O ATOM 804 ND2 ASN A 75 12.023 -15.770 -6.427 1.00 0.00 N ATOM 0 H ASN A 75 14.121 -15.573 -2.618 1.00 0.00 H new ATOM 0 HA ASN A 75 13.063 -17.731 -4.248 1.00 0.00 H new ATOM 0 HB2 ASN A 75 14.789 -15.291 -4.847 1.00 0.00 H new ATOM 0 HB3 ASN A 75 14.396 -16.500 -6.053 1.00 0.00 H new ATOM 0 HD21 ASN A 75 11.157 -15.302 -6.693 1.00 0.00 H new ATOM 0 HD22 ASN A 75 12.324 -16.608 -6.925 1.00 0.00 H new ATOM 811 N PRO A 76 15.178 -19.108 -4.555 1.00 0.00 N ATOM 812 CA PRO A 76 16.399 -19.878 -4.723 1.00 0.00 C ATOM 813 C PRO A 76 17.279 -19.213 -5.790 1.00 0.00 C ATOM 814 O PRO A 76 18.463 -19.441 -5.873 1.00 0.00 O ATOM 815 CB PRO A 76 15.922 -21.263 -5.167 1.00 0.00 C ATOM 816 CG PRO A 76 14.548 -21.058 -5.702 1.00 0.00 C ATOM 817 CD PRO A 76 13.981 -19.861 -4.994 1.00 0.00 C ATOM 0 HA PRO A 76 17.002 -19.939 -3.817 1.00 0.00 H new ATOM 0 HB2 PRO A 76 16.581 -21.680 -5.928 1.00 0.00 H new ATOM 0 HB3 PRO A 76 15.917 -21.963 -4.331 1.00 0.00 H new ATOM 0 HG2 PRO A 76 14.573 -20.894 -6.779 1.00 0.00 H new ATOM 0 HG3 PRO A 76 13.930 -21.939 -5.528 1.00 0.00 H new ATOM 0 HD2 PRO A 76 13.354 -19.264 -5.657 1.00 0.00 H new ATOM 0 HD3 PRO A 76 13.360 -20.154 -4.147 1.00 0.00 H new ATOM 825 N GLU A 77 16.653 -18.365 -6.599 1.00 0.00 N ATOM 826 CA GLU A 77 17.336 -17.578 -7.624 1.00 0.00 C ATOM 827 C GLU A 77 18.201 -16.495 -6.974 1.00 0.00 C ATOM 828 O GLU A 77 19.137 -15.985 -7.586 1.00 0.00 O ATOM 829 CB GLU A 77 16.320 -16.880 -8.555 1.00 0.00 C ATOM 830 CG GLU A 77 15.462 -17.782 -9.445 1.00 0.00 C ATOM 831 CD GLU A 77 14.597 -18.749 -8.690 1.00 0.00 C ATOM 832 OE1 GLU A 77 13.728 -18.311 -7.924 1.00 0.00 O ATOM 833 OE2 GLU A 77 14.799 -19.974 -8.827 1.00 0.00 O ATOM 0 H GLU A 77 15.647 -18.202 -6.563 1.00 0.00 H new ATOM 0 HA GLU A 77 17.955 -18.264 -8.202 1.00 0.00 H new ATOM 0 HB2 GLU A 77 15.652 -16.278 -7.938 1.00 0.00 H new ATOM 0 HB3 GLU A 77 16.867 -16.191 -9.198 1.00 0.00 H new ATOM 0 HG2 GLU A 77 14.826 -17.156 -10.072 1.00 0.00 H new ATOM 0 HG3 GLU A 77 16.116 -18.342 -10.113 1.00 0.00 H new ATOM 840 N ASP A 78 17.915 -16.197 -5.710 1.00 0.00 N ATOM 841 CA ASP A 78 18.549 -15.081 -4.993 1.00 0.00 C ATOM 842 C ASP A 78 20.016 -15.375 -4.628 1.00 0.00 C ATOM 843 O ASP A 78 20.726 -14.532 -4.091 1.00 0.00 O ATOM 844 CB ASP A 78 17.715 -14.701 -3.765 1.00 0.00 C ATOM 845 CG ASP A 78 18.089 -13.369 -3.169 1.00 0.00 C ATOM 846 OD1 ASP A 78 18.610 -12.510 -3.894 1.00 0.00 O ATOM 847 OD2 ASP A 78 17.785 -13.126 -1.981 1.00 0.00 O ATOM 0 H ASP A 78 17.240 -16.717 -5.150 1.00 0.00 H new ATOM 0 HA ASP A 78 18.577 -14.224 -5.666 1.00 0.00 H new ATOM 0 HB2 ASP A 78 16.661 -14.682 -4.044 1.00 0.00 H new ATOM 0 HB3 ASP A 78 17.829 -15.474 -3.005 1.00 0.00 H new ATOM 852 N ARG A 79 20.476 -16.580 -4.949 1.00 0.00 N ATOM 853 CA ARG A 79 21.896 -16.907 -4.818 1.00 0.00 C ATOM 854 C ARG A 79 22.729 -16.147 -5.853 1.00 0.00 C ATOM 855 O ARG A 79 23.954 -16.112 -5.776 1.00 0.00 O ATOM 856 CB ARG A 79 22.179 -18.433 -4.833 1.00 0.00 C ATOM 857 CG ARG A 79 21.382 -19.258 -5.837 1.00 0.00 C ATOM 858 CD ARG A 79 21.607 -18.873 -7.287 1.00 0.00 C ATOM 859 NE ARG A 79 20.613 -19.507 -8.161 1.00 0.00 N ATOM 860 CZ ARG A 79 20.721 -19.635 -9.489 1.00 0.00 C ATOM 861 NH1 ARG A 79 21.856 -19.330 -10.104 1.00 0.00 N ATOM 862 NH2 ARG A 79 19.704 -20.103 -10.188 1.00 0.00 N ATOM 0 H ARG A 79 19.894 -17.342 -5.299 1.00 0.00 H new ATOM 0 HA ARG A 79 22.207 -16.571 -3.829 1.00 0.00 H new ATOM 0 HB2 ARG A 79 23.240 -18.582 -5.033 1.00 0.00 H new ATOM 0 HB3 ARG A 79 21.984 -18.827 -3.835 1.00 0.00 H new ATOM 0 HG2 ARG A 79 21.639 -20.310 -5.709 1.00 0.00 H new ATOM 0 HG3 ARG A 79 20.321 -19.159 -5.608 1.00 0.00 H new ATOM 0 HD2 ARG A 79 21.550 -17.790 -7.392 1.00 0.00 H new ATOM 0 HD3 ARG A 79 22.609 -19.171 -7.595 1.00 0.00 H new ATOM 0 HE ARG A 79 19.772 -19.880 -7.721 1.00 0.00 H new ATOM 0 HH11 ARG A 79 22.654 -18.995 -9.565 1.00 0.00 H new ATOM 0 HH12 ARG A 79 21.930 -19.430 -11.116 1.00 0.00 H new ATOM 0 HH21 ARG A 79 18.839 -20.366 -9.716 1.00 0.00 H new ATOM 0 HH22 ARG A 79 19.783 -20.202 -11.200 1.00 0.00 H new ATOM 876 N SER A 80 22.042 -15.576 -6.826 1.00 0.00 N ATOM 877 CA SER A 80 22.637 -14.703 -7.785 1.00 0.00 C ATOM 878 C SER A 80 22.655 -13.315 -7.138 1.00 0.00 C ATOM 879 O SER A 80 21.588 -12.743 -6.888 1.00 0.00 O ATOM 880 CB SER A 80 21.770 -14.697 -9.041 1.00 0.00 C ATOM 881 OG SER A 80 21.489 -16.037 -9.456 1.00 0.00 O ATOM 0 H SER A 80 21.041 -15.717 -6.962 1.00 0.00 H new ATOM 0 HA SER A 80 23.644 -15.012 -8.066 1.00 0.00 H new ATOM 0 HB2 SER A 80 20.838 -14.167 -8.845 1.00 0.00 H new ATOM 0 HB3 SER A 80 22.280 -14.161 -9.841 1.00 0.00 H new ATOM 0 HG SER A 80 20.704 -16.371 -8.974 1.00 0.00 H new ATOM 887 N PRO A 81 23.844 -12.791 -6.804 1.00 0.00 N ATOM 888 CA PRO A 81 23.992 -11.528 -6.050 1.00 0.00 C ATOM 889 C PRO A 81 23.272 -10.328 -6.679 1.00 0.00 C ATOM 890 O PRO A 81 23.277 -10.146 -7.895 1.00 0.00 O ATOM 891 CB PRO A 81 25.502 -11.298 -6.041 1.00 0.00 C ATOM 892 CG PRO A 81 26.093 -12.648 -6.224 1.00 0.00 C ATOM 893 CD PRO A 81 25.156 -13.379 -7.131 1.00 0.00 C ATOM 0 HA PRO A 81 23.539 -11.613 -5.062 1.00 0.00 H new ATOM 0 HB2 PRO A 81 25.804 -10.622 -6.841 1.00 0.00 H new ATOM 0 HB3 PRO A 81 25.828 -10.847 -5.104 1.00 0.00 H new ATOM 0 HG2 PRO A 81 27.090 -12.583 -6.660 1.00 0.00 H new ATOM 0 HG3 PRO A 81 26.196 -13.163 -5.269 1.00 0.00 H new ATOM 0 HD2 PRO A 81 25.413 -13.231 -8.180 1.00 0.00 H new ATOM 0 HD3 PRO A 81 25.173 -14.453 -6.947 1.00 0.00 H new ATOM 901 N SER A 82 22.654 -9.531 -5.843 1.00 0.00 N ATOM 902 CA SER A 82 21.977 -8.343 -6.272 1.00 0.00 C ATOM 903 C SER A 82 22.919 -7.165 -6.181 1.00 0.00 C ATOM 904 O SER A 82 23.680 -7.054 -5.210 1.00 0.00 O ATOM 905 CB SER A 82 20.770 -8.051 -5.373 1.00 0.00 C ATOM 906 OG SER A 82 19.800 -9.083 -5.418 1.00 0.00 O ATOM 0 H SER A 82 22.609 -9.694 -4.837 1.00 0.00 H new ATOM 0 HA SER A 82 21.642 -8.496 -7.298 1.00 0.00 H new ATOM 0 HB2 SER A 82 21.109 -7.920 -4.345 1.00 0.00 H new ATOM 0 HB3 SER A 82 20.311 -7.111 -5.680 1.00 0.00 H new ATOM 0 HG SER A 82 18.948 -8.718 -5.737 1.00 0.00 H new ATOM 912 N PRO A 83 22.932 -6.296 -7.184 1.00 0.00 N ATOM 913 CA PRO A 83 23.660 -5.048 -7.092 1.00 0.00 C ATOM 914 C PRO A 83 23.062 -4.200 -5.970 1.00 0.00 C ATOM 915 O PRO A 83 21.849 -4.294 -5.686 1.00 0.00 O ATOM 916 CB PRO A 83 23.416 -4.378 -8.442 1.00 0.00 C ATOM 917 CG PRO A 83 22.995 -5.472 -9.353 1.00 0.00 C ATOM 918 CD PRO A 83 22.288 -6.473 -8.496 1.00 0.00 C ATOM 0 HA PRO A 83 24.720 -5.180 -6.877 1.00 0.00 H new ATOM 0 HB2 PRO A 83 22.645 -3.611 -8.367 1.00 0.00 H new ATOM 0 HB3 PRO A 83 24.319 -3.888 -8.807 1.00 0.00 H new ATOM 0 HG2 PRO A 83 22.338 -5.096 -10.137 1.00 0.00 H new ATOM 0 HG3 PRO A 83 23.856 -5.921 -9.848 1.00 0.00 H new ATOM 0 HD2 PRO A 83 21.216 -6.280 -8.449 1.00 0.00 H new ATOM 0 HD3 PRO A 83 22.413 -7.488 -8.874 1.00 0.00 H new ATOM 926 N GLU A 84 23.878 -3.403 -5.346 1.00 0.00 N ATOM 927 CA GLU A 84 23.448 -2.593 -4.230 1.00 0.00 C ATOM 928 C GLU A 84 22.576 -1.433 -4.708 1.00 0.00 C ATOM 929 O GLU A 84 22.703 -0.989 -5.861 1.00 0.00 O ATOM 930 CB GLU A 84 24.658 -2.071 -3.472 1.00 0.00 C ATOM 931 CG GLU A 84 25.526 -3.164 -2.888 1.00 0.00 C ATOM 932 CD GLU A 84 26.712 -2.613 -2.166 1.00 0.00 C ATOM 933 OE1 GLU A 84 27.660 -2.166 -2.831 1.00 0.00 O ATOM 934 OE2 GLU A 84 26.698 -2.578 -0.908 1.00 0.00 O ATOM 0 H GLU A 84 24.862 -3.291 -5.591 1.00 0.00 H new ATOM 0 HA GLU A 84 22.851 -3.212 -3.560 1.00 0.00 H new ATOM 0 HB2 GLU A 84 25.261 -1.460 -4.144 1.00 0.00 H new ATOM 0 HB3 GLU A 84 24.318 -1.419 -2.667 1.00 0.00 H new ATOM 0 HG2 GLU A 84 24.934 -3.769 -2.202 1.00 0.00 H new ATOM 0 HG3 GLU A 84 25.863 -3.825 -3.687 1.00 0.00 H new ATOM 941 N PRO A 85 21.652 -0.954 -3.858 1.00 0.00 N ATOM 942 CA PRO A 85 20.795 0.181 -4.186 1.00 0.00 C ATOM 943 C PRO A 85 21.586 1.464 -4.439 1.00 0.00 C ATOM 944 O PRO A 85 22.757 1.602 -4.015 1.00 0.00 O ATOM 945 CB PRO A 85 19.893 0.352 -2.957 1.00 0.00 C ATOM 946 CG PRO A 85 20.552 -0.422 -1.865 1.00 0.00 C ATOM 947 CD PRO A 85 21.332 -1.514 -2.530 1.00 0.00 C ATOM 0 HA PRO A 85 20.242 -0.004 -5.107 1.00 0.00 H new ATOM 0 HB2 PRO A 85 19.793 1.403 -2.687 1.00 0.00 H new ATOM 0 HB3 PRO A 85 18.889 -0.024 -3.153 1.00 0.00 H new ATOM 0 HG2 PRO A 85 21.207 0.219 -1.276 1.00 0.00 H new ATOM 0 HG3 PRO A 85 19.811 -0.836 -1.181 1.00 0.00 H new ATOM 0 HD2 PRO A 85 22.235 -1.760 -1.971 1.00 0.00 H new ATOM 0 HD3 PRO A 85 20.748 -2.431 -2.612 1.00 0.00 H new ATOM 955 N ILE A 86 20.963 2.381 -5.127 1.00 0.00 N ATOM 956 CA ILE A 86 21.557 3.654 -5.434 1.00 0.00 C ATOM 957 C ILE A 86 21.440 4.575 -4.227 1.00 0.00 C ATOM 958 O ILE A 86 20.478 4.495 -3.461 1.00 0.00 O ATOM 959 CB ILE A 86 20.944 4.296 -6.751 1.00 0.00 C ATOM 960 CG1 ILE A 86 21.534 3.646 -8.014 1.00 0.00 C ATOM 961 CG2 ILE A 86 21.123 5.811 -6.826 1.00 0.00 C ATOM 962 CD1 ILE A 86 21.201 2.181 -8.223 1.00 0.00 C ATOM 0 H ILE A 86 20.019 2.265 -5.494 1.00 0.00 H new ATOM 0 HA ILE A 86 22.615 3.504 -5.648 1.00 0.00 H new ATOM 0 HB ILE A 86 19.874 4.097 -6.701 1.00 0.00 H new ATOM 0 HG12 ILE A 86 21.187 4.205 -8.883 1.00 0.00 H new ATOM 0 HG13 ILE A 86 22.618 3.751 -7.980 1.00 0.00 H new ATOM 0 HG21 ILE A 86 20.682 6.184 -7.750 1.00 0.00 H new ATOM 0 HG22 ILE A 86 20.630 6.278 -5.974 1.00 0.00 H new ATOM 0 HG23 ILE A 86 22.186 6.053 -6.808 1.00 0.00 H new ATOM 0 HD11 ILE A 86 21.669 1.829 -9.142 1.00 0.00 H new ATOM 0 HD12 ILE A 86 21.574 1.599 -7.380 1.00 0.00 H new ATOM 0 HD13 ILE A 86 20.120 2.060 -8.297 1.00 0.00 H new ATOM 974 N TYR A 87 22.438 5.394 -4.045 1.00 0.00 N ATOM 975 CA TYR A 87 22.514 6.296 -2.933 1.00 0.00 C ATOM 976 C TYR A 87 21.537 7.433 -3.102 1.00 0.00 C ATOM 977 O TYR A 87 21.350 7.958 -4.206 1.00 0.00 O ATOM 978 CB TYR A 87 23.944 6.808 -2.775 1.00 0.00 C ATOM 979 CG TYR A 87 24.911 5.710 -2.406 1.00 0.00 C ATOM 980 CD1 TYR A 87 25.432 4.862 -3.376 1.00 0.00 C ATOM 981 CD2 TYR A 87 25.275 5.495 -1.085 1.00 0.00 C ATOM 982 CE1 TYR A 87 26.276 3.833 -3.044 1.00 0.00 C ATOM 983 CE2 TYR A 87 26.134 4.466 -0.745 1.00 0.00 C ATOM 984 CZ TYR A 87 26.625 3.639 -1.732 1.00 0.00 C ATOM 985 OH TYR A 87 27.456 2.596 -1.404 1.00 0.00 O ATOM 0 H TYR A 87 23.236 5.453 -4.678 1.00 0.00 H new ATOM 0 HA TYR A 87 22.240 5.762 -2.023 1.00 0.00 H new ATOM 0 HB2 TYR A 87 24.265 7.273 -3.707 1.00 0.00 H new ATOM 0 HB3 TYR A 87 23.967 7.582 -2.008 1.00 0.00 H new ATOM 0 HD1 TYR A 87 25.167 5.016 -4.412 1.00 0.00 H new ATOM 0 HD2 TYR A 87 24.883 6.139 -0.312 1.00 0.00 H new ATOM 0 HE1 TYR A 87 26.663 3.179 -3.811 1.00 0.00 H new ATOM 0 HE2 TYR A 87 26.418 4.312 0.286 1.00 0.00 H new ATOM 0 HH TYR A 87 27.610 2.593 -0.436 1.00 0.00 H new ATOM 995 N ASN A 88 20.914 7.790 -2.019 1.00 0.00 N ATOM 996 CA ASN A 88 19.909 8.838 -1.965 1.00 0.00 C ATOM 997 C ASN A 88 20.547 10.191 -2.222 1.00 0.00 C ATOM 998 O ASN A 88 21.781 10.328 -2.209 1.00 0.00 O ATOM 999 CB ASN A 88 19.285 8.878 -0.571 1.00 0.00 C ATOM 1000 CG ASN A 88 18.465 7.669 -0.165 1.00 0.00 C ATOM 1001 OD1 ASN A 88 18.641 6.566 -0.665 1.00 0.00 O ATOM 1002 ND2 ASN A 88 17.631 7.856 0.817 1.00 0.00 N ATOM 0 H ASN A 88 21.089 7.353 -1.114 1.00 0.00 H new ATOM 0 HA ASN A 88 19.154 8.627 -2.722 1.00 0.00 H new ATOM 0 HB2 ASN A 88 20.085 9.009 0.158 1.00 0.00 H new ATOM 0 HB3 ASN A 88 18.648 9.760 -0.507 1.00 0.00 H new ATOM 0 HD21 ASN A 88 17.101 7.070 1.192 1.00 0.00 H new ATOM 0 HD22 ASN A 88 17.508 8.789 1.211 1.00 0.00 H new ATOM 1009 N SER A 89 19.727 11.200 -2.404 1.00 0.00 N ATOM 1010 CA SER A 89 20.198 12.552 -2.627 1.00 0.00 C ATOM 1011 C SER A 89 20.812 13.124 -1.336 1.00 0.00 C ATOM 1012 O SER A 89 21.611 14.053 -1.358 1.00 0.00 O ATOM 1013 CB SER A 89 19.031 13.395 -3.117 1.00 0.00 C ATOM 1014 OG SER A 89 18.413 12.753 -4.239 1.00 0.00 O ATOM 0 H SER A 89 18.711 11.109 -2.402 1.00 0.00 H new ATOM 0 HA SER A 89 20.982 12.560 -3.384 1.00 0.00 H new ATOM 0 HB2 SER A 89 18.304 13.529 -2.316 1.00 0.00 H new ATOM 0 HB3 SER A 89 19.380 14.388 -3.400 1.00 0.00 H new ATOM 0 HG SER A 89 17.660 13.296 -4.553 1.00 0.00 H new ATOM 1020 N GLU A 90 20.445 12.520 -0.225 1.00 0.00 N ATOM 1021 CA GLU A 90 20.957 12.868 1.095 1.00 0.00 C ATOM 1022 C GLU A 90 22.326 12.187 1.342 1.00 0.00 C ATOM 1023 O GLU A 90 22.925 12.351 2.395 1.00 0.00 O ATOM 1024 CB GLU A 90 19.927 12.427 2.149 1.00 0.00 C ATOM 1025 CG GLU A 90 19.713 10.924 2.168 1.00 0.00 C ATOM 1026 CD GLU A 90 18.379 10.506 2.723 1.00 0.00 C ATOM 1027 OE1 GLU A 90 17.403 10.445 1.939 1.00 0.00 O ATOM 1028 OE2 GLU A 90 18.267 10.199 3.913 1.00 0.00 O ATOM 0 H GLU A 90 19.769 11.757 -0.208 1.00 0.00 H new ATOM 0 HA GLU A 90 21.110 13.945 1.163 1.00 0.00 H new ATOM 0 HB2 GLU A 90 20.259 12.755 3.134 1.00 0.00 H new ATOM 0 HB3 GLU A 90 18.976 12.923 1.951 1.00 0.00 H new ATOM 0 HG2 GLU A 90 19.810 10.540 1.152 1.00 0.00 H new ATOM 0 HG3 GLU A 90 20.503 10.462 2.760 1.00 0.00 H new ATOM 1035 N GLY A 91 22.775 11.381 0.369 1.00 0.00 N ATOM 1036 CA GLY A 91 24.075 10.702 0.452 1.00 0.00 C ATOM 1037 C GLY A 91 24.025 9.404 1.244 1.00 0.00 C ATOM 1038 O GLY A 91 24.998 8.646 1.293 1.00 0.00 O ATOM 0 H GLY A 91 22.255 11.184 -0.486 1.00 0.00 H new ATOM 0 HA2 GLY A 91 24.432 10.491 -0.556 1.00 0.00 H new ATOM 0 HA3 GLY A 91 24.799 11.373 0.913 1.00 0.00 H new ATOM 1042 N LYS A 92 22.894 9.138 1.837 1.00 0.00 N ATOM 1043 CA LYS A 92 22.702 7.932 2.602 1.00 0.00 C ATOM 1044 C LYS A 92 22.123 6.901 1.666 1.00 0.00 C ATOM 1045 O LYS A 92 21.505 7.259 0.679 1.00 0.00 O ATOM 1046 CB LYS A 92 21.739 8.210 3.777 1.00 0.00 C ATOM 1047 CG LYS A 92 21.684 7.111 4.835 1.00 0.00 C ATOM 1048 CD LYS A 92 20.913 7.572 6.065 1.00 0.00 C ATOM 1049 CE LYS A 92 19.412 7.685 5.831 1.00 0.00 C ATOM 1050 NZ LYS A 92 18.767 6.363 5.673 1.00 0.00 N ATOM 0 H LYS A 92 22.078 9.749 1.805 1.00 0.00 H new ATOM 0 HA LYS A 92 23.642 7.574 3.022 1.00 0.00 H new ATOM 0 HB2 LYS A 92 22.035 9.143 4.257 1.00 0.00 H new ATOM 0 HB3 LYS A 92 20.736 8.361 3.378 1.00 0.00 H new ATOM 0 HG2 LYS A 92 21.210 6.223 4.417 1.00 0.00 H new ATOM 0 HG3 LYS A 92 22.697 6.827 5.122 1.00 0.00 H new ATOM 0 HD2 LYS A 92 21.094 6.873 6.881 1.00 0.00 H new ATOM 0 HD3 LYS A 92 21.298 8.541 6.384 1.00 0.00 H new ATOM 0 HE2 LYS A 92 18.955 8.212 6.668 1.00 0.00 H new ATOM 0 HE3 LYS A 92 19.230 8.285 4.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 17.736 6.484 5.618 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 19.110 5.912 4.801 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 19.002 5.762 6.489 1.00 0.00 H new ATOM 1064 N ARG A 93 22.342 5.659 1.918 1.00 0.00 N ATOM 1065 CA ARG A 93 21.774 4.656 1.076 1.00 0.00 C ATOM 1066 C ARG A 93 20.631 4.032 1.814 1.00 0.00 C ATOM 1067 O ARG A 93 20.781 3.638 2.977 1.00 0.00 O ATOM 1068 CB ARG A 93 22.806 3.612 0.686 1.00 0.00 C ATOM 1069 CG ARG A 93 22.366 2.760 -0.482 1.00 0.00 C ATOM 1070 CD ARG A 93 23.452 1.802 -0.919 1.00 0.00 C ATOM 1071 NE ARG A 93 23.658 0.683 0.010 1.00 0.00 N ATOM 1072 CZ ARG A 93 24.678 -0.191 -0.069 1.00 0.00 C ATOM 1073 NH1 ARG A 93 25.786 0.112 -0.759 1.00 0.00 N ATOM 1074 NH2 ARG A 93 24.631 -1.340 0.598 1.00 0.00 N ATOM 0 H ARG A 93 22.906 5.310 2.693 1.00 0.00 H new ATOM 0 HA ARG A 93 21.422 5.107 0.148 1.00 0.00 H new ATOM 0 HB2 ARG A 93 23.742 4.110 0.434 1.00 0.00 H new ATOM 0 HB3 ARG A 93 23.007 2.969 1.543 1.00 0.00 H new ATOM 0 HG2 ARG A 93 21.474 2.197 -0.206 1.00 0.00 H new ATOM 0 HG3 ARG A 93 22.091 3.403 -1.318 1.00 0.00 H new ATOM 0 HD2 ARG A 93 23.201 1.405 -1.903 1.00 0.00 H new ATOM 0 HD3 ARG A 93 24.387 2.351 -1.026 1.00 0.00 H new ATOM 0 HE ARG A 93 22.983 0.560 0.765 1.00 0.00 H new ATOM 0 HH11 ARG A 93 25.862 1.013 -1.231 1.00 0.00 H new ATOM 0 HH12 ARG A 93 26.553 -0.558 -0.812 1.00 0.00 H new ATOM 0 HH21 ARG A 93 23.819 -1.563 1.173 1.00 0.00 H new ATOM 0 HH22 ARG A 93 25.407 -1.999 0.534 1.00 0.00 H new ATOM 1088 N LEU A 94 19.494 3.962 1.190 1.00 0.00 N ATOM 1089 CA LEU A 94 18.340 3.436 1.868 1.00 0.00 C ATOM 1090 C LEU A 94 18.224 1.936 1.634 1.00 0.00 C ATOM 1091 O LEU A 94 19.057 1.330 0.946 1.00 0.00 O ATOM 1092 CB LEU A 94 17.033 4.176 1.467 1.00 0.00 C ATOM 1093 CG LEU A 94 16.258 3.681 0.229 1.00 0.00 C ATOM 1094 CD1 LEU A 94 15.052 4.546 -0.011 1.00 0.00 C ATOM 1095 CD2 LEU A 94 17.114 3.633 -1.008 1.00 0.00 C ATOM 0 H LEU A 94 19.337 4.257 0.226 1.00 0.00 H new ATOM 0 HA LEU A 94 18.478 3.609 2.935 1.00 0.00 H new ATOM 0 HB2 LEU A 94 16.355 4.138 2.320 1.00 0.00 H new ATOM 0 HB3 LEU A 94 17.282 5.225 1.305 1.00 0.00 H new ATOM 0 HG LEU A 94 15.940 2.660 0.440 1.00 0.00 H new ATOM 0 HD11 LEU A 94 14.514 4.185 -0.888 1.00 0.00 H new ATOM 0 HD12 LEU A 94 14.396 4.506 0.859 1.00 0.00 H new ATOM 0 HD13 LEU A 94 15.370 5.575 -0.178 1.00 0.00 H new ATOM 0 HD21 LEU A 94 16.518 3.278 -1.849 1.00 0.00 H new ATOM 0 HD22 LEU A 94 17.493 4.631 -1.227 1.00 0.00 H new ATOM 0 HD23 LEU A 94 17.952 2.955 -0.845 1.00 0.00 H new ATOM 1107 N ASN A 95 17.232 1.361 2.219 1.00 0.00 N ATOM 1108 CA ASN A 95 16.942 -0.043 2.085 1.00 0.00 C ATOM 1109 C ASN A 95 16.293 -0.303 0.749 1.00 0.00 C ATOM 1110 O ASN A 95 15.589 0.551 0.240 1.00 0.00 O ATOM 1111 CB ASN A 95 16.058 -0.510 3.229 1.00 0.00 C ATOM 1112 CG ASN A 95 16.723 -0.367 4.592 1.00 0.00 C ATOM 1113 OD1 ASN A 95 16.052 -0.173 5.602 1.00 0.00 O ATOM 1114 ND2 ASN A 95 18.039 -0.425 4.627 1.00 0.00 N ATOM 0 H ASN A 95 16.577 1.858 2.822 1.00 0.00 H new ATOM 0 HA ASN A 95 17.871 -0.611 2.131 1.00 0.00 H new ATOM 0 HB2 ASN A 95 15.131 0.063 3.221 1.00 0.00 H new ATOM 0 HB3 ASN A 95 15.789 -1.554 3.070 1.00 0.00 H new ATOM 0 HD21 ASN A 95 18.531 -0.307 5.513 1.00 0.00 H new ATOM 0 HD22 ASN A 95 18.565 -0.588 3.769 1.00 0.00 H new ATOM 1121 N THR A 96 16.537 -1.441 0.162 1.00 0.00 N ATOM 1122 CA THR A 96 16.017 -1.668 -1.152 1.00 0.00 C ATOM 1123 C THR A 96 14.737 -2.521 -1.156 1.00 0.00 C ATOM 1124 O THR A 96 13.641 -1.966 -1.213 1.00 0.00 O ATOM 1125 CB THR A 96 17.107 -2.143 -2.175 1.00 0.00 C ATOM 1126 OG1 THR A 96 16.539 -2.376 -3.469 1.00 0.00 O ATOM 1127 CG2 THR A 96 17.886 -3.374 -1.700 1.00 0.00 C ATOM 0 H THR A 96 17.079 -2.207 0.562 1.00 0.00 H new ATOM 0 HA THR A 96 15.701 -0.692 -1.520 1.00 0.00 H new ATOM 0 HB THR A 96 17.825 -1.326 -2.247 1.00 0.00 H new ATOM 0 HG1 THR A 96 17.241 -2.669 -4.087 1.00 0.00 H new ATOM 0 HG21 THR A 96 18.624 -3.651 -2.453 1.00 0.00 H new ATOM 0 HG22 THR A 96 18.393 -3.144 -0.763 1.00 0.00 H new ATOM 0 HG23 THR A 96 17.196 -4.204 -1.546 1.00 0.00 H new ATOM 1135 N ARG A 97 14.856 -3.835 -0.986 1.00 0.00 N ATOM 1136 CA ARG A 97 13.699 -4.736 -1.074 1.00 0.00 C ATOM 1137 C ARG A 97 12.782 -4.467 0.089 1.00 0.00 C ATOM 1138 O ARG A 97 11.578 -4.427 -0.046 1.00 0.00 O ATOM 1139 CB ARG A 97 14.144 -6.185 -0.991 1.00 0.00 C ATOM 1140 CG ARG A 97 15.211 -6.599 -1.973 1.00 0.00 C ATOM 1141 CD ARG A 97 15.619 -8.027 -1.698 1.00 0.00 C ATOM 1142 NE ARG A 97 16.731 -8.465 -2.537 1.00 0.00 N ATOM 1143 CZ ARG A 97 17.231 -9.701 -2.549 1.00 0.00 C ATOM 1144 NH1 ARG A 97 16.697 -10.659 -1.794 1.00 0.00 N ATOM 1145 NH2 ARG A 97 18.255 -9.989 -3.318 1.00 0.00 N ATOM 0 H ARG A 97 15.739 -4.304 -0.786 1.00 0.00 H new ATOM 0 HA ARG A 97 13.194 -4.562 -2.024 1.00 0.00 H new ATOM 0 HB2 ARG A 97 14.511 -6.376 0.018 1.00 0.00 H new ATOM 0 HB3 ARG A 97 13.272 -6.823 -1.139 1.00 0.00 H new ATOM 0 HG2 ARG A 97 14.838 -6.506 -2.993 1.00 0.00 H new ATOM 0 HG3 ARG A 97 16.075 -5.940 -1.888 1.00 0.00 H new ATOM 0 HD2 ARG A 97 15.899 -8.125 -0.649 1.00 0.00 H new ATOM 0 HD3 ARG A 97 14.764 -8.683 -1.862 1.00 0.00 H new ATOM 0 HE ARG A 97 17.156 -7.776 -3.158 1.00 0.00 H new ATOM 0 HH11 ARG A 97 15.896 -10.451 -1.197 1.00 0.00 H new ATOM 0 HH12 ARG A 97 17.089 -11.601 -1.812 1.00 0.00 H new ATOM 0 HH21 ARG A 97 18.669 -9.267 -3.907 1.00 0.00 H new ATOM 0 HH22 ARG A 97 18.637 -10.935 -3.326 1.00 0.00 H new ATOM 1159 N GLU A 98 13.407 -4.212 1.208 1.00 0.00 N ATOM 1160 CA GLU A 98 12.768 -3.969 2.486 1.00 0.00 C ATOM 1161 C GLU A 98 11.825 -2.786 2.350 1.00 0.00 C ATOM 1162 O GLU A 98 10.635 -2.857 2.670 1.00 0.00 O ATOM 1163 CB GLU A 98 13.840 -3.540 3.530 1.00 0.00 C ATOM 1164 CG GLU A 98 15.107 -4.413 3.660 1.00 0.00 C ATOM 1165 CD GLU A 98 16.039 -4.338 2.444 1.00 0.00 C ATOM 1166 OE1 GLU A 98 16.850 -3.408 2.346 1.00 0.00 O ATOM 1167 OE2 GLU A 98 15.921 -5.188 1.543 1.00 0.00 O ATOM 0 H GLU A 98 14.424 -4.165 1.262 1.00 0.00 H new ATOM 0 HA GLU A 98 12.248 -4.876 2.794 1.00 0.00 H new ATOM 0 HB2 GLU A 98 14.156 -2.525 3.288 1.00 0.00 H new ATOM 0 HB3 GLU A 98 13.359 -3.500 4.507 1.00 0.00 H new ATOM 0 HG2 GLU A 98 15.659 -4.106 4.548 1.00 0.00 H new ATOM 0 HG3 GLU A 98 14.808 -5.450 3.813 1.00 0.00 H new ATOM 1174 N PHE A 99 12.383 -1.730 1.821 1.00 0.00 N ATOM 1175 CA PHE A 99 11.716 -0.477 1.651 1.00 0.00 C ATOM 1176 C PHE A 99 10.642 -0.612 0.605 1.00 0.00 C ATOM 1177 O PHE A 99 9.516 -0.202 0.813 1.00 0.00 O ATOM 1178 CB PHE A 99 12.746 0.529 1.210 1.00 0.00 C ATOM 1179 CG PHE A 99 12.361 1.962 1.309 1.00 0.00 C ATOM 1180 CD1 PHE A 99 11.726 2.615 0.264 1.00 0.00 C ATOM 1181 CD2 PHE A 99 12.693 2.673 2.440 1.00 0.00 C ATOM 1182 CE1 PHE A 99 11.435 3.957 0.349 1.00 0.00 C ATOM 1183 CE2 PHE A 99 12.394 4.016 2.540 1.00 0.00 C ATOM 1184 CZ PHE A 99 11.769 4.659 1.489 1.00 0.00 C ATOM 0 H PHE A 99 13.347 -1.723 1.487 1.00 0.00 H new ATOM 0 HA PHE A 99 11.248 -0.158 2.582 1.00 0.00 H new ATOM 0 HB2 PHE A 99 13.647 0.376 1.804 1.00 0.00 H new ATOM 0 HB3 PHE A 99 13.007 0.317 0.173 1.00 0.00 H new ATOM 0 HD1 PHE A 99 11.457 2.065 -0.626 1.00 0.00 H new ATOM 0 HD2 PHE A 99 13.193 2.174 3.257 1.00 0.00 H new ATOM 0 HE1 PHE A 99 10.947 4.459 -0.473 1.00 0.00 H new ATOM 0 HE2 PHE A 99 12.647 4.563 3.436 1.00 0.00 H new ATOM 0 HZ PHE A 99 11.542 5.712 1.560 1.00 0.00 H new ATOM 1194 N ARG A 100 11.004 -1.222 -0.510 1.00 0.00 N ATOM 1195 CA ARG A 100 10.108 -1.395 -1.632 1.00 0.00 C ATOM 1196 C ARG A 100 8.894 -2.234 -1.299 1.00 0.00 C ATOM 1197 O ARG A 100 7.784 -1.828 -1.608 1.00 0.00 O ATOM 1198 CB ARG A 100 10.838 -1.931 -2.862 1.00 0.00 C ATOM 1199 CG ARG A 100 11.741 -0.905 -3.557 1.00 0.00 C ATOM 1200 CD ARG A 100 10.926 0.272 -4.087 1.00 0.00 C ATOM 1201 NE ARG A 100 9.794 -0.189 -4.910 1.00 0.00 N ATOM 1202 CZ ARG A 100 8.601 0.418 -5.003 1.00 0.00 C ATOM 1203 NH1 ARG A 100 8.427 1.647 -4.509 1.00 0.00 N ATOM 1204 NH2 ARG A 100 7.604 -0.183 -5.636 1.00 0.00 N ATOM 0 H ARG A 100 11.934 -1.612 -0.660 1.00 0.00 H new ATOM 0 HA ARG A 100 9.734 -0.400 -1.873 1.00 0.00 H new ATOM 0 HB2 ARG A 100 11.443 -2.788 -2.566 1.00 0.00 H new ATOM 0 HB3 ARG A 100 10.101 -2.293 -3.579 1.00 0.00 H new ATOM 0 HG2 ARG A 100 12.494 -0.544 -2.856 1.00 0.00 H new ATOM 0 HG3 ARG A 100 12.274 -1.382 -4.379 1.00 0.00 H new ATOM 0 HD2 ARG A 100 10.554 0.865 -3.252 1.00 0.00 H new ATOM 0 HD3 ARG A 100 11.568 0.924 -4.680 1.00 0.00 H new ATOM 0 HE ARG A 100 9.929 -1.041 -5.455 1.00 0.00 H new ATOM 0 HH11 ARG A 100 9.204 2.130 -4.058 1.00 0.00 H new ATOM 0 HH12 ARG A 100 7.517 2.102 -4.583 1.00 0.00 H new ATOM 0 HH21 ARG A 100 7.745 -1.104 -6.051 1.00 0.00 H new ATOM 0 HH22 ARG A 100 6.696 0.276 -5.709 1.00 0.00 H new ATOM 1218 N THR A 101 9.090 -3.371 -0.645 1.00 0.00 N ATOM 1219 CA THR A 101 7.980 -4.226 -0.280 1.00 0.00 C ATOM 1220 C THR A 101 7.051 -3.493 0.698 1.00 0.00 C ATOM 1221 O THR A 101 5.842 -3.453 0.499 1.00 0.00 O ATOM 1222 CB THR A 101 8.481 -5.551 0.345 1.00 0.00 C ATOM 1223 OG1 THR A 101 9.435 -6.161 -0.543 1.00 0.00 O ATOM 1224 CG2 THR A 101 7.330 -6.523 0.564 1.00 0.00 C ATOM 0 H THR A 101 10.006 -3.718 -0.359 1.00 0.00 H new ATOM 0 HA THR A 101 7.423 -4.470 -1.185 1.00 0.00 H new ATOM 0 HB THR A 101 8.939 -5.324 1.308 1.00 0.00 H new ATOM 0 HG1 THR A 101 10.291 -5.688 -0.479 1.00 0.00 H new ATOM 0 HG21 THR A 101 7.711 -7.445 1.004 1.00 0.00 H new ATOM 0 HG22 THR A 101 6.599 -6.075 1.237 1.00 0.00 H new ATOM 0 HG23 THR A 101 6.855 -6.746 -0.392 1.00 0.00 H new ATOM 1232 N ARG A 102 7.644 -2.849 1.705 1.00 0.00 N ATOM 1233 CA ARG A 102 6.874 -2.129 2.711 1.00 0.00 C ATOM 1234 C ARG A 102 6.124 -0.957 2.073 1.00 0.00 C ATOM 1235 O ARG A 102 4.941 -0.741 2.333 1.00 0.00 O ATOM 1236 CB ARG A 102 7.789 -1.591 3.808 1.00 0.00 C ATOM 1237 CG ARG A 102 7.036 -1.002 4.982 1.00 0.00 C ATOM 1238 CD ARG A 102 7.956 -0.259 5.925 1.00 0.00 C ATOM 1239 NE ARG A 102 7.249 0.162 7.136 1.00 0.00 N ATOM 1240 CZ ARG A 102 6.618 1.340 7.316 1.00 0.00 C ATOM 1241 NH1 ARG A 102 6.505 2.218 6.317 1.00 0.00 N ATOM 1242 NH2 ARG A 102 6.064 1.609 8.481 1.00 0.00 N ATOM 0 H ARG A 102 8.654 -2.814 1.842 1.00 0.00 H new ATOM 0 HA ARG A 102 6.160 -2.828 3.146 1.00 0.00 H new ATOM 0 HB2 ARG A 102 8.430 -2.397 4.164 1.00 0.00 H new ATOM 0 HB3 ARG A 102 8.442 -0.828 3.385 1.00 0.00 H new ATOM 0 HG2 ARG A 102 6.266 -0.323 4.616 1.00 0.00 H new ATOM 0 HG3 ARG A 102 6.527 -1.799 5.524 1.00 0.00 H new ATOM 0 HD2 ARG A 102 8.796 -0.898 6.196 1.00 0.00 H new ATOM 0 HD3 ARG A 102 8.369 0.614 5.420 1.00 0.00 H new ATOM 0 HE ARG A 102 7.232 -0.496 7.915 1.00 0.00 H new ATOM 0 HH11 ARG A 102 6.899 2.002 5.401 1.00 0.00 H new ATOM 0 HH12 ARG A 102 6.025 3.105 6.469 1.00 0.00 H new ATOM 0 HH21 ARG A 102 6.114 0.928 9.239 1.00 0.00 H new ATOM 0 HH22 ARG A 102 5.585 2.498 8.625 1.00 0.00 H new ATOM 1256 N LYS A 103 6.823 -0.213 1.237 1.00 0.00 N ATOM 1257 CA LYS A 103 6.253 0.938 0.581 1.00 0.00 C ATOM 1258 C LYS A 103 5.147 0.522 -0.369 1.00 0.00 C ATOM 1259 O LYS A 103 4.137 1.182 -0.451 1.00 0.00 O ATOM 1260 CB LYS A 103 7.323 1.779 -0.134 1.00 0.00 C ATOM 1261 CG LYS A 103 6.828 3.141 -0.627 1.00 0.00 C ATOM 1262 CD LYS A 103 6.269 4.002 0.526 1.00 0.00 C ATOM 1263 CE LYS A 103 7.312 4.302 1.607 1.00 0.00 C ATOM 1264 NZ LYS A 103 6.710 4.967 2.783 1.00 0.00 N ATOM 0 H LYS A 103 7.798 -0.392 0.997 1.00 0.00 H new ATOM 0 HA LYS A 103 5.816 1.573 1.351 1.00 0.00 H new ATOM 0 HB2 LYS A 103 8.161 1.934 0.546 1.00 0.00 H new ATOM 0 HB3 LYS A 103 7.704 1.214 -0.985 1.00 0.00 H new ATOM 0 HG2 LYS A 103 7.648 3.671 -1.112 1.00 0.00 H new ATOM 0 HG3 LYS A 103 6.053 2.995 -1.380 1.00 0.00 H new ATOM 0 HD2 LYS A 103 5.892 4.941 0.121 1.00 0.00 H new ATOM 0 HD3 LYS A 103 5.422 3.487 0.979 1.00 0.00 H new ATOM 0 HE2 LYS A 103 7.789 3.373 1.920 1.00 0.00 H new ATOM 0 HE3 LYS A 103 8.094 4.937 1.191 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 7.420 5.574 3.240 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 5.903 5.548 2.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 6.383 4.248 3.459 1.00 0.00 H new ATOM 1278 N LYS A 104 5.348 -0.588 -1.069 1.00 0.00 N ATOM 1279 CA LYS A 104 4.349 -1.119 -1.988 1.00 0.00 C ATOM 1280 C LYS A 104 3.043 -1.427 -1.244 1.00 0.00 C ATOM 1281 O LYS A 104 1.954 -1.190 -1.769 1.00 0.00 O ATOM 1282 CB LYS A 104 4.886 -2.372 -2.715 1.00 0.00 C ATOM 1283 CG LYS A 104 3.908 -3.036 -3.689 1.00 0.00 C ATOM 1284 CD LYS A 104 3.410 -2.059 -4.744 1.00 0.00 C ATOM 1285 CE LYS A 104 2.489 -2.740 -5.737 1.00 0.00 C ATOM 1286 NZ LYS A 104 1.896 -1.776 -6.683 1.00 0.00 N ATOM 0 H LYS A 104 6.203 -1.142 -1.016 1.00 0.00 H new ATOM 0 HA LYS A 104 4.136 -0.362 -2.742 1.00 0.00 H new ATOM 0 HB2 LYS A 104 5.787 -2.095 -3.263 1.00 0.00 H new ATOM 0 HB3 LYS A 104 5.182 -3.107 -1.966 1.00 0.00 H new ATOM 0 HG2 LYS A 104 4.397 -3.879 -4.177 1.00 0.00 H new ATOM 0 HG3 LYS A 104 3.059 -3.437 -3.135 1.00 0.00 H new ATOM 0 HD2 LYS A 104 2.882 -1.237 -4.261 1.00 0.00 H new ATOM 0 HD3 LYS A 104 4.260 -1.626 -5.271 1.00 0.00 H new ATOM 0 HE2 LYS A 104 3.046 -3.496 -6.290 1.00 0.00 H new ATOM 0 HE3 LYS A 104 1.695 -3.258 -5.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 1.426 -2.291 -7.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 1.199 -1.185 -6.186 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 2.645 -1.171 -7.077 1.00 0.00 H new ATOM 1300 N LEU A 105 3.166 -1.907 -0.012 1.00 0.00 N ATOM 1301 CA LEU A 105 2.006 -2.189 0.829 1.00 0.00 C ATOM 1302 C LEU A 105 1.264 -0.898 1.093 1.00 0.00 C ATOM 1303 O LEU A 105 0.025 -0.829 1.021 1.00 0.00 O ATOM 1304 CB LEU A 105 2.440 -2.767 2.174 1.00 0.00 C ATOM 1305 CG LEU A 105 3.367 -3.963 2.154 1.00 0.00 C ATOM 1306 CD1 LEU A 105 3.610 -4.459 3.564 1.00 0.00 C ATOM 1307 CD2 LEU A 105 2.814 -5.059 1.276 1.00 0.00 C ATOM 0 H LEU A 105 4.063 -2.110 0.430 1.00 0.00 H new ATOM 0 HA LEU A 105 1.372 -2.909 0.312 1.00 0.00 H new ATOM 0 HB2 LEU A 105 2.927 -1.973 2.740 1.00 0.00 H new ATOM 0 HB3 LEU A 105 1.542 -3.046 2.725 1.00 0.00 H new ATOM 0 HG LEU A 105 4.323 -3.655 1.730 1.00 0.00 H new ATOM 0 HD11 LEU A 105 4.278 -5.320 3.537 1.00 0.00 H new ATOM 0 HD12 LEU A 105 4.065 -3.665 4.156 1.00 0.00 H new ATOM 0 HD13 LEU A 105 2.662 -4.750 4.016 1.00 0.00 H new ATOM 0 HD21 LEU A 105 3.498 -5.907 1.278 1.00 0.00 H new ATOM 0 HD22 LEU A 105 1.843 -5.375 1.657 1.00 0.00 H new ATOM 0 HD23 LEU A 105 2.701 -4.687 0.258 1.00 0.00 H new ATOM 1319 N GLU A 106 2.034 0.133 1.369 1.00 0.00 N ATOM 1320 CA GLU A 106 1.502 1.435 1.633 1.00 0.00 C ATOM 1321 C GLU A 106 0.882 2.027 0.385 1.00 0.00 C ATOM 1322 O GLU A 106 -0.122 2.715 0.470 1.00 0.00 O ATOM 1323 CB GLU A 106 2.566 2.376 2.173 1.00 0.00 C ATOM 1324 CG GLU A 106 3.203 1.924 3.466 1.00 0.00 C ATOM 1325 CD GLU A 106 3.934 3.049 4.135 1.00 0.00 C ATOM 1326 OE1 GLU A 106 3.267 3.841 4.859 1.00 0.00 O ATOM 1327 OE2 GLU A 106 5.165 3.187 3.942 1.00 0.00 O ATOM 0 H GLU A 106 3.052 0.082 1.415 1.00 0.00 H new ATOM 0 HA GLU A 106 0.730 1.318 2.394 1.00 0.00 H new ATOM 0 HB2 GLU A 106 3.345 2.493 1.420 1.00 0.00 H new ATOM 0 HB3 GLU A 106 2.120 3.359 2.326 1.00 0.00 H new ATOM 0 HG2 GLU A 106 2.436 1.537 4.136 1.00 0.00 H new ATOM 0 HG3 GLU A 106 3.895 1.106 3.267 1.00 0.00 H new ATOM 1334 N GLU A 107 1.475 1.742 -0.754 1.00 0.00 N ATOM 1335 CA GLU A 107 0.998 2.224 -2.032 1.00 0.00 C ATOM 1336 C GLU A 107 -0.335 1.634 -2.401 1.00 0.00 C ATOM 1337 O GLU A 107 -1.218 2.355 -2.854 1.00 0.00 O ATOM 1338 CB GLU A 107 2.030 2.003 -3.131 1.00 0.00 C ATOM 1339 CG GLU A 107 3.248 2.909 -3.010 1.00 0.00 C ATOM 1340 CD GLU A 107 2.953 4.383 -3.268 1.00 0.00 C ATOM 1341 OE1 GLU A 107 1.847 4.887 -2.941 1.00 0.00 O ATOM 1342 OE2 GLU A 107 3.850 5.093 -3.791 1.00 0.00 O ATOM 0 H GLU A 107 2.312 1.162 -0.819 1.00 0.00 H new ATOM 0 HA GLU A 107 0.849 3.299 -1.929 1.00 0.00 H new ATOM 0 HB2 GLU A 107 2.356 0.963 -3.108 1.00 0.00 H new ATOM 0 HB3 GLU A 107 1.559 2.168 -4.100 1.00 0.00 H new ATOM 0 HG2 GLU A 107 3.669 2.803 -2.010 1.00 0.00 H new ATOM 0 HG3 GLU A 107 4.009 2.573 -3.714 1.00 0.00 H new ATOM 1349 N GLU A 108 -0.507 0.335 -2.188 1.00 0.00 N ATOM 1350 CA GLU A 108 -1.780 -0.286 -2.459 1.00 0.00 C ATOM 1351 C GLU A 108 -2.830 0.271 -1.503 1.00 0.00 C ATOM 1352 O GLU A 108 -3.960 0.562 -1.901 1.00 0.00 O ATOM 1353 CB GLU A 108 -1.672 -1.796 -2.340 1.00 0.00 C ATOM 1354 CG GLU A 108 -0.631 -2.400 -3.262 1.00 0.00 C ATOM 1355 CD GLU A 108 -0.879 -2.082 -4.716 1.00 0.00 C ATOM 1356 OE1 GLU A 108 -1.656 -2.801 -5.378 1.00 0.00 O ATOM 1357 OE2 GLU A 108 -0.279 -1.121 -5.240 1.00 0.00 O ATOM 0 H GLU A 108 0.213 -0.294 -1.833 1.00 0.00 H new ATOM 0 HA GLU A 108 -2.084 -0.059 -3.481 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -1.428 -2.055 -1.310 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -2.643 -2.241 -2.559 1.00 0.00 H new ATOM 0 HG2 GLU A 108 0.355 -2.033 -2.978 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -0.619 -3.482 -3.129 1.00 0.00 H new ATOM 1364 N ARG A 109 -2.422 0.479 -0.247 1.00 0.00 N ATOM 1365 CA ARG A 109 -3.288 1.075 0.766 1.00 0.00 C ATOM 1366 C ARG A 109 -3.694 2.481 0.317 1.00 0.00 C ATOM 1367 O ARG A 109 -4.856 2.829 0.322 1.00 0.00 O ATOM 1368 CB ARG A 109 -2.493 1.188 2.081 1.00 0.00 C ATOM 1369 CG ARG A 109 -3.207 1.890 3.231 1.00 0.00 C ATOM 1370 CD ARG A 109 -2.206 2.312 4.315 1.00 0.00 C ATOM 1371 NE ARG A 109 -1.254 3.358 3.821 1.00 0.00 N ATOM 1372 CZ ARG A 109 -0.011 3.599 4.321 1.00 0.00 C ATOM 1373 NH1 ARG A 109 0.462 2.885 5.323 1.00 0.00 N ATOM 1374 NH2 ARG A 109 0.754 4.572 3.813 1.00 0.00 N ATOM 0 H ARG A 109 -1.490 0.240 0.091 1.00 0.00 H new ATOM 0 HA ARG A 109 -4.177 0.460 0.907 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -2.221 0.184 2.406 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -1.564 1.720 1.877 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -3.736 2.766 2.856 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -3.956 1.225 3.660 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -2.748 2.694 5.180 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -1.645 1.440 4.650 1.00 0.00 H new ATOM 0 HE ARG A 109 -1.564 3.940 3.043 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -0.105 2.142 5.732 1.00 0.00 H new ATOM 0 HH12 ARG A 109 1.395 3.075 5.689 1.00 0.00 H new ATOM 0 HH21 ARG A 109 0.408 5.143 3.042 1.00 0.00 H new ATOM 0 HH22 ARG A 109 1.684 4.743 4.197 1.00 0.00 H new ATOM 1388 N HIS A 110 -2.714 3.227 -0.138 1.00 0.00 N ATOM 1389 CA HIS A 110 -2.854 4.609 -0.586 1.00 0.00 C ATOM 1390 C HIS A 110 -3.757 4.691 -1.816 1.00 0.00 C ATOM 1391 O HIS A 110 -4.639 5.565 -1.905 1.00 0.00 O ATOM 1392 CB HIS A 110 -1.435 5.159 -0.859 1.00 0.00 C ATOM 1393 CG HIS A 110 -1.334 6.508 -1.479 1.00 0.00 C ATOM 1394 ND1 HIS A 110 -0.351 6.844 -2.375 1.00 0.00 N ATOM 1395 CD2 HIS A 110 -2.089 7.617 -1.313 1.00 0.00 C ATOM 1396 CE1 HIS A 110 -0.529 8.112 -2.722 1.00 0.00 C ATOM 1397 NE2 HIS A 110 -1.577 8.635 -2.108 1.00 0.00 N ATOM 0 H HIS A 110 -1.757 2.882 -0.212 1.00 0.00 H new ATOM 0 HA HIS A 110 -3.334 5.219 0.179 1.00 0.00 H new ATOM 0 HB2 HIS A 110 -0.894 5.181 0.087 1.00 0.00 H new ATOM 0 HB3 HIS A 110 -0.917 4.451 -1.506 1.00 0.00 H new ATOM 0 HD1 HIS A 110 0.387 6.227 -2.715 1.00 0.00 H new ATOM 0 HD2 HIS A 110 -2.951 7.699 -0.667 1.00 0.00 H new ATOM 0 HE1 HIS A 110 0.101 8.648 -3.416 1.00 0.00 H new ATOM 1405 N ASN A 111 -3.550 3.774 -2.734 1.00 0.00 N ATOM 1406 CA ASN A 111 -4.349 3.669 -3.940 1.00 0.00 C ATOM 1407 C ASN A 111 -5.811 3.433 -3.577 1.00 0.00 C ATOM 1408 O ASN A 111 -6.717 4.080 -4.129 1.00 0.00 O ATOM 1409 CB ASN A 111 -3.811 2.522 -4.829 1.00 0.00 C ATOM 1410 CG ASN A 111 -4.634 2.272 -6.083 1.00 0.00 C ATOM 1411 OD1 ASN A 111 -5.279 3.175 -6.614 1.00 0.00 O ATOM 1412 ND2 ASN A 111 -4.596 1.059 -6.581 1.00 0.00 N ATOM 0 H ASN A 111 -2.814 3.071 -2.666 1.00 0.00 H new ATOM 0 HA ASN A 111 -4.281 4.601 -4.501 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -2.786 2.752 -5.120 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -3.777 1.605 -4.240 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -5.111 0.841 -7.434 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -4.051 0.333 -6.115 1.00 0.00 H new ATOM 1419 N LEU A 112 -6.032 2.555 -2.617 1.00 0.00 N ATOM 1420 CA LEU A 112 -7.368 2.248 -2.167 1.00 0.00 C ATOM 1421 C LEU A 112 -7.979 3.401 -1.371 1.00 0.00 C ATOM 1422 O LEU A 112 -9.156 3.674 -1.520 1.00 0.00 O ATOM 1423 CB LEU A 112 -7.409 0.963 -1.355 1.00 0.00 C ATOM 1424 CG LEU A 112 -6.918 -0.311 -2.041 1.00 0.00 C ATOM 1425 CD1 LEU A 112 -7.161 -1.502 -1.152 1.00 0.00 C ATOM 1426 CD2 LEU A 112 -7.582 -0.509 -3.386 1.00 0.00 C ATOM 0 H LEU A 112 -5.295 2.041 -2.134 1.00 0.00 H new ATOM 0 HA LEU A 112 -7.970 2.101 -3.063 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -6.814 1.113 -0.454 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -8.437 0.799 -1.033 1.00 0.00 H new ATOM 0 HG LEU A 112 -5.847 -0.209 -2.216 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -6.808 -2.405 -1.649 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -6.623 -1.371 -0.213 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -8.228 -1.593 -0.949 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -7.209 -1.425 -3.845 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -8.661 -0.584 -3.251 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -7.355 0.339 -4.032 1.00 0.00 H new ATOM 1438 N ILE A 113 -7.173 4.076 -0.528 1.00 0.00 N ATOM 1439 CA ILE A 113 -7.664 5.228 0.259 1.00 0.00 C ATOM 1440 C ILE A 113 -8.213 6.289 -0.664 1.00 0.00 C ATOM 1441 O ILE A 113 -9.345 6.723 -0.509 1.00 0.00 O ATOM 1442 CB ILE A 113 -6.552 5.911 1.111 1.00 0.00 C ATOM 1443 CG1 ILE A 113 -5.918 4.951 2.129 1.00 0.00 C ATOM 1444 CG2 ILE A 113 -7.133 7.129 1.831 1.00 0.00 C ATOM 1445 CD1 ILE A 113 -6.847 4.463 3.210 1.00 0.00 C ATOM 0 H ILE A 113 -6.191 3.848 -0.374 1.00 0.00 H new ATOM 0 HA ILE A 113 -8.426 4.823 0.926 1.00 0.00 H new ATOM 0 HB ILE A 113 -5.761 6.221 0.429 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -5.523 4.088 1.594 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -5.070 5.451 2.598 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -6.354 7.605 2.426 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -7.513 7.839 1.096 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -7.946 6.812 2.484 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -6.307 3.792 3.878 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -7.224 5.314 3.777 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -7.683 3.930 2.758 1.00 0.00 H new ATOM 1457 N THR A 114 -7.424 6.635 -1.663 1.00 0.00 N ATOM 1458 CA THR A 114 -7.772 7.679 -2.604 1.00 0.00 C ATOM 1459 C THR A 114 -9.077 7.329 -3.342 1.00 0.00 C ATOM 1460 O THR A 114 -9.953 8.184 -3.536 1.00 0.00 O ATOM 1461 CB THR A 114 -6.610 7.885 -3.603 1.00 0.00 C ATOM 1462 OG1 THR A 114 -5.388 8.080 -2.857 1.00 0.00 O ATOM 1463 CG2 THR A 114 -6.850 9.108 -4.487 1.00 0.00 C ATOM 0 H THR A 114 -6.521 6.198 -1.844 1.00 0.00 H new ATOM 0 HA THR A 114 -7.937 8.610 -2.061 1.00 0.00 H new ATOM 0 HB THR A 114 -6.541 7.006 -4.243 1.00 0.00 H new ATOM 0 HG1 THR A 114 -5.023 7.209 -2.593 1.00 0.00 H new ATOM 0 HG21 THR A 114 -6.016 9.226 -5.179 1.00 0.00 H new ATOM 0 HG22 THR A 114 -7.773 8.974 -5.051 1.00 0.00 H new ATOM 0 HG23 THR A 114 -6.933 9.998 -3.863 1.00 0.00 H new ATOM 1471 N GLU A 115 -9.218 6.063 -3.681 1.00 0.00 N ATOM 1472 CA GLU A 115 -10.389 5.586 -4.363 1.00 0.00 C ATOM 1473 C GLU A 115 -11.594 5.574 -3.419 1.00 0.00 C ATOM 1474 O GLU A 115 -12.641 6.106 -3.750 1.00 0.00 O ATOM 1475 CB GLU A 115 -10.112 4.205 -4.951 1.00 0.00 C ATOM 1476 CG GLU A 115 -11.229 3.645 -5.803 1.00 0.00 C ATOM 1477 CD GLU A 115 -10.755 2.492 -6.631 1.00 0.00 C ATOM 1478 OE1 GLU A 115 -10.061 2.738 -7.643 1.00 0.00 O ATOM 1479 OE2 GLU A 115 -11.049 1.326 -6.312 1.00 0.00 O ATOM 0 H GLU A 115 -8.522 5.343 -3.489 1.00 0.00 H new ATOM 0 HA GLU A 115 -10.632 6.261 -5.184 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -9.205 4.257 -5.553 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -9.913 3.511 -4.135 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -12.051 3.323 -5.163 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -11.620 4.427 -6.454 1.00 0.00 H new ATOM 1486 N MET A 116 -11.401 5.026 -2.219 1.00 0.00 N ATOM 1487 CA MET A 116 -12.464 4.908 -1.215 1.00 0.00 C ATOM 1488 C MET A 116 -12.979 6.302 -0.854 1.00 0.00 C ATOM 1489 O MET A 116 -14.161 6.524 -0.799 1.00 0.00 O ATOM 1490 CB MET A 116 -11.932 4.198 0.044 1.00 0.00 C ATOM 1491 CG MET A 116 -12.970 3.383 0.849 1.00 0.00 C ATOM 1492 SD MET A 116 -14.429 4.293 1.363 1.00 0.00 S ATOM 1493 CE MET A 116 -15.246 3.079 2.389 1.00 0.00 C ATOM 0 H MET A 116 -10.503 4.650 -1.913 1.00 0.00 H new ATOM 0 HA MET A 116 -13.282 4.316 -1.626 1.00 0.00 H new ATOM 0 HB2 MET A 116 -11.125 3.529 -0.254 1.00 0.00 H new ATOM 0 HB3 MET A 116 -11.497 4.948 0.704 1.00 0.00 H new ATOM 0 HG2 MET A 116 -13.287 2.532 0.245 1.00 0.00 H new ATOM 0 HG3 MET A 116 -12.482 2.980 1.736 1.00 0.00 H new ATOM 0 HE1 MET A 116 -16.094 3.541 2.895 1.00 0.00 H new ATOM 0 HE2 MET A 116 -15.599 2.256 1.768 1.00 0.00 H new ATOM 0 HE3 MET A 116 -14.544 2.698 3.131 1.00 0.00 H new ATOM 1503 N VAL A 117 -12.065 7.246 -0.687 1.00 0.00 N ATOM 1504 CA VAL A 117 -12.407 8.631 -0.363 1.00 0.00 C ATOM 1505 C VAL A 117 -13.262 9.272 -1.480 1.00 0.00 C ATOM 1506 O VAL A 117 -14.202 10.022 -1.206 1.00 0.00 O ATOM 1507 CB VAL A 117 -11.108 9.467 -0.082 1.00 0.00 C ATOM 1508 CG1 VAL A 117 -11.371 10.957 -0.032 1.00 0.00 C ATOM 1509 CG2 VAL A 117 -10.492 9.047 1.232 1.00 0.00 C ATOM 0 H VAL A 117 -11.063 7.077 -0.772 1.00 0.00 H new ATOM 0 HA VAL A 117 -13.010 8.631 0.545 1.00 0.00 H new ATOM 0 HB VAL A 117 -10.429 9.268 -0.911 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -10.438 11.485 0.165 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -11.779 11.287 -0.987 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -12.085 11.174 0.762 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -9.592 9.634 1.416 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -11.206 9.215 2.039 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -10.233 7.989 1.191 1.00 0.00 H new ATOM 1519 N ALA A 118 -12.953 8.944 -2.716 1.00 0.00 N ATOM 1520 CA ALA A 118 -13.695 9.458 -3.854 1.00 0.00 C ATOM 1521 C ALA A 118 -15.067 8.788 -3.969 1.00 0.00 C ATOM 1522 O ALA A 118 -16.039 9.395 -4.418 1.00 0.00 O ATOM 1523 CB ALA A 118 -12.901 9.256 -5.130 1.00 0.00 C ATOM 0 H ALA A 118 -12.186 8.318 -2.963 1.00 0.00 H new ATOM 0 HA ALA A 118 -13.855 10.525 -3.700 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -13.467 9.645 -5.976 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -11.951 9.785 -5.055 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -12.713 8.192 -5.277 1.00 0.00 H new ATOM 1529 N LEU A 119 -15.129 7.539 -3.574 1.00 0.00 N ATOM 1530 CA LEU A 119 -16.353 6.760 -3.644 1.00 0.00 C ATOM 1531 C LEU A 119 -17.270 7.058 -2.463 1.00 0.00 C ATOM 1532 O LEU A 119 -18.504 7.116 -2.610 1.00 0.00 O ATOM 1533 CB LEU A 119 -16.018 5.268 -3.644 1.00 0.00 C ATOM 1534 CG LEU A 119 -15.120 4.763 -4.773 1.00 0.00 C ATOM 1535 CD1 LEU A 119 -14.763 3.316 -4.553 1.00 0.00 C ATOM 1536 CD2 LEU A 119 -15.781 4.943 -6.122 1.00 0.00 C ATOM 0 H LEU A 119 -14.333 7.028 -3.193 1.00 0.00 H new ATOM 0 HA LEU A 119 -16.868 7.033 -4.565 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -15.538 5.028 -2.695 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -16.954 4.710 -3.679 1.00 0.00 H new ATOM 0 HG LEU A 119 -14.206 5.356 -4.765 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -14.123 2.971 -5.366 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -14.234 3.212 -3.606 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -15.673 2.716 -4.529 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -15.118 4.574 -6.904 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -16.716 4.384 -6.146 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -15.986 6.001 -6.289 1.00 0.00 H new ATOM 1548 N ASN A 120 -16.679 7.260 -1.317 1.00 0.00 N ATOM 1549 CA ASN A 120 -17.420 7.405 -0.087 1.00 0.00 C ATOM 1550 C ASN A 120 -16.888 8.591 0.732 1.00 0.00 C ATOM 1551 O ASN A 120 -15.724 8.610 1.135 1.00 0.00 O ATOM 1552 CB ASN A 120 -17.245 6.129 0.734 1.00 0.00 C ATOM 1553 CG ASN A 120 -18.215 5.977 1.877 1.00 0.00 C ATOM 1554 OD1 ASN A 120 -18.723 6.941 2.421 1.00 0.00 O ATOM 1555 ND2 ASN A 120 -18.476 4.763 2.248 1.00 0.00 N ATOM 0 H ASN A 120 -15.667 7.329 -1.206 1.00 0.00 H new ATOM 0 HA ASN A 120 -18.470 7.582 -0.322 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -17.348 5.270 0.071 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -16.230 6.105 1.131 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -19.124 4.593 3.017 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -18.033 3.978 1.771 1.00 0.00 H new ATOM 1562 N PRO A 121 -17.735 9.588 0.988 1.00 0.00 N ATOM 1563 CA PRO A 121 -17.385 10.761 1.818 1.00 0.00 C ATOM 1564 C PRO A 121 -17.434 10.460 3.333 1.00 0.00 C ATOM 1565 O PRO A 121 -16.926 11.221 4.159 1.00 0.00 O ATOM 1566 CB PRO A 121 -18.463 11.760 1.440 1.00 0.00 C ATOM 1567 CG PRO A 121 -19.644 10.912 1.128 1.00 0.00 C ATOM 1568 CD PRO A 121 -19.109 9.697 0.444 1.00 0.00 C ATOM 0 HA PRO A 121 -16.366 11.104 1.641 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -18.672 12.451 2.257 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -18.166 12.362 0.582 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -20.182 10.643 2.037 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -20.347 11.443 0.487 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -19.704 8.812 0.669 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -19.106 9.812 -0.640 1.00 0.00 H new ATOM 1576 N ASP A 122 -18.043 9.343 3.668 1.00 0.00 N ATOM 1577 CA ASP A 122 -18.234 8.891 5.050 1.00 0.00 C ATOM 1578 C ASP A 122 -17.063 7.996 5.466 1.00 0.00 C ATOM 1579 O ASP A 122 -17.060 7.377 6.524 1.00 0.00 O ATOM 1580 CB ASP A 122 -19.595 8.142 5.160 1.00 0.00 C ATOM 1581 CG ASP A 122 -19.913 7.553 6.526 1.00 0.00 C ATOM 1582 OD1 ASP A 122 -20.385 8.291 7.427 1.00 0.00 O ATOM 1583 OD2 ASP A 122 -19.731 6.328 6.720 1.00 0.00 O ATOM 0 H ASP A 122 -18.432 8.701 2.978 1.00 0.00 H new ATOM 0 HA ASP A 122 -18.258 9.745 5.727 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -20.393 8.833 4.888 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -19.606 7.337 4.425 1.00 0.00 H new ATOM 1588 N PHE A 123 -16.059 7.950 4.631 1.00 0.00 N ATOM 1589 CA PHE A 123 -14.925 7.111 4.862 1.00 0.00 C ATOM 1590 C PHE A 123 -13.996 7.685 5.936 1.00 0.00 C ATOM 1591 O PHE A 123 -13.649 8.866 5.910 1.00 0.00 O ATOM 1592 CB PHE A 123 -14.171 6.890 3.553 1.00 0.00 C ATOM 1593 CG PHE A 123 -12.910 6.081 3.680 1.00 0.00 C ATOM 1594 CD1 PHE A 123 -12.859 4.968 4.492 1.00 0.00 C ATOM 1595 CD2 PHE A 123 -11.792 6.433 2.979 1.00 0.00 C ATOM 1596 CE1 PHE A 123 -11.723 4.229 4.609 1.00 0.00 C ATOM 1597 CE2 PHE A 123 -10.638 5.704 3.075 1.00 0.00 C ATOM 1598 CZ PHE A 123 -10.596 4.591 3.898 1.00 0.00 C ATOM 0 H PHE A 123 -16.009 8.496 3.771 1.00 0.00 H new ATOM 0 HA PHE A 123 -15.285 6.152 5.235 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -14.836 6.392 2.847 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -13.921 7.861 3.126 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -13.739 4.677 5.046 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -11.819 7.302 2.338 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -11.703 3.364 5.255 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -9.764 5.995 2.512 1.00 0.00 H new ATOM 0 HZ PHE A 123 -9.689 4.011 3.983 1.00 0.00 H new ATOM 1608 N LYS A 124 -13.628 6.839 6.878 1.00 0.00 N ATOM 1609 CA LYS A 124 -12.663 7.180 7.898 1.00 0.00 C ATOM 1610 C LYS A 124 -11.388 6.431 7.585 1.00 0.00 C ATOM 1611 O LYS A 124 -11.345 5.199 7.745 1.00 0.00 O ATOM 1612 CB LYS A 124 -13.123 6.794 9.335 1.00 0.00 C ATOM 1613 CG LYS A 124 -14.340 7.544 9.882 1.00 0.00 C ATOM 1614 CD LYS A 124 -15.619 7.203 9.146 1.00 0.00 C ATOM 1615 CE LYS A 124 -16.120 5.792 9.432 1.00 0.00 C ATOM 1616 NZ LYS A 124 -17.377 5.526 8.705 1.00 0.00 N ATOM 0 H LYS A 124 -13.994 5.890 6.955 1.00 0.00 H new ATOM 0 HA LYS A 124 -12.531 8.262 7.887 1.00 0.00 H new ATOM 0 HB2 LYS A 124 -13.344 5.727 9.348 1.00 0.00 H new ATOM 0 HB3 LYS A 124 -12.288 6.955 10.016 1.00 0.00 H new ATOM 0 HG2 LYS A 124 -14.461 7.309 10.939 1.00 0.00 H new ATOM 0 HG3 LYS A 124 -14.161 8.617 9.813 1.00 0.00 H new ATOM 0 HD2 LYS A 124 -16.392 7.919 9.424 1.00 0.00 H new ATOM 0 HD3 LYS A 124 -15.454 7.312 8.074 1.00 0.00 H new ATOM 0 HE2 LYS A 124 -15.363 5.065 9.137 1.00 0.00 H new ATOM 0 HE3 LYS A 124 -16.281 5.668 10.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 -17.401 4.530 8.407 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 -18.186 5.721 9.328 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 -17.430 6.140 7.867 1.00 0.00 H new ATOM 1630 N PRO A 125 -10.363 7.113 7.086 1.00 0.00 N ATOM 1631 CA PRO A 125 -9.110 6.475 6.783 1.00 0.00 C ATOM 1632 C PRO A 125 -8.385 6.078 8.066 1.00 0.00 C ATOM 1633 O PRO A 125 -8.488 6.775 9.085 1.00 0.00 O ATOM 1634 CB PRO A 125 -8.299 7.519 6.005 1.00 0.00 C ATOM 1635 CG PRO A 125 -9.101 8.781 6.003 1.00 0.00 C ATOM 1636 CD PRO A 125 -10.355 8.552 6.798 1.00 0.00 C ATOM 0 HA PRO A 125 -9.250 5.560 6.207 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -7.328 7.680 6.473 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -8.110 7.180 4.986 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -8.523 9.598 6.435 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -9.348 9.071 4.982 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -10.353 9.139 7.717 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -11.240 8.847 6.234 1.00 0.00 H new ATOM 1644 N PRO A 126 -7.679 4.943 8.057 1.00 0.00 N ATOM 1645 CA PRO A 126 -6.949 4.471 9.222 1.00 0.00 C ATOM 1646 C PRO A 126 -5.811 5.418 9.601 1.00 0.00 C ATOM 1647 O PRO A 126 -5.270 6.144 8.745 1.00 0.00 O ATOM 1648 CB PRO A 126 -6.387 3.110 8.779 1.00 0.00 C ATOM 1649 CG PRO A 126 -6.362 3.184 7.296 1.00 0.00 C ATOM 1650 CD PRO A 126 -7.547 4.021 6.916 1.00 0.00 C ATOM 0 HA PRO A 126 -7.586 4.409 10.104 1.00 0.00 H new ATOM 0 HB2 PRO A 126 -5.390 2.941 9.185 1.00 0.00 H new ATOM 0 HB3 PRO A 126 -7.015 2.289 9.125 1.00 0.00 H new ATOM 0 HG2 PRO A 126 -5.434 3.633 6.941 1.00 0.00 H new ATOM 0 HG3 PRO A 126 -6.425 2.190 6.852 1.00 0.00 H new ATOM 0 HD2 PRO A 126 -7.380 4.556 5.981 1.00 0.00 H new ATOM 0 HD3 PRO A 126 -8.443 3.415 6.781 1.00 0.00 H new ATOM 1658 N ALA A 127 -5.436 5.401 10.867 1.00 0.00 N ATOM 1659 CA ALA A 127 -4.343 6.232 11.377 1.00 0.00 C ATOM 1660 C ALA A 127 -3.004 5.761 10.805 1.00 0.00 C ATOM 1661 O ALA A 127 -1.990 6.482 10.832 1.00 0.00 O ATOM 1662 CB ALA A 127 -4.320 6.191 12.897 1.00 0.00 C ATOM 0 H ALA A 127 -5.875 4.814 11.576 1.00 0.00 H new ATOM 0 HA ALA A 127 -4.507 7.262 11.060 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -3.504 6.812 13.265 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -5.266 6.568 13.285 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -4.174 5.164 13.231 1.00 0.00 H new ATOM 1668 N ASP A 128 -3.027 4.571 10.235 1.00 0.00 N ATOM 1669 CA ASP A 128 -1.858 3.954 9.636 1.00 0.00 C ATOM 1670 C ASP A 128 -1.637 4.510 8.260 1.00 0.00 C ATOM 1671 O ASP A 128 -0.561 4.376 7.697 1.00 0.00 O ATOM 1672 CB ASP A 128 -2.063 2.449 9.496 1.00 0.00 C ATOM 1673 CG ASP A 128 -2.235 1.723 10.795 1.00 0.00 C ATOM 1674 OD1 ASP A 128 -3.310 1.822 11.409 1.00 0.00 O ATOM 1675 OD2 ASP A 128 -1.314 1.001 11.210 1.00 0.00 O ATOM 0 H ASP A 128 -3.869 3.998 10.174 1.00 0.00 H new ATOM 0 HA ASP A 128 -1.003 4.160 10.279 1.00 0.00 H new ATOM 0 HB2 ASP A 128 -2.941 2.271 8.875 1.00 0.00 H new ATOM 0 HB3 ASP A 128 -1.208 2.026 8.968 1.00 0.00 H new ATOM 1680 N TYR A 129 -2.645 5.163 7.721 1.00 0.00 N ATOM 1681 CA TYR A 129 -2.524 5.754 6.424 1.00 0.00 C ATOM 1682 C TYR A 129 -1.725 7.004 6.507 1.00 0.00 C ATOM 1683 O TYR A 129 -2.032 7.905 7.282 1.00 0.00 O ATOM 1684 CB TYR A 129 -3.891 6.015 5.763 1.00 0.00 C ATOM 1685 CG TYR A 129 -3.841 6.893 4.502 1.00 0.00 C ATOM 1686 CD1 TYR A 129 -2.915 6.664 3.474 1.00 0.00 C ATOM 1687 CD2 TYR A 129 -4.721 7.958 4.352 1.00 0.00 C ATOM 1688 CE1 TYR A 129 -2.883 7.471 2.349 1.00 0.00 C ATOM 1689 CE2 TYR A 129 -4.691 8.765 3.226 1.00 0.00 C ATOM 1690 CZ TYR A 129 -3.772 8.514 2.232 1.00 0.00 C ATOM 1691 OH TYR A 129 -3.738 9.312 1.117 1.00 0.00 O ATOM 0 H TYR A 129 -3.553 5.293 8.168 1.00 0.00 H new ATOM 0 HA TYR A 129 -2.005 5.039 5.786 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -4.342 5.057 5.504 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -4.547 6.489 6.493 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -2.216 5.845 3.561 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -5.443 8.161 5.129 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -2.163 7.282 1.567 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -5.385 9.587 3.129 1.00 0.00 H new ATOM 0 HH TYR A 129 -4.430 10.002 1.187 1.00 0.00 H new ATOM 1701 N LYS A 130 -0.678 7.024 5.767 1.00 0.00 N ATOM 1702 CA LYS A 130 0.131 8.173 5.649 1.00 0.00 C ATOM 1703 C LYS A 130 0.080 8.628 4.214 1.00 0.00 C ATOM 1704 O LYS A 130 0.300 7.805 3.304 1.00 0.00 O ATOM 1705 CB LYS A 130 1.566 7.853 6.037 1.00 0.00 C ATOM 1706 CG LYS A 130 1.738 7.350 7.464 1.00 0.00 C ATOM 1707 CD LYS A 130 1.240 8.364 8.493 1.00 0.00 C ATOM 1708 CE LYS A 130 1.464 7.873 9.915 1.00 0.00 C ATOM 1709 NZ LYS A 130 0.754 6.603 10.195 1.00 0.00 N ATOM 0 H LYS A 130 -0.356 6.227 5.218 1.00 0.00 H new ATOM 0 HA LYS A 130 -0.233 8.956 6.314 1.00 0.00 H new ATOM 0 HB2 LYS A 130 1.955 7.101 5.351 1.00 0.00 H new ATOM 0 HB3 LYS A 130 2.173 8.749 5.906 1.00 0.00 H new ATOM 0 HG2 LYS A 130 1.194 6.413 7.586 1.00 0.00 H new ATOM 0 HG3 LYS A 130 2.790 7.134 7.648 1.00 0.00 H new ATOM 0 HD2 LYS A 130 1.757 9.313 8.349 1.00 0.00 H new ATOM 0 HD3 LYS A 130 0.178 8.552 8.335 1.00 0.00 H new ATOM 0 HE2 LYS A 130 2.532 7.733 10.084 1.00 0.00 H new ATOM 0 HE3 LYS A 130 1.127 8.636 10.617 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 0.939 6.311 11.176 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -0.268 6.740 10.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 1.093 5.865 9.545 1.00 0.00 H new ATOM 1723 N PRO A 131 -0.301 9.896 3.971 1.00 0.00 N ATOM 1724 CA PRO A 131 -0.276 10.473 2.635 1.00 0.00 C ATOM 1725 C PRO A 131 1.160 10.496 2.112 1.00 0.00 C ATOM 1726 O PRO A 131 2.115 10.548 2.910 1.00 0.00 O ATOM 1727 CB PRO A 131 -0.820 11.904 2.828 1.00 0.00 C ATOM 1728 CG PRO A 131 -0.701 12.178 4.287 1.00 0.00 C ATOM 1729 CD PRO A 131 -0.802 10.854 4.979 1.00 0.00 C ATOM 0 HA PRO A 131 -0.864 9.909 1.911 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -0.247 12.624 2.245 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -1.856 11.979 2.497 1.00 0.00 H new ATOM 0 HG2 PRO A 131 0.248 12.663 4.514 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -1.491 12.851 4.621 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -0.201 10.830 5.888 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -1.829 10.630 5.269 1.00 0.00 H new ATOM 1737 N PRO A 132 1.342 10.465 0.796 1.00 0.00 N ATOM 1738 CA PRO A 132 2.662 10.350 0.200 1.00 0.00 C ATOM 1739 C PRO A 132 3.544 11.542 0.506 1.00 0.00 C ATOM 1740 O PRO A 132 3.111 12.693 0.444 1.00 0.00 O ATOM 1741 CB PRO A 132 2.376 10.283 -1.303 1.00 0.00 C ATOM 1742 CG PRO A 132 1.035 10.902 -1.463 1.00 0.00 C ATOM 1743 CD PRO A 132 0.286 10.573 -0.215 1.00 0.00 C ATOM 0 HA PRO A 132 3.201 9.486 0.588 1.00 0.00 H new ATOM 0 HB2 PRO A 132 3.131 10.823 -1.874 1.00 0.00 H new ATOM 0 HB3 PRO A 132 2.382 9.254 -1.661 1.00 0.00 H new ATOM 0 HG2 PRO A 132 1.115 11.981 -1.598 1.00 0.00 H new ATOM 0 HG3 PRO A 132 0.524 10.508 -2.341 1.00 0.00 H new ATOM 0 HD2 PRO A 132 -0.435 11.351 0.038 1.00 0.00 H new ATOM 0 HD3 PRO A 132 -0.272 9.642 -0.315 1.00 0.00 H new ATOM 1751 N ALA A 133 4.771 11.262 0.817 1.00 0.00 N ATOM 1752 CA ALA A 133 5.748 12.288 1.084 1.00 0.00 C ATOM 1753 C ALA A 133 6.583 12.489 -0.154 1.00 0.00 C ATOM 1754 O ALA A 133 7.342 13.455 -0.283 1.00 0.00 O ATOM 1755 CB ALA A 133 6.614 11.881 2.256 1.00 0.00 C ATOM 0 H ALA A 133 5.132 10.311 0.895 1.00 0.00 H new ATOM 0 HA ALA A 133 5.252 13.224 1.341 1.00 0.00 H new ATOM 0 HB1 ALA A 133 7.350 12.661 2.453 1.00 0.00 H new ATOM 0 HB2 ALA A 133 5.990 11.741 3.138 1.00 0.00 H new ATOM 0 HB3 ALA A 133 7.127 10.948 2.023 1.00 0.00 H new