USER MOD reduce.3.24.130724 H: found=0, std=0, add=870, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 872 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 25 SER OG : rot -10:sc= -1.48! USER MOD Set 1.2: B 43 THR OG1 : rot 115:sc= -0.808 USER MOD Set 2.1: A 27 SER OG : rot 180:sc= 0.832 USER MOD Set 2.2: B 27 SER OG : rot 60:sc= 0.812 USER MOD Set 3.1: A 25 SER OG : rot -11:sc= -1.5! USER MOD Set 3.2: A 43 THR OG1 : rot 116:sc= -0.847 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 ASN : amide:sc= -4.96! C(o=-5!,f=-9.9!) USER MOD Single : A 24 GLN : amide:sc= -0.0558 X(o=-0.056,f=0) USER MOD Single : A 29 THR OG1 : rot 180:sc=-0.00708 USER MOD Single : A 38 THR OG1 : rot 22:sc= 0.891 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 GLN : amide:sc= -0.706 K(o=-0.71,f=-0.0097) USER MOD Single : A 49 LYS NZ :NH3+ -118:sc= -0.0451 (180deg=-0.0496) USER MOD Single : A 51 CYS SG : rot -134:sc= 1.19 USER MOD Single : A 60 GLN : amide:sc= -10.4! C(o=-10!,f=-16!) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 ASN : amide:sc= 0.342 X(o=0.34,f=0) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 14 THR OG1 : rot 180:sc= 0 USER MOD Single : B 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 22 ASN : amide:sc= -4.9! C(o=-4.9!,f=-10!) USER MOD Single : B 24 GLN : amide:sc= -0.0609 X(o=-0.061,f=0) USER MOD Single : B 29 THR OG1 : rot 180:sc=-0.00638 USER MOD Single : B 38 THR OG1 : rot -13:sc= 0.825 USER MOD Single : B 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 48 GLN : amide:sc= -0.738 K(o=-0.74,f=0) USER MOD Single : B 49 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0511) USER MOD Single : B 51 CYS SG : rot -120:sc= 1.21 USER MOD Single : B 60 GLN : amide:sc= -10.7! C(o=-11!,f=-16!) USER MOD Single : B 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 64 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 68 ASN : amide:sc= 0.304 X(o=0.3,f=0) USER MOD Single : B 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 177 N LYS A 13 15.934 -5.702 3.543 1.00 0.00 N ATOM 178 CA LYS A 13 15.611 -6.220 2.187 1.00 0.00 C ATOM 179 C LYS A 13 14.095 -6.201 1.969 1.00 0.00 C ATOM 180 O LYS A 13 13.340 -5.814 2.840 1.00 0.00 O ATOM 181 CB LYS A 13 16.131 -7.657 2.178 1.00 0.00 C ATOM 182 CG LYS A 13 15.930 -8.295 3.556 1.00 0.00 C ATOM 183 CD LYS A 13 15.632 -9.787 3.389 1.00 0.00 C ATOM 184 CE LYS A 13 16.775 -10.455 2.622 1.00 0.00 C ATOM 185 NZ LYS A 13 16.106 -11.354 1.640 1.00 0.00 N ATOM 0 HA LYS A 13 16.059 -5.619 1.395 1.00 0.00 H new ATOM 0 HB2 LYS A 13 15.606 -8.238 1.419 1.00 0.00 H new ATOM 0 HB3 LYS A 13 17.188 -7.668 1.914 1.00 0.00 H new ATOM 0 HG2 LYS A 13 16.823 -8.158 4.166 1.00 0.00 H new ATOM 0 HG3 LYS A 13 15.108 -7.805 4.079 1.00 0.00 H new ATOM 0 HD2 LYS A 13 15.513 -10.256 4.366 1.00 0.00 H new ATOM 0 HD3 LYS A 13 14.693 -9.923 2.853 1.00 0.00 H new ATOM 0 HE2 LYS A 13 17.398 -9.715 2.119 1.00 0.00 H new ATOM 0 HE3 LYS A 13 17.425 -11.017 3.293 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 16.826 -11.848 1.075 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 15.525 -12.052 2.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 15.499 -10.791 1.011 1.00 0.00 H new ATOM 199 N THR A 14 13.645 -6.617 0.819 1.00 0.00 N ATOM 200 CA THR A 14 12.182 -6.625 0.550 1.00 0.00 C ATOM 201 C THR A 14 11.837 -7.737 -0.441 1.00 0.00 C ATOM 202 O THR A 14 12.680 -8.201 -1.184 1.00 0.00 O ATOM 203 CB THR A 14 11.886 -5.260 -0.060 1.00 0.00 C ATOM 204 OG1 THR A 14 13.091 -4.689 -0.550 1.00 0.00 O ATOM 205 CG2 THR A 14 11.276 -4.344 1.001 1.00 0.00 C ATOM 0 H THR A 14 14.229 -6.952 0.053 1.00 0.00 H new ATOM 0 HA THR A 14 11.596 -6.805 1.451 1.00 0.00 H new ATOM 0 HB THR A 14 11.180 -5.376 -0.882 1.00 0.00 H new ATOM 0 HG1 THR A 14 12.901 -3.812 -0.944 1.00 0.00 H new ATOM 0 HG21 THR A 14 11.065 -3.369 0.562 1.00 0.00 H new ATOM 0 HG22 THR A 14 10.350 -4.783 1.372 1.00 0.00 H new ATOM 0 HG23 THR A 14 11.977 -4.226 1.827 1.00 0.00 H new ATOM 213 N LEU A 15 10.609 -8.169 -0.460 1.00 0.00 N ATOM 214 CA LEU A 15 10.218 -9.250 -1.403 1.00 0.00 C ATOM 215 C LEU A 15 9.506 -8.662 -2.617 1.00 0.00 C ATOM 216 O LEU A 15 8.790 -7.686 -2.512 1.00 0.00 O ATOM 217 CB LEU A 15 9.263 -10.133 -0.610 1.00 0.00 C ATOM 218 CG LEU A 15 10.023 -10.793 0.537 1.00 0.00 C ATOM 219 CD1 LEU A 15 9.460 -10.308 1.873 1.00 0.00 C ATOM 220 CD2 LEU A 15 9.871 -12.310 0.438 1.00 0.00 C ATOM 0 H LEU A 15 9.859 -7.820 0.137 1.00 0.00 H new ATOM 0 HA LEU A 15 11.080 -9.803 -1.775 1.00 0.00 H new ATOM 0 HB2 LEU A 15 8.438 -9.537 -0.220 1.00 0.00 H new ATOM 0 HB3 LEU A 15 8.828 -10.893 -1.259 1.00 0.00 H new ATOM 0 HG LEU A 15 11.078 -10.527 0.474 1.00 0.00 H new ATOM 0 HD11 LEU A 15 10.004 -10.781 2.690 1.00 0.00 H new ATOM 0 HD12 LEU A 15 9.569 -9.226 1.942 1.00 0.00 H new ATOM 0 HD13 LEU A 15 8.404 -10.571 1.940 1.00 0.00 H new ATOM 0 HD21 LEU A 15 10.413 -12.784 1.256 1.00 0.00 H new ATOM 0 HD22 LEU A 15 8.815 -12.575 0.500 1.00 0.00 H new ATOM 0 HD23 LEU A 15 10.276 -12.655 -0.513 1.00 0.00 H new ATOM 232 N PRO A 16 9.723 -9.291 -3.735 1.00 0.00 N ATOM 233 CA PRO A 16 9.094 -8.845 -4.990 1.00 0.00 C ATOM 234 C PRO A 16 7.679 -9.412 -5.080 1.00 0.00 C ATOM 235 O PRO A 16 6.893 -9.023 -5.917 1.00 0.00 O ATOM 236 CB PRO A 16 9.990 -9.451 -6.064 1.00 0.00 C ATOM 237 CG PRO A 16 10.633 -10.645 -5.428 1.00 0.00 C ATOM 238 CD PRO A 16 10.571 -10.467 -3.930 1.00 0.00 C ATOM 0 HA PRO A 16 9.005 -7.762 -5.079 1.00 0.00 H new ATOM 0 HB2 PRO A 16 9.410 -9.739 -6.941 1.00 0.00 H new ATOM 0 HB3 PRO A 16 10.740 -8.734 -6.399 1.00 0.00 H new ATOM 0 HG2 PRO A 16 10.118 -11.558 -5.725 1.00 0.00 H new ATOM 0 HG3 PRO A 16 11.667 -10.741 -5.758 1.00 0.00 H new ATOM 0 HD2 PRO A 16 10.149 -11.346 -3.443 1.00 0.00 H new ATOM 0 HD3 PRO A 16 11.564 -10.315 -3.507 1.00 0.00 H new ATOM 246 N ARG A 17 7.355 -10.342 -4.222 1.00 0.00 N ATOM 247 CA ARG A 17 5.999 -10.954 -4.259 1.00 0.00 C ATOM 248 C ARG A 17 5.814 -11.871 -3.046 1.00 0.00 C ATOM 249 O ARG A 17 5.784 -13.080 -3.167 1.00 0.00 O ATOM 250 CB ARG A 17 5.992 -11.764 -5.555 1.00 0.00 C ATOM 251 CG ARG A 17 4.750 -12.653 -5.599 1.00 0.00 C ATOM 252 CD ARG A 17 5.093 -13.979 -6.282 1.00 0.00 C ATOM 253 NE ARG A 17 5.179 -14.971 -5.175 1.00 0.00 N ATOM 254 CZ ARG A 17 5.838 -16.085 -5.345 1.00 0.00 C ATOM 255 NH1 ARG A 17 6.292 -16.401 -6.528 1.00 0.00 N ATOM 256 NH2 ARG A 17 6.043 -16.882 -4.333 1.00 0.00 N ATOM 0 H ARG A 17 7.974 -10.704 -3.496 1.00 0.00 H new ATOM 0 HA ARG A 17 5.194 -10.219 -4.227 1.00 0.00 H new ATOM 0 HB2 ARG A 17 6.002 -11.094 -6.414 1.00 0.00 H new ATOM 0 HB3 ARG A 17 6.892 -12.376 -5.618 1.00 0.00 H new ATOM 0 HG2 ARG A 17 4.385 -12.836 -4.588 1.00 0.00 H new ATOM 0 HG3 ARG A 17 3.949 -12.150 -6.140 1.00 0.00 H new ATOM 0 HD2 ARG A 17 4.328 -14.260 -7.005 1.00 0.00 H new ATOM 0 HD3 ARG A 17 6.035 -13.911 -6.825 1.00 0.00 H new ATOM 0 HE ARG A 17 4.723 -14.780 -4.283 1.00 0.00 H new ATOM 0 HH11 ARG A 17 6.132 -15.777 -7.319 1.00 0.00 H new ATOM 0 HH12 ARG A 17 6.807 -17.271 -6.661 1.00 0.00 H new ATOM 0 HH21 ARG A 17 5.688 -16.635 -3.409 1.00 0.00 H new ATOM 0 HH22 ARG A 17 6.558 -17.752 -4.466 1.00 0.00 H new ATOM 270 N VAL A 18 5.686 -11.305 -1.878 1.00 0.00 N ATOM 271 CA VAL A 18 5.492 -12.147 -0.657 1.00 0.00 C ATOM 272 C VAL A 18 4.418 -13.196 -0.930 1.00 0.00 C ATOM 273 O VAL A 18 3.861 -13.239 -2.005 1.00 0.00 O ATOM 274 CB VAL A 18 5.028 -11.172 0.424 1.00 0.00 C ATOM 275 CG1 VAL A 18 5.012 -11.880 1.776 1.00 0.00 C ATOM 276 CG2 VAL A 18 5.990 -9.984 0.489 1.00 0.00 C ATOM 0 H VAL A 18 5.707 -10.299 -1.713 1.00 0.00 H new ATOM 0 HA VAL A 18 6.397 -12.677 -0.360 1.00 0.00 H new ATOM 0 HB VAL A 18 4.025 -10.818 0.184 1.00 0.00 H new ATOM 0 HG11 VAL A 18 4.681 -11.184 2.547 1.00 0.00 H new ATOM 0 HG12 VAL A 18 4.328 -12.728 1.735 1.00 0.00 H new ATOM 0 HG13 VAL A 18 6.015 -12.234 2.013 1.00 0.00 H new ATOM 0 HG21 VAL A 18 5.658 -9.289 1.260 1.00 0.00 H new ATOM 0 HG22 VAL A 18 6.992 -10.340 0.728 1.00 0.00 H new ATOM 0 HG23 VAL A 18 6.006 -9.476 -0.475 1.00 0.00 H new ATOM 286 N ASP A 19 4.110 -14.033 0.028 1.00 0.00 N ATOM 287 CA ASP A 19 3.052 -15.051 -0.203 1.00 0.00 C ATOM 288 C ASP A 19 1.844 -14.337 -0.808 1.00 0.00 C ATOM 289 O ASP A 19 0.819 -14.153 -0.181 1.00 0.00 O ATOM 290 CB ASP A 19 2.747 -15.602 1.185 1.00 0.00 C ATOM 291 CG ASP A 19 1.827 -16.816 1.068 1.00 0.00 C ATOM 292 OD1 ASP A 19 1.297 -17.032 -0.010 1.00 0.00 O ATOM 293 OD2 ASP A 19 1.666 -17.510 2.058 1.00 0.00 O ATOM 0 H ASP A 19 4.543 -14.053 0.951 1.00 0.00 H new ATOM 0 HA ASP A 19 3.335 -15.854 -0.884 1.00 0.00 H new ATOM 0 HB2 ASP A 19 3.673 -15.883 1.687 1.00 0.00 H new ATOM 0 HB3 ASP A 19 2.274 -14.833 1.796 1.00 0.00 H new ATOM 298 N PHE A 20 2.005 -13.894 -2.017 1.00 0.00 N ATOM 299 CA PHE A 20 0.944 -13.130 -2.719 1.00 0.00 C ATOM 300 C PHE A 20 -0.462 -13.598 -2.371 1.00 0.00 C ATOM 301 O PHE A 20 -1.178 -12.941 -1.644 1.00 0.00 O ATOM 302 CB PHE A 20 1.229 -13.351 -4.197 1.00 0.00 C ATOM 303 CG PHE A 20 1.125 -12.028 -4.884 1.00 0.00 C ATOM 304 CD1 PHE A 20 2.233 -11.178 -4.929 1.00 0.00 C ATOM 305 CD2 PHE A 20 -0.086 -11.639 -5.451 1.00 0.00 C ATOM 306 CE1 PHE A 20 2.127 -9.933 -5.545 1.00 0.00 C ATOM 307 CE2 PHE A 20 -0.196 -10.399 -6.070 1.00 0.00 C ATOM 308 CZ PHE A 20 0.915 -9.540 -6.117 1.00 0.00 C ATOM 0 H PHE A 20 2.854 -14.034 -2.565 1.00 0.00 H new ATOM 0 HA PHE A 20 0.967 -12.080 -2.426 1.00 0.00 H new ATOM 0 HB2 PHE A 20 2.223 -13.776 -4.335 1.00 0.00 H new ATOM 0 HB3 PHE A 20 0.518 -14.059 -4.622 1.00 0.00 H new ATOM 0 HD1 PHE A 20 3.169 -11.485 -4.487 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -0.939 -12.300 -5.410 1.00 0.00 H new ATOM 0 HE1 PHE A 20 2.981 -9.273 -5.580 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -1.133 -10.097 -6.514 1.00 0.00 H new ATOM 0 HZ PHE A 20 0.832 -8.575 -6.596 1.00 0.00 H new ATOM 318 N LYS A 21 -0.880 -14.698 -2.907 1.00 0.00 N ATOM 319 CA LYS A 21 -2.260 -15.164 -2.625 1.00 0.00 C ATOM 320 C LYS A 21 -2.601 -14.942 -1.147 1.00 0.00 C ATOM 321 O LYS A 21 -3.752 -14.811 -0.777 1.00 0.00 O ATOM 322 CB LYS A 21 -2.261 -16.654 -2.965 1.00 0.00 C ATOM 323 CG LYS A 21 -1.812 -16.847 -4.415 1.00 0.00 C ATOM 324 CD LYS A 21 -2.298 -18.207 -4.922 1.00 0.00 C ATOM 325 CE LYS A 21 -3.260 -17.999 -6.093 1.00 0.00 C ATOM 326 NZ LYS A 21 -2.508 -18.454 -7.295 1.00 0.00 N ATOM 0 H LYS A 21 -0.332 -15.295 -3.526 1.00 0.00 H new ATOM 0 HA LYS A 21 -3.005 -14.620 -3.206 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -1.593 -17.192 -2.292 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -3.259 -17.069 -2.824 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -2.213 -16.049 -5.040 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -0.726 -16.789 -4.481 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -1.450 -18.814 -5.238 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -2.797 -18.750 -4.119 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -4.176 -18.575 -5.959 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -3.552 -16.953 -6.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -3.104 -18.342 -8.140 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -1.645 -17.883 -7.401 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -2.249 -19.455 -7.184 1.00 0.00 H new ATOM 340 N ASN A 22 -1.607 -14.892 -0.299 1.00 0.00 N ATOM 341 CA ASN A 22 -1.867 -14.674 1.150 1.00 0.00 C ATOM 342 C ASN A 22 -1.862 -13.181 1.471 1.00 0.00 C ATOM 343 O ASN A 22 -2.479 -12.739 2.419 1.00 0.00 O ATOM 344 CB ASN A 22 -0.706 -15.361 1.857 1.00 0.00 C ATOM 345 CG ASN A 22 -1.242 -16.273 2.962 1.00 0.00 C ATOM 346 OD1 ASN A 22 -2.417 -16.581 2.996 1.00 0.00 O ATOM 347 ND2 ASN A 22 -0.425 -16.722 3.874 1.00 0.00 N ATOM 0 H ASN A 22 -0.624 -14.993 -0.551 1.00 0.00 H new ATOM 0 HA ASN A 22 -2.836 -15.066 1.458 1.00 0.00 H new ATOM 0 HB2 ASN A 22 -0.125 -15.943 1.142 1.00 0.00 H new ATOM 0 HB3 ASN A 22 -0.034 -14.615 2.282 1.00 0.00 H new ATOM 0 HD21 ASN A 22 -0.773 -17.331 4.615 1.00 0.00 H new ATOM 0 HD22 ASN A 22 0.561 -16.464 3.846 1.00 0.00 H new ATOM 354 N ILE A 23 -1.159 -12.406 0.693 1.00 0.00 N ATOM 355 CA ILE A 23 -1.097 -10.941 0.952 1.00 0.00 C ATOM 356 C ILE A 23 -2.450 -10.431 1.465 1.00 0.00 C ATOM 357 O ILE A 23 -3.425 -10.384 0.742 1.00 0.00 O ATOM 358 CB ILE A 23 -0.732 -10.315 -0.401 1.00 0.00 C ATOM 359 CG1 ILE A 23 0.629 -9.625 -0.288 1.00 0.00 C ATOM 360 CG2 ILE A 23 -1.785 -9.286 -0.816 1.00 0.00 C ATOM 361 CD1 ILE A 23 1.709 -10.670 -0.002 1.00 0.00 C ATOM 0 H ILE A 23 -0.623 -12.726 -0.114 1.00 0.00 H new ATOM 0 HA ILE A 23 -0.367 -10.682 1.719 1.00 0.00 H new ATOM 0 HB ILE A 23 -0.692 -11.102 -1.154 1.00 0.00 H new ATOM 0 HG12 ILE A 23 0.857 -9.094 -1.212 1.00 0.00 H new ATOM 0 HG13 ILE A 23 0.607 -8.882 0.509 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -1.511 -8.852 -1.777 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -2.756 -9.774 -0.902 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -1.840 -8.498 -0.065 1.00 0.00 H new ATOM 0 HD11 ILE A 23 2.679 -10.179 0.078 1.00 0.00 H new ATOM 0 HD12 ILE A 23 1.482 -11.181 0.934 1.00 0.00 H new ATOM 0 HD13 ILE A 23 1.737 -11.396 -0.814 1.00 0.00 H new ATOM 373 N GLN A 24 -2.513 -10.054 2.712 1.00 0.00 N ATOM 374 CA GLN A 24 -3.800 -9.548 3.279 1.00 0.00 C ATOM 375 C GLN A 24 -3.783 -8.020 3.363 1.00 0.00 C ATOM 376 O GLN A 24 -4.777 -7.395 3.672 1.00 0.00 O ATOM 377 CB GLN A 24 -3.889 -10.163 4.676 1.00 0.00 C ATOM 378 CG GLN A 24 -5.313 -10.005 5.214 1.00 0.00 C ATOM 379 CD GLN A 24 -5.269 -9.834 6.733 1.00 0.00 C ATOM 380 OE1 GLN A 24 -5.166 -8.731 7.230 1.00 0.00 O ATOM 381 NE2 GLN A 24 -5.345 -10.890 7.498 1.00 0.00 N ATOM 0 H GLN A 24 -1.730 -10.074 3.365 1.00 0.00 H new ATOM 0 HA GLN A 24 -4.655 -9.819 2.660 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -3.618 -11.218 4.638 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -3.180 -9.676 5.345 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -5.793 -9.141 4.754 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -5.911 -10.878 4.953 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -5.432 -11.817 7.081 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -5.318 -10.788 8.513 1.00 0.00 H new ATOM 390 N SER A 25 -2.664 -7.414 3.087 1.00 0.00 N ATOM 391 CA SER A 25 -2.588 -5.927 3.147 1.00 0.00 C ATOM 392 C SER A 25 -1.265 -5.446 2.551 1.00 0.00 C ATOM 393 O SER A 25 -0.203 -5.901 2.925 1.00 0.00 O ATOM 394 CB SER A 25 -2.665 -5.580 4.631 1.00 0.00 C ATOM 395 OG SER A 25 -1.372 -5.704 5.209 1.00 0.00 O ATOM 0 H SER A 25 -1.798 -7.883 2.822 1.00 0.00 H new ATOM 0 HA SER A 25 -3.387 -5.450 2.580 1.00 0.00 H new ATOM 0 HB2 SER A 25 -3.038 -4.564 4.760 1.00 0.00 H new ATOM 0 HB3 SER A 25 -3.367 -6.244 5.136 1.00 0.00 H new ATOM 0 HG SER A 25 -0.773 -6.153 4.577 1.00 0.00 H new ATOM 401 N LEU A 26 -1.316 -4.531 1.627 1.00 0.00 N ATOM 402 CA LEU A 26 -0.056 -4.028 1.011 1.00 0.00 C ATOM 403 C LEU A 26 0.190 -2.576 1.418 1.00 0.00 C ATOM 404 O LEU A 26 -0.731 -1.794 1.537 1.00 0.00 O ATOM 405 CB LEU A 26 -0.285 -4.124 -0.498 1.00 0.00 C ATOM 406 CG LEU A 26 0.058 -5.530 -0.988 1.00 0.00 C ATOM 407 CD1 LEU A 26 1.574 -5.658 -1.152 1.00 0.00 C ATOM 408 CD2 LEU A 26 -0.434 -6.559 0.031 1.00 0.00 C ATOM 0 H LEU A 26 -2.174 -4.109 1.271 1.00 0.00 H new ATOM 0 HA LEU A 26 0.814 -4.601 1.331 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -1.324 -3.891 -0.732 1.00 0.00 H new ATOM 0 HB3 LEU A 26 0.331 -3.389 -1.016 1.00 0.00 H new ATOM 0 HG LEU A 26 -0.427 -5.709 -1.948 1.00 0.00 H new ATOM 0 HD11 LEU A 26 1.819 -6.661 -1.502 1.00 0.00 H new ATOM 0 HD12 LEU A 26 1.925 -4.925 -1.879 1.00 0.00 H new ATOM 0 HD13 LEU A 26 2.060 -5.479 -0.193 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -0.190 -7.562 -0.318 1.00 0.00 H new ATOM 0 HD22 LEU A 26 0.050 -6.381 0.991 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -1.514 -6.468 0.147 1.00 0.00 H new ATOM 420 N SER A 27 1.424 -2.208 1.626 1.00 0.00 N ATOM 421 CA SER A 27 1.722 -0.803 2.019 1.00 0.00 C ATOM 422 C SER A 27 2.921 -0.277 1.226 1.00 0.00 C ATOM 423 O SER A 27 3.784 -1.026 0.817 1.00 0.00 O ATOM 424 CB SER A 27 2.048 -0.871 3.507 1.00 0.00 C ATOM 425 OG SER A 27 1.207 0.031 4.213 1.00 0.00 O ATOM 0 H SER A 27 2.237 -2.818 1.541 1.00 0.00 H new ATOM 0 HA SER A 27 0.889 -0.130 1.816 1.00 0.00 H new ATOM 0 HB2 SER A 27 1.904 -1.886 3.877 1.00 0.00 H new ATOM 0 HB3 SER A 27 3.095 -0.617 3.674 1.00 0.00 H new ATOM 0 HG SER A 27 1.413 -0.011 5.170 1.00 0.00 H new ATOM 431 N VAL A 28 2.982 1.007 1.003 1.00 0.00 N ATOM 432 CA VAL A 28 4.127 1.576 0.236 1.00 0.00 C ATOM 433 C VAL A 28 4.599 2.877 0.889 1.00 0.00 C ATOM 434 O VAL A 28 3.877 3.850 0.948 1.00 0.00 O ATOM 435 CB VAL A 28 3.573 1.845 -1.164 1.00 0.00 C ATOM 436 CG1 VAL A 28 4.469 2.852 -1.887 1.00 0.00 C ATOM 437 CG2 VAL A 28 3.540 0.535 -1.955 1.00 0.00 C ATOM 0 H VAL A 28 2.290 1.686 1.318 1.00 0.00 H new ATOM 0 HA VAL A 28 4.984 0.904 0.209 1.00 0.00 H new ATOM 0 HB VAL A 28 2.565 2.251 -1.083 1.00 0.00 H new ATOM 0 HG11 VAL A 28 4.072 3.042 -2.884 1.00 0.00 H new ATOM 0 HG12 VAL A 28 4.496 3.785 -1.324 1.00 0.00 H new ATOM 0 HG13 VAL A 28 5.478 2.448 -1.969 1.00 0.00 H new ATOM 0 HG21 VAL A 28 3.146 0.723 -2.954 1.00 0.00 H new ATOM 0 HG22 VAL A 28 4.550 0.132 -2.034 1.00 0.00 H new ATOM 0 HG23 VAL A 28 2.901 -0.184 -1.442 1.00 0.00 H new ATOM 447 N THR A 29 5.807 2.905 1.376 1.00 0.00 N ATOM 448 CA THR A 29 6.317 4.146 2.019 1.00 0.00 C ATOM 449 C THR A 29 7.587 4.604 1.308 1.00 0.00 C ATOM 450 O THR A 29 8.406 3.797 0.917 1.00 0.00 O ATOM 451 CB THR A 29 6.617 3.747 3.463 1.00 0.00 C ATOM 452 OG1 THR A 29 7.165 4.859 4.158 1.00 0.00 O ATOM 453 CG2 THR A 29 7.618 2.590 3.478 1.00 0.00 C ATOM 0 H THR A 29 6.462 2.123 1.357 1.00 0.00 H new ATOM 0 HA THR A 29 5.606 4.971 1.970 1.00 0.00 H new ATOM 0 HB THR A 29 5.694 3.433 3.951 1.00 0.00 H new ATOM 0 HG1 THR A 29 7.356 4.604 5.085 1.00 0.00 H new ATOM 0 HG21 THR A 29 7.831 2.307 4.509 1.00 0.00 H new ATOM 0 HG22 THR A 29 7.196 1.737 2.947 1.00 0.00 H new ATOM 0 HG23 THR A 29 8.541 2.901 2.989 1.00 0.00 H new ATOM 461 N PRO A 30 7.705 5.891 1.157 1.00 0.00 N ATOM 462 CA PRO A 30 8.885 6.466 0.476 1.00 0.00 C ATOM 463 C PRO A 30 10.142 6.281 1.325 1.00 0.00 C ATOM 464 O PRO A 30 10.076 5.835 2.453 1.00 0.00 O ATOM 465 CB PRO A 30 8.529 7.943 0.327 1.00 0.00 C ATOM 466 CG PRO A 30 7.533 8.203 1.412 1.00 0.00 C ATOM 467 CD PRO A 30 6.764 6.923 1.602 1.00 0.00 C ATOM 0 HA PRO A 30 9.102 5.990 -0.480 1.00 0.00 H new ATOM 0 HB2 PRO A 30 9.410 8.576 0.437 1.00 0.00 H new ATOM 0 HB3 PRO A 30 8.107 8.152 -0.656 1.00 0.00 H new ATOM 0 HG2 PRO A 30 8.033 8.496 2.335 1.00 0.00 H new ATOM 0 HG3 PRO A 30 6.865 9.020 1.138 1.00 0.00 H new ATOM 0 HD2 PRO A 30 6.473 6.780 2.643 1.00 0.00 H new ATOM 0 HD3 PRO A 30 5.848 6.913 1.011 1.00 0.00 H new ATOM 475 N PRO A 31 11.252 6.618 0.734 1.00 0.00 N ATOM 476 CA PRO A 31 12.558 6.475 1.417 1.00 0.00 C ATOM 477 C PRO A 31 12.797 7.607 2.422 1.00 0.00 C ATOM 478 O PRO A 31 11.907 8.368 2.748 1.00 0.00 O ATOM 479 CB PRO A 31 13.562 6.557 0.274 1.00 0.00 C ATOM 480 CG PRO A 31 12.876 7.335 -0.805 1.00 0.00 C ATOM 481 CD PRO A 31 11.390 7.154 -0.623 1.00 0.00 C ATOM 0 HA PRO A 31 12.628 5.553 1.994 1.00 0.00 H new ATOM 0 HB2 PRO A 31 14.479 7.052 0.592 1.00 0.00 H new ATOM 0 HB3 PRO A 31 13.841 5.563 -0.076 1.00 0.00 H new ATOM 0 HG2 PRO A 31 13.143 8.390 -0.745 1.00 0.00 H new ATOM 0 HG3 PRO A 31 13.187 6.982 -1.788 1.00 0.00 H new ATOM 0 HD2 PRO A 31 10.858 8.099 -0.733 1.00 0.00 H new ATOM 0 HD3 PRO A 31 10.979 6.469 -1.365 1.00 0.00 H new ATOM 564 N THR A 38 12.888 3.413 -1.912 1.00 0.00 N ATOM 565 CA THR A 38 11.426 3.172 -1.715 1.00 0.00 C ATOM 566 C THR A 38 11.220 1.829 -1.014 1.00 0.00 C ATOM 567 O THR A 38 11.952 0.885 -1.241 1.00 0.00 O ATOM 568 CB THR A 38 10.828 3.137 -3.124 1.00 0.00 C ATOM 569 OG1 THR A 38 11.799 3.585 -4.061 1.00 0.00 O ATOM 570 CG2 THR A 38 9.598 4.047 -3.190 1.00 0.00 C ATOM 0 HA THR A 38 10.957 3.939 -1.100 1.00 0.00 H new ATOM 0 HB THR A 38 10.532 2.116 -3.363 1.00 0.00 H new ATOM 0 HG1 THR A 38 12.695 3.485 -3.677 1.00 0.00 H new ATOM 0 HG21 THR A 38 9.177 4.018 -4.195 1.00 0.00 H new ATOM 0 HG22 THR A 38 8.852 3.703 -2.474 1.00 0.00 H new ATOM 0 HG23 THR A 38 9.888 5.069 -2.948 1.00 0.00 H new ATOM 578 N GLU A 39 10.241 1.728 -0.157 1.00 0.00 N ATOM 579 CA GLU A 39 10.022 0.435 0.550 1.00 0.00 C ATOM 580 C GLU A 39 8.533 0.099 0.624 1.00 0.00 C ATOM 581 O GLU A 39 7.687 0.970 0.614 1.00 0.00 O ATOM 582 CB GLU A 39 10.585 0.651 1.950 1.00 0.00 C ATOM 583 CG GLU A 39 11.113 -0.676 2.486 1.00 0.00 C ATOM 584 CD GLU A 39 11.355 -0.564 3.992 1.00 0.00 C ATOM 585 OE1 GLU A 39 12.265 0.153 4.375 1.00 0.00 O ATOM 586 OE2 GLU A 39 10.628 -1.200 4.737 1.00 0.00 O ATOM 0 H GLU A 39 9.590 2.476 0.082 1.00 0.00 H new ATOM 0 HA GLU A 39 10.503 -0.395 0.033 1.00 0.00 H new ATOM 0 HB2 GLU A 39 11.385 1.391 1.924 1.00 0.00 H new ATOM 0 HB3 GLU A 39 9.811 1.042 2.610 1.00 0.00 H new ATOM 0 HG2 GLU A 39 10.398 -1.472 2.281 1.00 0.00 H new ATOM 0 HG3 GLU A 39 12.040 -0.942 1.978 1.00 0.00 H new ATOM 593 N VAL A 40 8.209 -1.164 0.700 1.00 0.00 N ATOM 594 CA VAL A 40 6.775 -1.559 0.778 1.00 0.00 C ATOM 595 C VAL A 40 6.537 -2.471 1.987 1.00 0.00 C ATOM 596 O VAL A 40 7.454 -3.065 2.520 1.00 0.00 O ATOM 597 CB VAL A 40 6.512 -2.318 -0.523 1.00 0.00 C ATOM 598 CG1 VAL A 40 5.069 -2.822 -0.554 1.00 0.00 C ATOM 599 CG2 VAL A 40 6.746 -1.382 -1.709 1.00 0.00 C ATOM 0 H VAL A 40 8.874 -1.937 0.711 1.00 0.00 H new ATOM 0 HA VAL A 40 6.114 -0.700 0.897 1.00 0.00 H new ATOM 0 HB VAL A 40 7.189 -3.170 -0.583 1.00 0.00 H new ATOM 0 HG11 VAL A 40 4.892 -3.361 -1.485 1.00 0.00 H new ATOM 0 HG12 VAL A 40 4.899 -3.490 0.290 1.00 0.00 H new ATOM 0 HG13 VAL A 40 4.386 -1.975 -0.490 1.00 0.00 H new ATOM 0 HG21 VAL A 40 6.560 -1.919 -2.639 1.00 0.00 H new ATOM 0 HG22 VAL A 40 6.069 -0.531 -1.640 1.00 0.00 H new ATOM 0 HG23 VAL A 40 7.777 -1.028 -1.695 1.00 0.00 H new ATOM 609 N ILE A 41 5.313 -2.591 2.413 1.00 0.00 N ATOM 610 CA ILE A 41 5.000 -3.475 3.571 1.00 0.00 C ATOM 611 C ILE A 41 3.785 -4.331 3.223 1.00 0.00 C ATOM 612 O ILE A 41 2.705 -3.825 2.988 1.00 0.00 O ATOM 613 CB ILE A 41 4.682 -2.533 4.733 1.00 0.00 C ATOM 614 CG1 ILE A 41 5.627 -1.329 4.690 1.00 0.00 C ATOM 615 CG2 ILE A 41 4.866 -3.276 6.057 1.00 0.00 C ATOM 616 CD1 ILE A 41 5.247 -0.342 5.796 1.00 0.00 C ATOM 0 H ILE A 41 4.509 -2.112 2.007 1.00 0.00 H new ATOM 0 HA ILE A 41 5.821 -4.146 3.825 1.00 0.00 H new ATOM 0 HB ILE A 41 3.651 -2.189 4.648 1.00 0.00 H new ATOM 0 HG12 ILE A 41 6.658 -1.658 4.820 1.00 0.00 H new ATOM 0 HG13 ILE A 41 5.568 -0.842 3.717 1.00 0.00 H new ATOM 0 HG21 ILE A 41 4.639 -2.605 6.885 1.00 0.00 H new ATOM 0 HG22 ILE A 41 4.193 -4.133 6.090 1.00 0.00 H new ATOM 0 HG23 ILE A 41 5.897 -3.621 6.141 1.00 0.00 H new ATOM 0 HD11 ILE A 41 5.920 0.515 5.766 1.00 0.00 H new ATOM 0 HD12 ILE A 41 4.222 -0.004 5.646 1.00 0.00 H new ATOM 0 HD13 ILE A 41 5.329 -0.833 6.766 1.00 0.00 H new ATOM 628 N ALA A 42 3.954 -5.619 3.161 1.00 0.00 N ATOM 629 CA ALA A 42 2.809 -6.495 2.794 1.00 0.00 C ATOM 630 C ALA A 42 2.527 -7.529 3.884 1.00 0.00 C ATOM 631 O ALA A 42 3.427 -8.125 4.441 1.00 0.00 O ATOM 632 CB ALA A 42 3.260 -7.189 1.512 1.00 0.00 C ATOM 0 H ALA A 42 4.832 -6.103 3.348 1.00 0.00 H new ATOM 0 HA ALA A 42 1.887 -5.927 2.669 1.00 0.00 H new ATOM 0 HB1 ALA A 42 2.474 -7.860 1.165 1.00 0.00 H new ATOM 0 HB2 ALA A 42 3.463 -6.441 0.746 1.00 0.00 H new ATOM 0 HB3 ALA A 42 4.166 -7.763 1.708 1.00 0.00 H new ATOM 638 N THR A 43 1.276 -7.761 4.167 1.00 0.00 N ATOM 639 CA THR A 43 0.914 -8.774 5.198 1.00 0.00 C ATOM 640 C THR A 43 0.293 -9.982 4.502 1.00 0.00 C ATOM 641 O THR A 43 -0.255 -9.867 3.428 1.00 0.00 O ATOM 642 CB THR A 43 -0.111 -8.091 6.104 1.00 0.00 C ATOM 643 OG1 THR A 43 0.509 -7.011 6.789 1.00 0.00 O ATOM 644 CG2 THR A 43 -0.653 -9.104 7.119 1.00 0.00 C ATOM 0 H THR A 43 0.485 -7.291 3.727 1.00 0.00 H new ATOM 0 HA THR A 43 1.775 -9.120 5.771 1.00 0.00 H new ATOM 0 HB THR A 43 -0.935 -7.711 5.500 1.00 0.00 H new ATOM 0 HG1 THR A 43 0.101 -6.166 6.505 1.00 0.00 H new ATOM 0 HG21 THR A 43 -1.384 -8.617 7.765 1.00 0.00 H new ATOM 0 HG22 THR A 43 -1.129 -9.930 6.590 1.00 0.00 H new ATOM 0 HG23 THR A 43 0.168 -9.487 7.725 1.00 0.00 H new ATOM 652 N LEU A 44 0.390 -11.139 5.087 1.00 0.00 N ATOM 653 CA LEU A 44 -0.180 -12.345 4.428 1.00 0.00 C ATOM 654 C LEU A 44 -1.425 -12.838 5.167 1.00 0.00 C ATOM 655 O LEU A 44 -1.756 -12.365 6.236 1.00 0.00 O ATOM 656 CB LEU A 44 0.933 -13.376 4.521 1.00 0.00 C ATOM 657 CG LEU A 44 2.145 -12.878 3.738 1.00 0.00 C ATOM 658 CD1 LEU A 44 3.213 -13.968 3.715 1.00 0.00 C ATOM 659 CD2 LEU A 44 1.719 -12.545 2.308 1.00 0.00 C ATOM 0 H LEU A 44 0.837 -11.303 5.989 1.00 0.00 H new ATOM 0 HA LEU A 44 -0.493 -12.148 3.403 1.00 0.00 H new ATOM 0 HB2 LEU A 44 1.203 -13.544 5.564 1.00 0.00 H new ATOM 0 HB3 LEU A 44 0.594 -14.332 4.121 1.00 0.00 H new ATOM 0 HG LEU A 44 2.550 -11.985 4.213 1.00 0.00 H new ATOM 0 HD11 LEU A 44 4.080 -13.616 3.157 1.00 0.00 H new ATOM 0 HD12 LEU A 44 3.511 -14.207 4.736 1.00 0.00 H new ATOM 0 HD13 LEU A 44 2.811 -14.861 3.236 1.00 0.00 H new ATOM 0 HD21 LEU A 44 2.582 -12.189 1.745 1.00 0.00 H new ATOM 0 HD22 LEU A 44 1.318 -13.439 1.830 1.00 0.00 H new ATOM 0 HD23 LEU A 44 0.953 -11.770 2.328 1.00 0.00 H new ATOM 671 N LYS A 45 -2.117 -13.788 4.598 1.00 0.00 N ATOM 672 CA LYS A 45 -3.341 -14.316 5.262 1.00 0.00 C ATOM 673 C LYS A 45 -2.964 -15.398 6.274 1.00 0.00 C ATOM 674 O LYS A 45 -2.510 -16.467 5.915 1.00 0.00 O ATOM 675 CB LYS A 45 -4.183 -14.909 4.131 1.00 0.00 C ATOM 676 CG LYS A 45 -5.465 -14.090 3.966 1.00 0.00 C ATOM 677 CD LYS A 45 -6.323 -14.222 5.226 1.00 0.00 C ATOM 678 CE LYS A 45 -7.802 -14.106 4.851 1.00 0.00 C ATOM 679 NZ LYS A 45 -8.505 -13.839 6.136 1.00 0.00 N ATOM 0 H LYS A 45 -1.887 -14.220 3.703 1.00 0.00 H new ATOM 0 HA LYS A 45 -3.882 -13.543 5.808 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -3.615 -14.907 3.201 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -4.428 -15.948 4.352 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -5.220 -13.043 3.789 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -6.022 -14.438 3.096 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -6.133 -15.181 5.709 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -6.057 -13.446 5.943 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -7.966 -13.299 4.136 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -8.164 -15.023 4.386 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -9.526 -13.747 5.961 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -8.336 -14.627 6.794 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -8.144 -12.957 6.552 1.00 0.00 H new ATOM 693 N GLY A 46 -3.148 -15.131 7.536 1.00 0.00 N ATOM 694 CA GLY A 46 -2.801 -16.142 8.568 1.00 0.00 C ATOM 695 C GLY A 46 -1.991 -15.481 9.684 1.00 0.00 C ATOM 696 O GLY A 46 -2.034 -15.900 10.824 1.00 0.00 O ATOM 0 H GLY A 46 -3.524 -14.254 7.897 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -3.709 -16.584 8.977 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -2.226 -16.952 8.119 1.00 0.00 H new ATOM 700 N GLY A 47 -1.250 -14.453 9.370 1.00 0.00 N ATOM 701 CA GLY A 47 -0.441 -13.778 10.419 1.00 0.00 C ATOM 702 C GLY A 47 1.036 -13.847 10.041 1.00 0.00 C ATOM 703 O GLY A 47 1.830 -14.493 10.695 1.00 0.00 O ATOM 0 H GLY A 47 -1.171 -14.054 8.435 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -0.753 -12.739 10.522 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -0.604 -14.257 11.384 1.00 0.00 H new ATOM 707 N GLN A 48 1.405 -13.182 8.987 1.00 0.00 N ATOM 708 CA GLN A 48 2.825 -13.194 8.546 1.00 0.00 C ATOM 709 C GLN A 48 3.069 -12.029 7.587 1.00 0.00 C ATOM 710 O GLN A 48 2.823 -12.128 6.402 1.00 0.00 O ATOM 711 CB GLN A 48 3.012 -14.532 7.829 1.00 0.00 C ATOM 712 CG GLN A 48 4.081 -15.353 8.552 1.00 0.00 C ATOM 713 CD GLN A 48 4.671 -16.384 7.588 1.00 0.00 C ATOM 714 OE1 GLN A 48 5.780 -16.845 7.778 1.00 0.00 O ATOM 715 NE2 GLN A 48 3.972 -16.768 6.556 1.00 0.00 N ATOM 0 H GLN A 48 0.779 -12.625 8.406 1.00 0.00 H new ATOM 0 HA GLN A 48 3.523 -13.085 9.376 1.00 0.00 H new ATOM 0 HB2 GLN A 48 2.070 -15.080 7.808 1.00 0.00 H new ATOM 0 HB3 GLN A 48 3.306 -14.364 6.793 1.00 0.00 H new ATOM 0 HG2 GLN A 48 4.867 -14.697 8.926 1.00 0.00 H new ATOM 0 HG3 GLN A 48 3.646 -15.855 9.417 1.00 0.00 H new ATOM 0 HE21 GLN A 48 3.042 -16.381 6.397 1.00 0.00 H new ATOM 0 HE22 GLN A 48 4.356 -17.456 5.908 1.00 0.00 H new ATOM 724 N LYS A 49 3.533 -10.922 8.092 1.00 0.00 N ATOM 725 CA LYS A 49 3.770 -9.750 7.210 1.00 0.00 C ATOM 726 C LYS A 49 5.261 -9.501 7.029 1.00 0.00 C ATOM 727 O LYS A 49 6.098 -10.110 7.664 1.00 0.00 O ATOM 728 CB LYS A 49 3.125 -8.575 7.940 1.00 0.00 C ATOM 729 CG LYS A 49 3.509 -7.253 7.270 1.00 0.00 C ATOM 730 CD LYS A 49 2.841 -6.094 8.012 1.00 0.00 C ATOM 731 CE LYS A 49 3.847 -5.460 8.976 1.00 0.00 C ATOM 732 NZ LYS A 49 3.375 -4.059 9.161 1.00 0.00 N ATOM 0 H LYS A 49 3.758 -10.779 9.077 1.00 0.00 H new ATOM 0 HA LYS A 49 3.355 -9.901 6.214 1.00 0.00 H new ATOM 0 HB2 LYS A 49 2.041 -8.689 7.939 1.00 0.00 H new ATOM 0 HB3 LYS A 49 3.444 -8.567 8.982 1.00 0.00 H new ATOM 0 HG2 LYS A 49 4.592 -7.129 7.279 1.00 0.00 H new ATOM 0 HG3 LYS A 49 3.198 -7.258 6.225 1.00 0.00 H new ATOM 0 HD2 LYS A 49 2.484 -5.350 7.300 1.00 0.00 H new ATOM 0 HD3 LYS A 49 1.971 -6.453 8.561 1.00 0.00 H new ATOM 0 HE2 LYS A 49 3.875 -5.995 9.925 1.00 0.00 H new ATOM 0 HE3 LYS A 49 4.856 -5.485 8.566 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 4.102 -3.400 8.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 2.496 -3.915 8.625 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 3.197 -3.883 10.170 1.00 0.00 H new ATOM 746 N VAL A 50 5.584 -8.602 6.155 1.00 0.00 N ATOM 747 CA VAL A 50 7.017 -8.279 5.895 1.00 0.00 C ATOM 748 C VAL A 50 7.125 -7.033 5.009 1.00 0.00 C ATOM 749 O VAL A 50 6.192 -6.262 4.891 1.00 0.00 O ATOM 750 CB VAL A 50 7.568 -9.514 5.176 1.00 0.00 C ATOM 751 CG1 VAL A 50 7.265 -9.420 3.678 1.00 0.00 C ATOM 752 CG2 VAL A 50 9.082 -9.596 5.386 1.00 0.00 C ATOM 0 H VAL A 50 4.915 -8.068 5.600 1.00 0.00 H new ATOM 0 HA VAL A 50 7.571 -8.060 6.808 1.00 0.00 H new ATOM 0 HB VAL A 50 7.095 -10.407 5.584 1.00 0.00 H new ATOM 0 HG11 VAL A 50 7.659 -10.301 3.171 1.00 0.00 H new ATOM 0 HG12 VAL A 50 6.187 -9.367 3.528 1.00 0.00 H new ATOM 0 HG13 VAL A 50 7.733 -8.525 3.268 1.00 0.00 H new ATOM 0 HG21 VAL A 50 9.473 -10.475 4.874 1.00 0.00 H new ATOM 0 HG22 VAL A 50 9.554 -8.701 4.982 1.00 0.00 H new ATOM 0 HG23 VAL A 50 9.298 -9.671 6.452 1.00 0.00 H new ATOM 762 N CYS A 51 8.252 -6.830 4.381 1.00 0.00 N ATOM 763 CA CYS A 51 8.413 -5.640 3.501 1.00 0.00 C ATOM 764 C CYS A 51 8.464 -6.083 2.040 1.00 0.00 C ATOM 765 O CYS A 51 8.931 -7.160 1.726 1.00 0.00 O ATOM 766 CB CYS A 51 9.739 -5.010 3.926 1.00 0.00 C ATOM 767 SG CYS A 51 9.476 -3.977 5.389 1.00 0.00 S ATOM 0 H CYS A 51 9.068 -7.439 4.440 1.00 0.00 H new ATOM 0 HA CYS A 51 7.587 -4.935 3.592 1.00 0.00 H new ATOM 0 HB2 CYS A 51 10.470 -5.788 4.144 1.00 0.00 H new ATOM 0 HB3 CYS A 51 10.146 -4.410 3.112 1.00 0.00 H new ATOM 0 HG CYS A 51 10.076 -2.835 5.228 1.00 0.00 H new ATOM 772 N LEU A 52 7.961 -5.279 1.145 1.00 0.00 N ATOM 773 CA LEU A 52 7.952 -5.669 -0.278 1.00 0.00 C ATOM 774 C LEU A 52 8.941 -4.832 -1.092 1.00 0.00 C ATOM 775 O LEU A 52 9.407 -3.793 -0.657 1.00 0.00 O ATOM 776 CB LEU A 52 6.524 -5.378 -0.706 1.00 0.00 C ATOM 777 CG LEU A 52 5.853 -6.671 -1.154 1.00 0.00 C ATOM 778 CD1 LEU A 52 4.336 -6.497 -1.094 1.00 0.00 C ATOM 779 CD2 LEU A 52 6.276 -6.997 -2.588 1.00 0.00 C ATOM 0 H LEU A 52 7.555 -4.365 1.347 1.00 0.00 H new ATOM 0 HA LEU A 52 8.249 -6.706 -0.434 1.00 0.00 H new ATOM 0 HB2 LEU A 52 5.969 -4.935 0.121 1.00 0.00 H new ATOM 0 HB3 LEU A 52 6.518 -4.652 -1.519 1.00 0.00 H new ATOM 0 HG LEU A 52 6.154 -7.487 -0.496 1.00 0.00 H new ATOM 0 HD11 LEU A 52 3.851 -7.419 -1.414 1.00 0.00 H new ATOM 0 HD12 LEU A 52 4.037 -6.265 -0.072 1.00 0.00 H new ATOM 0 HD13 LEU A 52 4.037 -5.682 -1.754 1.00 0.00 H new ATOM 0 HD21 LEU A 52 5.796 -7.922 -2.908 1.00 0.00 H new ATOM 0 HD22 LEU A 52 5.975 -6.185 -3.250 1.00 0.00 H new ATOM 0 HD23 LEU A 52 7.359 -7.117 -2.630 1.00 0.00 H new ATOM 791 N ASP A 53 9.252 -5.298 -2.274 1.00 0.00 N ATOM 792 CA ASP A 53 10.205 -4.580 -3.170 1.00 0.00 C ATOM 793 C ASP A 53 9.851 -3.090 -3.271 1.00 0.00 C ATOM 794 O ASP A 53 9.118 -2.570 -2.455 1.00 0.00 O ATOM 795 CB ASP A 53 10.029 -5.275 -4.521 1.00 0.00 C ATOM 796 CG ASP A 53 11.386 -5.765 -5.030 1.00 0.00 C ATOM 797 OD1 ASP A 53 12.148 -6.278 -4.228 1.00 0.00 O ATOM 798 OD2 ASP A 53 11.639 -5.620 -6.215 1.00 0.00 O ATOM 0 H ASP A 53 8.877 -6.163 -2.663 1.00 0.00 H new ATOM 0 HA ASP A 53 11.232 -4.617 -2.806 1.00 0.00 H new ATOM 0 HB2 ASP A 53 9.342 -6.115 -4.422 1.00 0.00 H new ATOM 0 HB3 ASP A 53 9.587 -4.586 -5.241 1.00 0.00 H new ATOM 803 N PRO A 54 10.389 -2.446 -4.277 1.00 0.00 N ATOM 804 CA PRO A 54 10.129 -1.006 -4.482 1.00 0.00 C ATOM 805 C PRO A 54 8.850 -0.837 -5.294 1.00 0.00 C ATOM 806 O PRO A 54 8.873 -0.855 -6.504 1.00 0.00 O ATOM 807 CB PRO A 54 11.348 -0.543 -5.270 1.00 0.00 C ATOM 808 CG PRO A 54 11.870 -1.764 -5.975 1.00 0.00 C ATOM 809 CD PRO A 54 11.274 -2.988 -5.315 1.00 0.00 C ATOM 0 HA PRO A 54 9.990 -0.440 -3.561 1.00 0.00 H new ATOM 0 HB2 PRO A 54 11.079 0.235 -5.984 1.00 0.00 H new ATOM 0 HB3 PRO A 54 12.104 -0.121 -4.608 1.00 0.00 H new ATOM 0 HG2 PRO A 54 11.603 -1.735 -7.031 1.00 0.00 H new ATOM 0 HG3 PRO A 54 12.958 -1.796 -5.922 1.00 0.00 H new ATOM 0 HD2 PRO A 54 10.721 -3.597 -6.031 1.00 0.00 H new ATOM 0 HD3 PRO A 54 12.047 -3.625 -4.886 1.00 0.00 H new ATOM 817 N GLU A 55 7.729 -0.711 -4.640 1.00 0.00 N ATOM 818 CA GLU A 55 6.450 -0.592 -5.389 1.00 0.00 C ATOM 819 C GLU A 55 6.312 -1.829 -6.266 1.00 0.00 C ATOM 820 O GLU A 55 5.591 -1.845 -7.240 1.00 0.00 O ATOM 821 CB GLU A 55 6.565 0.700 -6.218 1.00 0.00 C ATOM 822 CG GLU A 55 7.174 0.420 -7.600 1.00 0.00 C ATOM 823 CD GLU A 55 6.384 1.177 -8.669 1.00 0.00 C ATOM 824 OE1 GLU A 55 5.252 0.799 -8.921 1.00 0.00 O ATOM 825 OE2 GLU A 55 6.925 2.123 -9.218 1.00 0.00 O ATOM 0 H GLU A 55 7.644 -0.685 -3.624 1.00 0.00 H new ATOM 0 HA GLU A 55 5.568 -0.536 -4.751 1.00 0.00 H new ATOM 0 HB2 GLU A 55 5.579 1.148 -6.336 1.00 0.00 H new ATOM 0 HB3 GLU A 55 7.182 1.423 -5.685 1.00 0.00 H new ATOM 0 HG2 GLU A 55 8.219 0.729 -7.618 1.00 0.00 H new ATOM 0 HG3 GLU A 55 7.154 -0.650 -7.808 1.00 0.00 H new ATOM 832 N ALA A 56 7.023 -2.871 -5.920 1.00 0.00 N ATOM 833 CA ALA A 56 6.965 -4.117 -6.725 1.00 0.00 C ATOM 834 C ALA A 56 6.950 -3.749 -8.207 1.00 0.00 C ATOM 835 O ALA A 56 5.934 -3.845 -8.861 1.00 0.00 O ATOM 836 CB ALA A 56 5.665 -4.811 -6.313 1.00 0.00 C ATOM 0 H ALA A 56 7.642 -2.908 -5.110 1.00 0.00 H new ATOM 0 HA ALA A 56 7.821 -4.771 -6.559 1.00 0.00 H new ATOM 0 HB1 ALA A 56 5.557 -5.742 -6.870 1.00 0.00 H new ATOM 0 HB2 ALA A 56 5.691 -5.028 -5.245 1.00 0.00 H new ATOM 0 HB3 ALA A 56 4.820 -4.158 -6.530 1.00 0.00 H new ATOM 842 N PRO A 57 8.091 -3.326 -8.681 1.00 0.00 N ATOM 843 CA PRO A 57 8.221 -2.926 -10.099 1.00 0.00 C ATOM 844 C PRO A 57 8.240 -4.176 -10.970 1.00 0.00 C ATOM 845 O PRO A 57 7.347 -4.408 -11.760 1.00 0.00 O ATOM 846 CB PRO A 57 9.557 -2.194 -10.149 1.00 0.00 C ATOM 847 CG PRO A 57 10.343 -2.730 -8.994 1.00 0.00 C ATOM 848 CD PRO A 57 9.354 -3.191 -7.948 1.00 0.00 C ATOM 0 HA PRO A 57 7.403 -2.303 -10.461 1.00 0.00 H new ATOM 0 HB2 PRO A 57 10.071 -2.376 -11.093 1.00 0.00 H new ATOM 0 HB3 PRO A 57 9.419 -1.116 -10.064 1.00 0.00 H new ATOM 0 HG2 PRO A 57 10.978 -3.557 -9.313 1.00 0.00 H new ATOM 0 HG3 PRO A 57 11.001 -1.961 -8.588 1.00 0.00 H new ATOM 0 HD2 PRO A 57 9.659 -4.138 -7.502 1.00 0.00 H new ATOM 0 HD3 PRO A 57 9.268 -2.469 -7.136 1.00 0.00 H new ATOM 856 N LEU A 58 9.234 -5.001 -10.808 1.00 0.00 N ATOM 857 CA LEU A 58 9.276 -6.251 -11.606 1.00 0.00 C ATOM 858 C LEU A 58 7.980 -7.018 -11.359 1.00 0.00 C ATOM 859 O LEU A 58 7.390 -7.575 -12.263 1.00 0.00 O ATOM 860 CB LEU A 58 10.478 -7.031 -11.069 1.00 0.00 C ATOM 861 CG LEU A 58 11.547 -7.139 -12.158 1.00 0.00 C ATOM 862 CD1 LEU A 58 10.988 -7.917 -13.351 1.00 0.00 C ATOM 863 CD2 LEU A 58 11.957 -5.737 -12.613 1.00 0.00 C ATOM 0 H LEU A 58 10.012 -4.864 -10.163 1.00 0.00 H new ATOM 0 HA LEU A 58 9.370 -6.078 -12.678 1.00 0.00 H new ATOM 0 HB2 LEU A 58 10.887 -6.530 -10.192 1.00 0.00 H new ATOM 0 HB3 LEU A 58 10.166 -8.026 -10.751 1.00 0.00 H new ATOM 0 HG LEU A 58 12.416 -7.662 -11.759 1.00 0.00 H new ATOM 0 HD11 LEU A 58 11.751 -7.993 -14.126 1.00 0.00 H new ATOM 0 HD12 LEU A 58 10.697 -8.917 -13.029 1.00 0.00 H new ATOM 0 HD13 LEU A 58 10.117 -7.396 -13.749 1.00 0.00 H new ATOM 0 HD21 LEU A 58 12.719 -5.814 -13.389 1.00 0.00 H new ATOM 0 HD22 LEU A 58 11.087 -5.214 -13.010 1.00 0.00 H new ATOM 0 HD23 LEU A 58 12.358 -5.182 -11.765 1.00 0.00 H new ATOM 875 N VAL A 59 7.528 -7.038 -10.130 1.00 0.00 N ATOM 876 CA VAL A 59 6.259 -7.757 -9.819 1.00 0.00 C ATOM 877 C VAL A 59 5.059 -6.811 -9.933 1.00 0.00 C ATOM 878 O VAL A 59 3.937 -7.180 -9.651 1.00 0.00 O ATOM 879 CB VAL A 59 6.421 -8.247 -8.387 1.00 0.00 C ATOM 880 CG1 VAL A 59 5.173 -9.028 -7.977 1.00 0.00 C ATOM 881 CG2 VAL A 59 7.648 -9.157 -8.304 1.00 0.00 C ATOM 0 H VAL A 59 7.981 -6.590 -9.334 1.00 0.00 H new ATOM 0 HA VAL A 59 6.075 -8.577 -10.513 1.00 0.00 H new ATOM 0 HB VAL A 59 6.552 -7.397 -7.717 1.00 0.00 H new ATOM 0 HG11 VAL A 59 5.285 -9.381 -6.952 1.00 0.00 H new ATOM 0 HG12 VAL A 59 4.300 -8.379 -8.044 1.00 0.00 H new ATOM 0 HG13 VAL A 59 5.043 -9.882 -8.642 1.00 0.00 H new ATOM 0 HG21 VAL A 59 7.770 -9.511 -7.280 1.00 0.00 H new ATOM 0 HG22 VAL A 59 7.514 -10.010 -8.970 1.00 0.00 H new ATOM 0 HG23 VAL A 59 8.536 -8.599 -8.603 1.00 0.00 H new ATOM 891 N GLN A 60 5.288 -5.593 -10.335 1.00 0.00 N ATOM 892 CA GLN A 60 4.162 -4.623 -10.459 1.00 0.00 C ATOM 893 C GLN A 60 2.961 -5.302 -11.106 1.00 0.00 C ATOM 894 O GLN A 60 1.841 -5.181 -10.652 1.00 0.00 O ATOM 895 CB GLN A 60 4.698 -3.507 -11.358 1.00 0.00 C ATOM 896 CG GLN A 60 3.818 -2.257 -11.227 1.00 0.00 C ATOM 897 CD GLN A 60 3.419 -2.044 -9.763 1.00 0.00 C ATOM 898 OE1 GLN A 60 2.365 -2.473 -9.342 1.00 0.00 O ATOM 899 NE2 GLN A 60 4.224 -1.394 -8.966 1.00 0.00 N ATOM 0 H GLN A 60 6.206 -5.226 -10.584 1.00 0.00 H new ATOM 0 HA GLN A 60 3.832 -4.242 -9.493 1.00 0.00 H new ATOM 0 HB2 GLN A 60 5.725 -3.269 -11.082 1.00 0.00 H new ATOM 0 HB3 GLN A 60 4.716 -3.842 -12.395 1.00 0.00 H new ATOM 0 HG2 GLN A 60 4.356 -1.384 -11.596 1.00 0.00 H new ATOM 0 HG3 GLN A 60 2.925 -2.365 -11.843 1.00 0.00 H new ATOM 0 HE21 GLN A 60 5.110 -1.033 -9.320 1.00 0.00 H new ATOM 0 HE22 GLN A 60 3.967 -1.247 -7.990 1.00 0.00 H new ATOM 908 N LYS A 61 3.192 -6.020 -12.161 1.00 0.00 N ATOM 909 CA LYS A 61 2.068 -6.721 -12.842 1.00 0.00 C ATOM 910 C LYS A 61 1.313 -7.584 -11.831 1.00 0.00 C ATOM 911 O LYS A 61 0.111 -7.484 -11.687 1.00 0.00 O ATOM 912 CB LYS A 61 2.727 -7.589 -13.915 1.00 0.00 C ATOM 913 CG LYS A 61 3.497 -6.696 -14.890 1.00 0.00 C ATOM 914 CD LYS A 61 4.600 -7.512 -15.568 1.00 0.00 C ATOM 915 CE LYS A 61 4.792 -7.018 -17.004 1.00 0.00 C ATOM 916 NZ LYS A 61 4.374 -8.161 -17.862 1.00 0.00 N ATOM 0 H LYS A 61 4.110 -6.155 -12.585 1.00 0.00 H new ATOM 0 HA LYS A 61 1.346 -6.030 -13.277 1.00 0.00 H new ATOM 0 HB2 LYS A 61 3.403 -8.308 -13.452 1.00 0.00 H new ATOM 0 HB3 LYS A 61 1.970 -8.162 -14.450 1.00 0.00 H new ATOM 0 HG2 LYS A 61 2.819 -6.288 -15.640 1.00 0.00 H new ATOM 0 HG3 LYS A 61 3.931 -5.849 -14.359 1.00 0.00 H new ATOM 0 HD2 LYS A 61 5.532 -7.416 -15.011 1.00 0.00 H new ATOM 0 HD3 LYS A 61 4.337 -8.570 -15.568 1.00 0.00 H new ATOM 0 HE2 LYS A 61 4.186 -6.134 -17.202 1.00 0.00 H new ATOM 0 HE3 LYS A 61 5.830 -6.742 -17.191 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 4.477 -7.899 -18.863 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 4.972 -8.986 -17.656 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 3.380 -8.397 -17.666 1.00 0.00 H new ATOM 930 N ILE A 62 2.015 -8.418 -11.121 1.00 0.00 N ATOM 931 CA ILE A 62 1.347 -9.277 -10.103 1.00 0.00 C ATOM 932 C ILE A 62 0.730 -8.391 -9.021 1.00 0.00 C ATOM 933 O ILE A 62 -0.243 -8.752 -8.388 1.00 0.00 O ATOM 934 CB ILE A 62 2.460 -10.152 -9.528 1.00 0.00 C ATOM 935 CG1 ILE A 62 3.041 -11.030 -10.639 1.00 0.00 C ATOM 936 CG2 ILE A 62 1.893 -11.041 -8.421 1.00 0.00 C ATOM 937 CD1 ILE A 62 3.969 -12.080 -10.026 1.00 0.00 C ATOM 0 H ILE A 62 3.024 -8.544 -11.200 1.00 0.00 H new ATOM 0 HA ILE A 62 0.543 -9.884 -10.520 1.00 0.00 H new ATOM 0 HB ILE A 62 3.244 -9.517 -9.116 1.00 0.00 H new ATOM 0 HG12 ILE A 62 2.237 -11.517 -11.190 1.00 0.00 H new ATOM 0 HG13 ILE A 62 3.590 -10.416 -11.353 1.00 0.00 H new ATOM 0 HG21 ILE A 62 2.688 -11.664 -8.012 1.00 0.00 H new ATOM 0 HG22 ILE A 62 1.478 -10.417 -7.630 1.00 0.00 H new ATOM 0 HG23 ILE A 62 1.108 -11.677 -8.831 1.00 0.00 H new ATOM 0 HD11 ILE A 62 4.383 -12.706 -10.817 1.00 0.00 H new ATOM 0 HD12 ILE A 62 4.780 -11.583 -9.494 1.00 0.00 H new ATOM 0 HD13 ILE A 62 3.406 -12.701 -9.329 1.00 0.00 H new ATOM 949 N ILE A 63 1.271 -7.219 -8.823 1.00 0.00 N ATOM 950 CA ILE A 63 0.697 -6.302 -7.809 1.00 0.00 C ATOM 951 C ILE A 63 -0.607 -5.744 -8.358 1.00 0.00 C ATOM 952 O ILE A 63 -1.646 -5.828 -7.737 1.00 0.00 O ATOM 953 CB ILE A 63 1.753 -5.208 -7.632 1.00 0.00 C ATOM 954 CG1 ILE A 63 2.485 -5.432 -6.311 1.00 0.00 C ATOM 955 CG2 ILE A 63 1.089 -3.834 -7.627 1.00 0.00 C ATOM 956 CD1 ILE A 63 2.964 -6.880 -6.254 1.00 0.00 C ATOM 0 H ILE A 63 2.086 -6.861 -9.322 1.00 0.00 H new ATOM 0 HA ILE A 63 0.471 -6.778 -6.855 1.00 0.00 H new ATOM 0 HB ILE A 63 2.462 -5.251 -8.459 1.00 0.00 H new ATOM 0 HG12 ILE A 63 3.332 -4.751 -6.228 1.00 0.00 H new ATOM 0 HG13 ILE A 63 1.823 -5.220 -5.472 1.00 0.00 H new ATOM 0 HG21 ILE A 63 1.849 -3.063 -7.501 1.00 0.00 H new ATOM 0 HG22 ILE A 63 0.568 -3.678 -8.572 1.00 0.00 H new ATOM 0 HG23 ILE A 63 0.375 -3.778 -6.805 1.00 0.00 H new ATOM 0 HD11 ILE A 63 3.489 -7.053 -5.314 1.00 0.00 H new ATOM 0 HD12 ILE A 63 2.106 -7.550 -6.319 1.00 0.00 H new ATOM 0 HD13 ILE A 63 3.639 -7.073 -7.088 1.00 0.00 H new ATOM 968 N GLN A 64 -0.568 -5.212 -9.545 1.00 0.00 N ATOM 969 CA GLN A 64 -1.824 -4.696 -10.146 1.00 0.00 C ATOM 970 C GLN A 64 -2.875 -5.792 -10.011 1.00 0.00 C ATOM 971 O GLN A 64 -4.062 -5.540 -9.943 1.00 0.00 O ATOM 972 CB GLN A 64 -1.494 -4.432 -11.616 1.00 0.00 C ATOM 973 CG GLN A 64 -1.392 -2.924 -11.855 1.00 0.00 C ATOM 974 CD GLN A 64 -1.656 -2.623 -13.332 1.00 0.00 C ATOM 975 OE1 GLN A 64 -0.769 -2.733 -14.155 1.00 0.00 O ATOM 976 NE2 GLN A 64 -2.848 -2.243 -13.704 1.00 0.00 N ATOM 0 H GLN A 64 0.269 -5.113 -10.119 1.00 0.00 H new ATOM 0 HA GLN A 64 -2.201 -3.790 -9.672 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -0.555 -4.917 -11.881 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -2.266 -4.861 -12.255 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -2.113 -2.396 -11.231 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -0.402 -2.566 -11.571 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -3.593 -2.151 -13.013 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -3.035 -2.038 -14.686 1.00 0.00 H new ATOM 985 N LYS A 65 -2.425 -7.019 -9.937 1.00 0.00 N ATOM 986 CA LYS A 65 -3.365 -8.155 -9.767 1.00 0.00 C ATOM 987 C LYS A 65 -3.919 -8.120 -8.346 1.00 0.00 C ATOM 988 O LYS A 65 -5.076 -8.402 -8.105 1.00 0.00 O ATOM 989 CB LYS A 65 -2.519 -9.410 -9.987 1.00 0.00 C ATOM 990 CG LYS A 65 -3.394 -10.519 -10.573 1.00 0.00 C ATOM 991 CD LYS A 65 -4.227 -11.155 -9.458 1.00 0.00 C ATOM 992 CE LYS A 65 -3.836 -12.626 -9.305 1.00 0.00 C ATOM 993 NZ LYS A 65 -5.100 -13.383 -9.528 1.00 0.00 N ATOM 0 H LYS A 65 -1.440 -7.279 -9.988 1.00 0.00 H new ATOM 0 HA LYS A 65 -4.209 -8.122 -10.457 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -1.692 -9.190 -10.662 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -2.082 -9.737 -9.043 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -4.049 -10.111 -11.343 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -2.770 -11.274 -11.052 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -4.064 -10.625 -8.520 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -5.289 -11.072 -9.690 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -3.073 -12.909 -10.029 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -3.426 -12.825 -8.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -4.914 -14.402 -9.440 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -5.806 -13.097 -8.820 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -5.463 -13.179 -10.481 1.00 0.00 H new ATOM 1007 N ILE A 66 -3.095 -7.748 -7.402 1.00 0.00 N ATOM 1008 CA ILE A 66 -3.562 -7.665 -5.993 1.00 0.00 C ATOM 1009 C ILE A 66 -4.437 -6.419 -5.833 1.00 0.00 C ATOM 1010 O ILE A 66 -5.423 -6.420 -5.121 1.00 0.00 O ATOM 1011 CB ILE A 66 -2.286 -7.571 -5.149 1.00 0.00 C ATOM 1012 CG1 ILE A 66 -2.505 -8.294 -3.819 1.00 0.00 C ATOM 1013 CG2 ILE A 66 -1.935 -6.109 -4.877 1.00 0.00 C ATOM 1014 CD1 ILE A 66 -1.807 -9.654 -3.856 1.00 0.00 C ATOM 0 H ILE A 66 -2.117 -7.498 -7.550 1.00 0.00 H new ATOM 0 HA ILE A 66 -4.163 -8.521 -5.687 1.00 0.00 H new ATOM 0 HB ILE A 66 -1.466 -8.036 -5.696 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -2.112 -7.694 -2.998 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -3.571 -8.426 -3.636 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -1.027 -6.059 -4.277 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -1.774 -5.591 -5.823 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -2.754 -5.633 -4.337 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -1.963 -10.169 -2.908 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -2.221 -10.253 -4.667 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -0.739 -9.510 -4.019 1.00 0.00 H new ATOM 1026 N LEU A 67 -4.093 -5.364 -6.523 1.00 0.00 N ATOM 1027 CA LEU A 67 -4.907 -4.118 -6.455 1.00 0.00 C ATOM 1028 C LEU A 67 -6.238 -4.346 -7.169 1.00 0.00 C ATOM 1029 O LEU A 67 -7.273 -3.859 -6.758 1.00 0.00 O ATOM 1030 CB LEU A 67 -4.077 -3.061 -7.193 1.00 0.00 C ATOM 1031 CG LEU A 67 -3.174 -2.325 -6.202 1.00 0.00 C ATOM 1032 CD1 LEU A 67 -2.356 -3.338 -5.405 1.00 0.00 C ATOM 1033 CD2 LEU A 67 -2.229 -1.397 -6.969 1.00 0.00 C ATOM 0 H LEU A 67 -3.278 -5.313 -7.134 1.00 0.00 H new ATOM 0 HA LEU A 67 -5.129 -3.813 -5.432 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -3.473 -3.535 -7.966 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -4.737 -2.352 -7.694 1.00 0.00 H new ATOM 0 HG LEU A 67 -3.788 -1.738 -5.519 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -1.713 -2.812 -4.699 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -3.028 -4.000 -4.859 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -1.742 -3.926 -6.086 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -1.584 -0.871 -6.265 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -1.616 -1.985 -7.652 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -2.812 -0.673 -7.537 1.00 0.00 H new ATOM 1045 N ASN A 68 -6.212 -5.091 -8.238 1.00 0.00 N ATOM 1046 CA ASN A 68 -7.464 -5.370 -8.992 1.00 0.00 C ATOM 1047 C ASN A 68 -8.131 -6.637 -8.455 1.00 0.00 C ATOM 1048 O ASN A 68 -9.067 -7.152 -9.036 1.00 0.00 O ATOM 1049 CB ASN A 68 -7.017 -5.572 -10.439 1.00 0.00 C ATOM 1050 CG ASN A 68 -8.009 -4.887 -11.380 1.00 0.00 C ATOM 1051 OD1 ASN A 68 -8.821 -5.540 -12.004 1.00 0.00 O ATOM 1052 ND2 ASN A 68 -7.977 -3.589 -11.510 1.00 0.00 N ATOM 0 H ASN A 68 -5.371 -5.521 -8.624 1.00 0.00 H new ATOM 0 HA ASN A 68 -8.192 -4.564 -8.899 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -6.018 -5.159 -10.583 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -6.958 -6.636 -10.667 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -8.634 -3.123 -12.136 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -7.295 -3.041 -10.986 1.00 0.00 H new ATOM 1059 N LYS A 69 -7.658 -7.146 -7.349 1.00 0.00 N ATOM 1060 CA LYS A 69 -8.264 -8.383 -6.776 1.00 0.00 C ATOM 1061 C LYS A 69 -9.559 -8.052 -6.042 1.00 0.00 C ATOM 1062 O LYS A 69 -10.117 -8.866 -5.333 1.00 0.00 O ATOM 1063 CB LYS A 69 -7.215 -8.941 -5.813 1.00 0.00 C ATOM 1064 CG LYS A 69 -6.676 -10.265 -6.356 1.00 0.00 C ATOM 1065 CD LYS A 69 -5.995 -11.040 -5.226 1.00 0.00 C ATOM 1066 CE LYS A 69 -6.204 -12.541 -5.438 1.00 0.00 C ATOM 1067 NZ LYS A 69 -4.886 -13.160 -5.122 1.00 0.00 N ATOM 0 H LYS A 69 -6.878 -6.759 -6.818 1.00 0.00 H new ATOM 0 HA LYS A 69 -8.522 -9.107 -7.549 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -6.400 -8.227 -5.692 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -7.655 -9.092 -4.827 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -7.489 -10.856 -6.778 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -5.967 -10.078 -7.162 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -4.930 -10.810 -5.204 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -6.407 -10.737 -4.263 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -6.988 -12.927 -4.786 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -6.506 -12.757 -6.463 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -4.948 -14.191 -5.244 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -4.161 -12.779 -5.763 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -4.628 -12.943 -4.138 1.00 0.00 H new ATOM 1310 N LYS B 13 -15.898 5.683 3.732 1.00 0.00 N ATOM 1311 CA LYS B 13 -15.589 6.210 2.376 1.00 0.00 C ATOM 1312 C LYS B 13 -14.076 6.191 2.143 1.00 0.00 C ATOM 1313 O LYS B 13 -13.311 5.798 3.002 1.00 0.00 O ATOM 1314 CB LYS B 13 -16.107 7.649 2.381 1.00 0.00 C ATOM 1315 CG LYS B 13 -15.891 8.276 3.761 1.00 0.00 C ATOM 1316 CD LYS B 13 -15.595 9.769 3.601 1.00 0.00 C ATOM 1317 CE LYS B 13 -16.745 10.442 2.849 1.00 0.00 C ATOM 1318 NZ LYS B 13 -16.085 11.348 1.867 1.00 0.00 N ATOM 0 HA LYS B 13 -16.047 5.615 1.586 1.00 0.00 H new ATOM 0 HB2 LYS B 13 -15.589 8.234 1.621 1.00 0.00 H new ATOM 0 HB3 LYS B 13 -17.167 7.664 2.127 1.00 0.00 H new ATOM 0 HG2 LYS B 13 -16.777 8.134 4.380 1.00 0.00 H new ATOM 0 HG3 LYS B 13 -15.064 7.783 4.271 1.00 0.00 H new ATOM 0 HD2 LYS B 13 -15.467 10.232 4.580 1.00 0.00 H new ATOM 0 HD3 LYS B 13 -14.661 9.909 3.058 1.00 0.00 H new ATOM 0 HE2 LYS B 13 -17.373 9.706 2.347 1.00 0.00 H new ATOM 0 HE3 LYS B 13 -17.389 10.999 3.529 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 -16.810 11.846 1.312 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 -15.500 12.042 2.374 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 -15.484 10.789 1.228 1.00 0.00 H new ATOM 1332 N THR B 14 -13.636 6.615 0.990 1.00 0.00 N ATOM 1333 CA THR B 14 -12.175 6.624 0.707 1.00 0.00 C ATOM 1334 C THR B 14 -11.841 7.742 -0.281 1.00 0.00 C ATOM 1335 O THR B 14 -12.691 8.211 -1.012 1.00 0.00 O ATOM 1336 CB THR B 14 -11.887 5.264 0.084 1.00 0.00 C ATOM 1337 OG1 THR B 14 -13.097 4.695 -0.397 1.00 0.00 O ATOM 1338 CG2 THR B 14 -11.266 4.340 1.133 1.00 0.00 C ATOM 0 H THR B 14 -14.227 6.956 0.232 1.00 0.00 H new ATOM 0 HA THR B 14 -11.580 6.798 1.604 1.00 0.00 H new ATOM 0 HB THR B 14 -11.191 5.387 -0.746 1.00 0.00 H new ATOM 0 HG1 THR B 14 -12.910 3.821 -0.799 1.00 0.00 H new ATOM 0 HG21 THR B 14 -11.061 3.368 0.685 1.00 0.00 H new ATOM 0 HG22 THR B 14 -10.335 4.776 1.497 1.00 0.00 H new ATOM 0 HG23 THR B 14 -11.959 4.217 1.966 1.00 0.00 H new ATOM 1346 N LEU B 15 -10.612 8.174 -0.309 1.00 0.00 N ATOM 1347 CA LEU B 15 -10.229 9.260 -1.249 1.00 0.00 C ATOM 1348 C LEU B 15 -9.531 8.680 -2.475 1.00 0.00 C ATOM 1349 O LEU B 15 -8.816 7.702 -2.383 1.00 0.00 O ATOM 1350 CB LEU B 15 -9.267 10.137 -0.460 1.00 0.00 C ATOM 1351 CG LEU B 15 -10.015 10.789 0.698 1.00 0.00 C ATOM 1352 CD1 LEU B 15 -9.438 10.296 2.026 1.00 0.00 C ATOM 1353 CD2 LEU B 15 -9.862 12.308 0.609 1.00 0.00 C ATOM 0 H LEU B 15 -9.857 7.821 0.279 1.00 0.00 H new ATOM 0 HA LEU B 15 -11.094 9.816 -1.610 1.00 0.00 H new ATOM 0 HB2 LEU B 15 -8.438 9.539 -0.082 1.00 0.00 H new ATOM 0 HB3 LEU B 15 -8.839 10.902 -1.108 1.00 0.00 H new ATOM 0 HG LEU B 15 -11.071 10.523 0.643 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -9.974 10.764 2.852 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -9.546 9.213 2.090 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -8.382 10.559 2.084 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -10.396 12.777 1.436 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -8.806 12.571 0.664 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -10.275 12.661 -0.336 1.00 0.00 H new ATOM 1365 N PRO B 16 -9.758 9.315 -3.586 1.00 0.00 N ATOM 1366 CA PRO B 16 -9.143 8.878 -4.850 1.00 0.00 C ATOM 1367 C PRO B 16 -7.728 9.445 -4.950 1.00 0.00 C ATOM 1368 O PRO B 16 -6.951 9.061 -5.798 1.00 0.00 O ATOM 1369 CB PRO B 16 -10.050 9.492 -5.912 1.00 0.00 C ATOM 1370 CG PRO B 16 -10.686 10.682 -5.260 1.00 0.00 C ATOM 1371 CD PRO B 16 -10.607 10.494 -3.764 1.00 0.00 C ATOM 0 HA PRO B 16 -9.056 7.796 -4.948 1.00 0.00 H new ATOM 0 HB2 PRO B 16 -9.479 9.786 -6.793 1.00 0.00 H new ATOM 0 HB3 PRO B 16 -10.803 8.778 -6.244 1.00 0.00 H new ATOM 0 HG2 PRO B 16 -10.174 11.598 -5.556 1.00 0.00 H new ATOM 0 HG3 PRO B 16 -11.724 10.780 -5.577 1.00 0.00 H new ATOM 0 HD2 PRO B 16 -10.178 11.369 -3.276 1.00 0.00 H new ATOM 0 HD3 PRO B 16 -11.595 10.340 -3.331 1.00 0.00 H new ATOM 1379 N ARG B 17 -7.395 10.368 -4.091 1.00 0.00 N ATOM 1380 CA ARG B 17 -6.039 10.980 -4.137 1.00 0.00 C ATOM 1381 C ARG B 17 -5.841 11.889 -2.919 1.00 0.00 C ATOM 1382 O ARG B 17 -5.812 13.099 -3.033 1.00 0.00 O ATOM 1383 CB ARG B 17 -6.044 11.800 -5.428 1.00 0.00 C ATOM 1384 CG ARG B 17 -4.802 12.688 -5.479 1.00 0.00 C ATOM 1385 CD ARG B 17 -5.151 14.018 -6.150 1.00 0.00 C ATOM 1386 NE ARG B 17 -5.225 15.003 -5.036 1.00 0.00 N ATOM 1387 CZ ARG B 17 -5.885 16.118 -5.192 1.00 0.00 C ATOM 1388 NH1 ARG B 17 -6.351 16.443 -6.366 1.00 0.00 N ATOM 1389 NH2 ARG B 17 -6.079 16.909 -4.171 1.00 0.00 N ATOM 0 H ARG B 17 -8.006 10.726 -3.357 1.00 0.00 H new ATOM 0 HA ARG B 17 -5.235 10.244 -4.118 1.00 0.00 H new ATOM 0 HB2 ARG B 17 -6.064 11.136 -6.292 1.00 0.00 H new ATOM 0 HB3 ARG B 17 -6.944 12.413 -5.477 1.00 0.00 H new ATOM 0 HG2 ARG B 17 -4.427 12.865 -4.471 1.00 0.00 H new ATOM 0 HG3 ARG B 17 -4.007 12.188 -6.032 1.00 0.00 H new ATOM 0 HD2 ARG B 17 -4.393 14.303 -6.879 1.00 0.00 H new ATOM 0 HD3 ARG B 17 -6.099 13.954 -6.684 1.00 0.00 H new ATOM 0 HE ARG B 17 -4.759 14.806 -4.150 1.00 0.00 H new ATOM 0 HH11 ARG B 17 -6.200 15.825 -7.164 1.00 0.00 H new ATOM 0 HH12 ARG B 17 -6.867 17.315 -6.487 1.00 0.00 H new ATOM 0 HH21 ARG B 17 -5.715 16.655 -3.253 1.00 0.00 H new ATOM 0 HH22 ARG B 17 -6.595 17.781 -4.292 1.00 0.00 H new ATOM 1403 N VAL B 18 -5.701 11.315 -1.757 1.00 0.00 N ATOM 1404 CA VAL B 18 -5.494 12.149 -0.532 1.00 0.00 C ATOM 1405 C VAL B 18 -4.422 13.200 -0.810 1.00 0.00 C ATOM 1406 O VAL B 18 -3.876 13.249 -1.890 1.00 0.00 O ATOM 1407 CB VAL B 18 -5.020 11.166 0.537 1.00 0.00 C ATOM 1408 CG1 VAL B 18 -4.990 11.866 1.892 1.00 0.00 C ATOM 1409 CG2 VAL B 18 -5.982 9.979 0.603 1.00 0.00 C ATOM 0 H VAL B 18 -5.720 10.308 -1.599 1.00 0.00 H new ATOM 0 HA VAL B 18 -6.395 12.677 -0.222 1.00 0.00 H new ATOM 0 HB VAL B 18 -4.020 10.811 0.285 1.00 0.00 H new ATOM 0 HG11 VAL B 18 -4.652 11.166 2.656 1.00 0.00 H new ATOM 0 HG12 VAL B 18 -4.306 12.714 1.849 1.00 0.00 H new ATOM 0 HG13 VAL B 18 -5.991 12.220 2.141 1.00 0.00 H new ATOM 0 HG21 VAL B 18 -5.643 9.278 1.366 1.00 0.00 H new ATOM 0 HG22 VAL B 18 -6.981 10.334 0.855 1.00 0.00 H new ATOM 0 HG23 VAL B 18 -6.008 9.478 -0.364 1.00 0.00 H new ATOM 1419 N ASP B 19 -4.104 14.029 0.151 1.00 0.00 N ATOM 1420 CA ASP B 19 -3.048 15.049 -0.084 1.00 0.00 C ATOM 1421 C ASP B 19 -1.847 14.338 -0.706 1.00 0.00 C ATOM 1422 O ASP B 19 -0.816 14.150 -0.091 1.00 0.00 O ATOM 1423 CB ASP B 19 -2.728 15.589 1.304 1.00 0.00 C ATOM 1424 CG ASP B 19 -1.808 16.804 1.186 1.00 0.00 C ATOM 1425 OD1 ASP B 19 -1.289 17.028 0.104 1.00 0.00 O ATOM 1426 OD2 ASP B 19 -1.637 17.493 2.179 1.00 0.00 O ATOM 0 H ASP B 19 -4.527 14.042 1.079 1.00 0.00 H new ATOM 0 HA ASP B 19 -3.338 15.857 -0.756 1.00 0.00 H new ATOM 0 HB2 ASP B 19 -3.648 15.867 1.818 1.00 0.00 H new ATOM 0 HB3 ASP B 19 -2.249 14.815 1.904 1.00 0.00 H new ATOM 1431 N PHE B 20 -2.019 13.902 -1.916 1.00 0.00 N ATOM 1432 CA PHE B 20 -0.967 13.143 -2.634 1.00 0.00 C ATOM 1433 C PHE B 20 0.442 13.607 -2.297 1.00 0.00 C ATOM 1434 O PHE B 20 1.166 12.945 -1.583 1.00 0.00 O ATOM 1435 CB PHE B 20 -1.266 13.374 -4.108 1.00 0.00 C ATOM 1436 CG PHE B 20 -1.171 12.055 -4.804 1.00 0.00 C ATOM 1437 CD1 PHE B 20 -2.279 11.206 -4.844 1.00 0.00 C ATOM 1438 CD2 PHE B 20 0.034 11.670 -5.386 1.00 0.00 C ATOM 1439 CE1 PHE B 20 -2.182 9.965 -5.470 1.00 0.00 C ATOM 1440 CE2 PHE B 20 0.136 10.433 -6.014 1.00 0.00 C ATOM 1441 CZ PHE B 20 -0.976 9.576 -6.056 1.00 0.00 C ATOM 0 H PHE B 20 -2.873 14.045 -2.454 1.00 0.00 H new ATOM 0 HA PHE B 20 -0.989 12.091 -2.349 1.00 0.00 H new ATOM 0 HB2 PHE B 20 -2.261 13.802 -4.234 1.00 0.00 H new ATOM 0 HB3 PHE B 20 -0.557 14.084 -4.535 1.00 0.00 H new ATOM 0 HD1 PHE B 20 -3.210 11.511 -4.390 1.00 0.00 H new ATOM 0 HD2 PHE B 20 0.888 12.331 -5.350 1.00 0.00 H new ATOM 0 HE1 PHE B 20 -3.037 9.306 -5.502 1.00 0.00 H new ATOM 0 HE2 PHE B 20 1.068 10.132 -6.468 1.00 0.00 H new ATOM 0 HZ PHE B 20 -0.898 8.615 -6.542 1.00 0.00 H new ATOM 1451 N LYS B 21 0.856 14.711 -2.831 1.00 0.00 N ATOM 1452 CA LYS B 21 2.240 15.175 -2.560 1.00 0.00 C ATOM 1453 C LYS B 21 2.595 14.942 -1.087 1.00 0.00 C ATOM 1454 O LYS B 21 3.749 14.808 -0.730 1.00 0.00 O ATOM 1455 CB LYS B 21 2.238 16.667 -2.890 1.00 0.00 C ATOM 1456 CG LYS B 21 1.774 16.869 -4.334 1.00 0.00 C ATOM 1457 CD LYS B 21 2.256 18.232 -4.837 1.00 0.00 C ATOM 1458 CE LYS B 21 3.207 18.032 -6.019 1.00 0.00 C ATOM 1459 NZ LYS B 21 2.442 18.495 -7.209 1.00 0.00 N ATOM 0 H LYS B 21 0.302 15.312 -3.441 1.00 0.00 H new ATOM 0 HA LYS B 21 2.979 14.636 -3.152 1.00 0.00 H new ATOM 0 HB2 LYS B 21 1.578 17.201 -2.206 1.00 0.00 H new ATOM 0 HB3 LYS B 21 3.237 17.081 -2.756 1.00 0.00 H new ATOM 0 HG2 LYS B 21 2.168 16.075 -4.969 1.00 0.00 H new ATOM 0 HG3 LYS B 21 0.687 16.812 -4.390 1.00 0.00 H new ATOM 0 HD2 LYS B 21 1.405 18.841 -5.140 1.00 0.00 H new ATOM 0 HD3 LYS B 21 2.763 18.769 -4.035 1.00 0.00 H new ATOM 0 HE2 LYS B 21 4.124 18.608 -5.890 1.00 0.00 H new ATOM 0 HE3 LYS B 21 3.498 16.986 -6.119 1.00 0.00 H new ATOM 0 HZ1 LYS B 21 3.028 18.389 -8.061 1.00 0.00 H new ATOM 0 HZ2 LYS B 21 1.578 17.925 -7.310 1.00 0.00 H new ATOM 0 HZ3 LYS B 21 2.184 19.495 -7.088 1.00 0.00 H new ATOM 1473 N ASN B 22 1.610 14.887 -0.229 1.00 0.00 N ATOM 1474 CA ASN B 22 1.885 14.660 1.216 1.00 0.00 C ATOM 1475 C ASN B 22 1.883 13.164 1.527 1.00 0.00 C ATOM 1476 O ASN B 22 2.509 12.714 2.465 1.00 0.00 O ATOM 1477 CB ASN B 22 0.732 15.341 1.939 1.00 0.00 C ATOM 1478 CG ASN B 22 1.280 16.246 3.044 1.00 0.00 C ATOM 1479 OD1 ASN B 22 2.455 16.553 3.068 1.00 0.00 O ATOM 1480 ND2 ASN B 22 0.472 16.690 3.967 1.00 0.00 N ATOM 0 H ASN B 22 0.624 14.990 -0.470 1.00 0.00 H new ATOM 0 HA ASN B 22 2.857 15.050 1.517 1.00 0.00 H new ATOM 0 HB2 ASN B 22 0.143 15.927 1.234 1.00 0.00 H new ATOM 0 HB3 ASN B 22 0.065 14.592 2.366 1.00 0.00 H new ATOM 0 HD21 ASN B 22 0.827 17.294 4.708 1.00 0.00 H new ATOM 0 HD22 ASN B 22 -0.515 16.433 3.948 1.00 0.00 H new ATOM 1487 N ILE B 23 1.170 12.395 0.750 1.00 0.00 N ATOM 1488 CA ILE B 23 1.109 10.929 1.001 1.00 0.00 C ATOM 1489 C ILE B 23 2.467 10.414 1.496 1.00 0.00 C ATOM 1490 O ILE B 23 3.435 10.371 0.763 1.00 0.00 O ATOM 1491 CB ILE B 23 0.730 10.311 -0.353 1.00 0.00 C ATOM 1492 CG1 ILE B 23 -0.630 9.622 -0.230 1.00 0.00 C ATOM 1493 CG2 ILE B 23 1.778 9.284 -0.785 1.00 0.00 C ATOM 1494 CD1 ILE B 23 -1.706 10.665 0.073 1.00 0.00 C ATOM 0 H ILE B 23 0.626 12.721 -0.049 1.00 0.00 H new ATOM 0 HA ILE B 23 0.387 10.667 1.774 1.00 0.00 H new ATOM 0 HB ILE B 23 0.683 11.103 -1.101 1.00 0.00 H new ATOM 0 HG12 ILE B 23 -0.868 9.097 -1.155 1.00 0.00 H new ATOM 0 HG13 ILE B 23 -0.600 8.874 0.563 1.00 0.00 H new ATOM 0 HG21 ILE B 23 1.494 8.856 -1.746 1.00 0.00 H new ATOM 0 HG22 ILE B 23 2.749 9.771 -0.878 1.00 0.00 H new ATOM 0 HG23 ILE B 23 1.840 8.491 -0.039 1.00 0.00 H new ATOM 0 HD11 ILE B 23 -2.675 10.173 0.160 1.00 0.00 H new ATOM 0 HD12 ILE B 23 -1.470 11.170 1.009 1.00 0.00 H new ATOM 0 HD13 ILE B 23 -1.742 11.396 -0.735 1.00 0.00 H new ATOM 1506 N GLN B 24 2.543 10.028 2.741 1.00 0.00 N ATOM 1507 CA GLN B 24 3.835 9.519 3.291 1.00 0.00 C ATOM 1508 C GLN B 24 3.817 7.991 3.366 1.00 0.00 C ATOM 1509 O GLN B 24 4.814 7.364 3.662 1.00 0.00 O ATOM 1510 CB GLN B 24 3.939 10.124 4.691 1.00 0.00 C ATOM 1511 CG GLN B 24 5.368 9.961 5.213 1.00 0.00 C ATOM 1512 CD GLN B 24 5.340 9.781 6.731 1.00 0.00 C ATOM 1513 OE1 GLN B 24 5.242 8.674 7.223 1.00 0.00 O ATOM 1514 NE2 GLN B 24 5.424 10.831 7.502 1.00 0.00 N ATOM 0 H GLN B 24 1.767 10.043 3.402 1.00 0.00 H new ATOM 0 HA GLN B 24 4.684 9.794 2.665 1.00 0.00 H new ATOM 0 HB2 GLN B 24 3.669 11.180 4.663 1.00 0.00 H new ATOM 0 HB3 GLN B 24 3.236 9.633 5.364 1.00 0.00 H new ATOM 0 HG2 GLN B 24 5.842 9.099 4.743 1.00 0.00 H new ATOM 0 HG3 GLN B 24 5.964 10.835 4.951 1.00 0.00 H new ATOM 0 HE21 GLN B 24 5.506 11.761 7.090 1.00 0.00 H new ATOM 0 HE22 GLN B 24 5.407 10.722 8.516 1.00 0.00 H new ATOM 1523 N SER B 25 2.695 7.386 3.096 1.00 0.00 N ATOM 1524 CA SER B 25 2.619 5.900 3.147 1.00 0.00 C ATOM 1525 C SER B 25 1.289 5.423 2.562 1.00 0.00 C ATOM 1526 O SER B 25 0.233 5.876 2.950 1.00 0.00 O ATOM 1527 CB SER B 25 2.711 5.542 4.629 1.00 0.00 C ATOM 1528 OG SER B 25 1.424 5.663 5.221 1.00 0.00 O ATOM 0 H SER B 25 1.826 7.857 2.842 1.00 0.00 H new ATOM 0 HA SER B 25 3.412 5.427 2.568 1.00 0.00 H new ATOM 0 HB2 SER B 25 3.084 4.525 4.747 1.00 0.00 H new ATOM 0 HB3 SER B 25 3.419 6.201 5.131 1.00 0.00 H new ATOM 0 HG SER B 25 0.815 6.103 4.592 1.00 0.00 H new ATOM 1534 N LEU B 26 1.330 4.513 1.632 1.00 0.00 N ATOM 1535 CA LEU B 26 0.063 4.016 1.026 1.00 0.00 C ATOM 1536 C LEU B 26 -0.179 2.561 1.424 1.00 0.00 C ATOM 1537 O LEU B 26 0.742 1.778 1.531 1.00 0.00 O ATOM 1538 CB LEU B 26 0.278 4.122 -0.486 1.00 0.00 C ATOM 1539 CG LEU B 26 -0.069 5.532 -0.962 1.00 0.00 C ATOM 1540 CD1 LEU B 26 -1.587 5.662 -1.111 1.00 0.00 C ATOM 1541 CD2 LEU B 26 0.435 6.554 0.058 1.00 0.00 C ATOM 0 H LEU B 26 2.183 4.092 1.265 1.00 0.00 H new ATOM 0 HA LEU B 26 -0.803 4.588 1.359 1.00 0.00 H new ATOM 0 HB2 LEU B 26 1.314 3.890 -0.732 1.00 0.00 H new ATOM 0 HB3 LEU B 26 -0.344 3.391 -1.003 1.00 0.00 H new ATOM 0 HG LEU B 26 0.406 5.717 -1.925 1.00 0.00 H new ATOM 0 HD11 LEU B 26 -1.834 6.668 -1.451 1.00 0.00 H new ATOM 0 HD12 LEU B 26 -1.945 4.935 -1.840 1.00 0.00 H new ATOM 0 HD13 LEU B 26 -2.064 5.476 -0.149 1.00 0.00 H new ATOM 0 HD21 LEU B 26 0.187 7.560 -0.282 1.00 0.00 H new ATOM 0 HD22 LEU B 26 -0.039 6.370 1.022 1.00 0.00 H new ATOM 0 HD23 LEU B 26 1.516 6.462 0.162 1.00 0.00 H new ATOM 1553 N SER B 27 -1.411 2.192 1.643 1.00 0.00 N ATOM 1554 CA SER B 27 -1.706 0.785 2.029 1.00 0.00 C ATOM 1555 C SER B 27 -2.914 0.265 1.245 1.00 0.00 C ATOM 1556 O SER B 27 -3.780 1.017 0.849 1.00 0.00 O ATOM 1557 CB SER B 27 -2.017 0.844 3.522 1.00 0.00 C ATOM 1558 OG SER B 27 -1.168 -0.064 4.214 1.00 0.00 O ATOM 0 H SER B 27 -2.224 2.803 1.571 1.00 0.00 H new ATOM 0 HA SER B 27 -0.876 0.112 1.813 1.00 0.00 H new ATOM 0 HB2 SER B 27 -1.868 1.857 3.897 1.00 0.00 H new ATOM 0 HB3 SER B 27 -3.062 0.589 3.698 1.00 0.00 H new ATOM 0 HG SER B 27 -0.232 0.181 4.059 1.00 0.00 H new ATOM 1564 N VAL B 28 -2.977 -1.017 1.015 1.00 0.00 N ATOM 1565 CA VAL B 28 -4.131 -1.580 0.256 1.00 0.00 C ATOM 1566 C VAL B 28 -4.596 -2.886 0.905 1.00 0.00 C ATOM 1567 O VAL B 28 -3.873 -3.860 0.950 1.00 0.00 O ATOM 1568 CB VAL B 28 -3.591 -1.840 -1.151 1.00 0.00 C ATOM 1569 CG1 VAL B 28 -4.495 -2.842 -1.872 1.00 0.00 C ATOM 1570 CG2 VAL B 28 -3.564 -0.526 -1.934 1.00 0.00 C ATOM 0 H VAL B 28 -2.282 -1.699 1.319 1.00 0.00 H new ATOM 0 HA VAL B 28 -4.988 -0.907 0.243 1.00 0.00 H new ATOM 0 HB VAL B 28 -2.582 -2.247 -1.082 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -4.108 -3.025 -2.874 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -4.517 -3.778 -1.315 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -5.505 -2.437 -1.941 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -3.179 -0.708 -2.937 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -4.574 -0.121 -2.000 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -2.919 0.189 -1.423 1.00 0.00 H new ATOM 1580 N THR B 29 -5.799 -2.916 1.404 1.00 0.00 N ATOM 1581 CA THR B 29 -6.303 -4.161 2.045 1.00 0.00 C ATOM 1582 C THR B 29 -7.582 -4.614 1.344 1.00 0.00 C ATOM 1583 O THR B 29 -8.404 -3.803 0.966 1.00 0.00 O ATOM 1584 CB THR B 29 -6.590 -3.771 3.494 1.00 0.00 C ATOM 1585 OG1 THR B 29 -7.130 -4.888 4.186 1.00 0.00 O ATOM 1586 CG2 THR B 29 -7.589 -2.614 3.526 1.00 0.00 C ATOM 0 H THR B 29 -6.454 -2.134 1.396 1.00 0.00 H new ATOM 0 HA THR B 29 -5.592 -4.985 1.984 1.00 0.00 H new ATOM 0 HB THR B 29 -5.664 -3.459 3.976 1.00 0.00 H new ATOM 0 HG1 THR B 29 -7.313 -4.639 5.116 1.00 0.00 H new ATOM 0 HG21 THR B 29 -7.792 -2.337 4.561 1.00 0.00 H new ATOM 0 HG22 THR B 29 -7.171 -1.758 2.997 1.00 0.00 H new ATOM 0 HG23 THR B 29 -8.517 -2.921 3.043 1.00 0.00 H new ATOM 1594 N PRO B 30 -7.702 -5.898 1.186 1.00 0.00 N ATOM 1595 CA PRO B 30 -8.889 -6.469 0.512 1.00 0.00 C ATOM 1596 C PRO B 30 -10.138 -6.288 1.375 1.00 0.00 C ATOM 1597 O PRO B 30 -10.061 -5.849 2.506 1.00 0.00 O ATOM 1598 CB PRO B 30 -8.536 -7.946 0.350 1.00 0.00 C ATOM 1599 CG PRO B 30 -7.529 -8.213 1.423 1.00 0.00 C ATOM 1600 CD PRO B 30 -6.757 -6.935 1.613 1.00 0.00 C ATOM 0 HA PRO B 30 -9.114 -5.987 -0.439 1.00 0.00 H new ATOM 0 HB2 PRO B 30 -9.416 -8.579 0.466 1.00 0.00 H new ATOM 0 HB3 PRO B 30 -8.125 -8.149 -0.639 1.00 0.00 H new ATOM 0 HG2 PRO B 30 -8.019 -8.511 2.350 1.00 0.00 H new ATOM 0 HG3 PRO B 30 -6.865 -9.029 1.137 1.00 0.00 H new ATOM 0 HD2 PRO B 30 -6.454 -6.799 2.651 1.00 0.00 H new ATOM 0 HD3 PRO B 30 -5.848 -6.922 1.012 1.00 0.00 H new ATOM 1608 N PRO B 31 -11.254 -6.620 0.793 1.00 0.00 N ATOM 1609 CA PRO B 31 -12.552 -6.481 1.491 1.00 0.00 C ATOM 1610 C PRO B 31 -12.782 -7.619 2.490 1.00 0.00 C ATOM 1611 O PRO B 31 -11.889 -8.383 2.801 1.00 0.00 O ATOM 1612 CB PRO B 31 -13.568 -6.554 0.358 1.00 0.00 C ATOM 1613 CG PRO B 31 -12.893 -7.326 -0.733 1.00 0.00 C ATOM 1614 CD PRO B 31 -11.406 -7.149 -0.565 1.00 0.00 C ATOM 0 HA PRO B 31 -12.614 -5.563 2.075 1.00 0.00 H new ATOM 0 HB2 PRO B 31 -14.483 -7.050 0.682 1.00 0.00 H new ATOM 0 HB3 PRO B 31 -13.849 -5.557 0.018 1.00 0.00 H new ATOM 0 HG2 PRO B 31 -13.161 -8.381 -0.678 1.00 0.00 H new ATOM 0 HG3 PRO B 31 -13.213 -6.966 -1.711 1.00 0.00 H new ATOM 0 HD2 PRO B 31 -10.877 -8.095 -0.685 1.00 0.00 H new ATOM 0 HD3 PRO B 31 -11.001 -6.461 -1.307 1.00 0.00 H new ATOM 1697 N THR B 38 -12.914 -3.397 -1.815 1.00 0.00 N ATOM 1698 CA THR B 38 -11.450 -3.157 -1.631 1.00 0.00 C ATOM 1699 C THR B 38 -11.236 -1.819 -0.923 1.00 0.00 C ATOM 1700 O THR B 38 -11.969 -0.875 -1.137 1.00 0.00 O ATOM 1701 CB THR B 38 -10.867 -3.114 -3.047 1.00 0.00 C ATOM 1702 OG1 THR B 38 -11.847 -3.555 -3.975 1.00 0.00 O ATOM 1703 CG2 THR B 38 -9.637 -4.025 -3.130 1.00 0.00 C ATOM 0 HA THR B 38 -10.974 -3.928 -1.025 1.00 0.00 H new ATOM 0 HB THR B 38 -10.573 -2.092 -3.284 1.00 0.00 H new ATOM 0 HG1 THR B 38 -12.585 -3.983 -3.493 1.00 0.00 H new ATOM 0 HG21 THR B 38 -9.226 -3.991 -4.139 1.00 0.00 H new ATOM 0 HG22 THR B 38 -8.883 -3.685 -2.420 1.00 0.00 H new ATOM 0 HG23 THR B 38 -9.925 -5.048 -2.890 1.00 0.00 H new ATOM 1711 N GLU B 39 -10.248 -1.725 -0.076 1.00 0.00 N ATOM 1712 CA GLU B 39 -10.021 -0.437 0.637 1.00 0.00 C ATOM 1713 C GLU B 39 -8.532 -0.103 0.698 1.00 0.00 C ATOM 1714 O GLU B 39 -7.685 -0.975 0.673 1.00 0.00 O ATOM 1715 CB GLU B 39 -10.569 -0.663 2.042 1.00 0.00 C ATOM 1716 CG GLU B 39 -11.092 0.661 2.591 1.00 0.00 C ATOM 1717 CD GLU B 39 -11.319 0.540 4.099 1.00 0.00 C ATOM 1718 OE1 GLU B 39 -12.225 -0.179 4.487 1.00 0.00 O ATOM 1719 OE2 GLU B 39 -10.583 1.171 4.841 1.00 0.00 O ATOM 0 H GLU B 39 -9.595 -2.475 0.151 1.00 0.00 H new ATOM 0 HA GLU B 39 -10.507 0.397 0.130 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -11.369 -1.403 2.019 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -9.788 -1.058 2.692 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -10.379 1.459 2.384 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -12.024 0.929 2.094 1.00 0.00 H new ATOM 1726 N VAL B 40 -8.205 1.159 0.780 1.00 0.00 N ATOM 1727 CA VAL B 40 -6.770 1.553 0.845 1.00 0.00 C ATOM 1728 C VAL B 40 -6.520 2.456 2.058 1.00 0.00 C ATOM 1729 O VAL B 40 -7.430 3.048 2.604 1.00 0.00 O ATOM 1730 CB VAL B 40 -6.521 2.321 -0.454 1.00 0.00 C ATOM 1731 CG1 VAL B 40 -5.076 2.823 -0.495 1.00 0.00 C ATOM 1732 CG2 VAL B 40 -6.768 1.392 -1.642 1.00 0.00 C ATOM 0 H VAL B 40 -8.870 1.932 0.805 1.00 0.00 H new ATOM 0 HA VAL B 40 -6.108 0.694 0.951 1.00 0.00 H new ATOM 0 HB VAL B 40 -7.197 3.174 -0.503 1.00 0.00 H new ATOM 0 HG11 VAL B 40 -4.907 3.369 -1.423 1.00 0.00 H new ATOM 0 HG12 VAL B 40 -4.896 3.484 0.353 1.00 0.00 H new ATOM 0 HG13 VAL B 40 -4.394 1.974 -0.444 1.00 0.00 H new ATOM 0 HG21 VAL B 40 -6.592 1.934 -2.571 1.00 0.00 H new ATOM 0 HG22 VAL B 40 -6.090 0.540 -1.585 1.00 0.00 H new ATOM 0 HG23 VAL B 40 -7.799 1.038 -1.619 1.00 0.00 H new ATOM 1742 N ILE B 41 -5.290 2.573 2.472 1.00 0.00 N ATOM 1743 CA ILE B 41 -4.965 3.449 3.633 1.00 0.00 C ATOM 1744 C ILE B 41 -3.753 4.307 3.278 1.00 0.00 C ATOM 1745 O ILE B 41 -2.676 3.802 3.029 1.00 0.00 O ATOM 1746 CB ILE B 41 -4.638 2.499 4.785 1.00 0.00 C ATOM 1747 CG1 ILE B 41 -5.583 1.296 4.745 1.00 0.00 C ATOM 1748 CG2 ILE B 41 -4.807 3.233 6.116 1.00 0.00 C ATOM 1749 CD1 ILE B 41 -5.192 0.301 5.839 1.00 0.00 C ATOM 0 H ILE B 41 -4.491 2.097 2.054 1.00 0.00 H new ATOM 0 HA ILE B 41 -5.782 4.119 3.900 1.00 0.00 H new ATOM 0 HB ILE B 41 -3.609 2.154 4.686 1.00 0.00 H new ATOM 0 HG12 ILE B 41 -6.612 1.624 4.889 1.00 0.00 H new ATOM 0 HG13 ILE B 41 -5.535 0.815 3.768 1.00 0.00 H new ATOM 0 HG21 ILE B 41 -4.574 2.555 6.937 1.00 0.00 H new ATOM 0 HG22 ILE B 41 -4.132 4.088 6.148 1.00 0.00 H new ATOM 0 HG23 ILE B 41 -5.836 3.579 6.212 1.00 0.00 H new ATOM 0 HD11 ILE B 41 -5.866 -0.555 5.810 1.00 0.00 H new ATOM 0 HD12 ILE B 41 -4.169 -0.037 5.675 1.00 0.00 H new ATOM 0 HD13 ILE B 41 -5.263 0.785 6.813 1.00 0.00 H new ATOM 1761 N ALA B 42 -3.923 5.596 3.226 1.00 0.00 N ATOM 1762 CA ALA B 42 -2.780 6.473 2.854 1.00 0.00 C ATOM 1763 C ALA B 42 -2.487 7.499 3.947 1.00 0.00 C ATOM 1764 O ALA B 42 -3.381 8.092 4.518 1.00 0.00 O ATOM 1765 CB ALA B 42 -3.244 7.175 1.581 1.00 0.00 C ATOM 0 H ALA B 42 -4.799 6.079 3.424 1.00 0.00 H new ATOM 0 HA ALA B 42 -1.859 5.906 2.717 1.00 0.00 H new ATOM 0 HB1 ALA B 42 -2.461 7.847 1.230 1.00 0.00 H new ATOM 0 HB2 ALA B 42 -3.456 6.432 0.812 1.00 0.00 H new ATOM 0 HB3 ALA B 42 -4.147 7.748 1.790 1.00 0.00 H new ATOM 1771 N THR B 43 -1.233 7.729 4.220 1.00 0.00 N ATOM 1772 CA THR B 43 -0.860 8.734 5.253 1.00 0.00 C ATOM 1773 C THR B 43 -0.245 9.946 4.558 1.00 0.00 C ATOM 1774 O THR B 43 0.293 9.838 3.478 1.00 0.00 O ATOM 1775 CB THR B 43 0.175 8.045 6.144 1.00 0.00 C ATOM 1776 OG1 THR B 43 -0.439 6.961 6.828 1.00 0.00 O ATOM 1777 CG2 THR B 43 0.728 9.051 7.159 1.00 0.00 C ATOM 0 H THR B 43 -0.447 7.261 3.769 1.00 0.00 H new ATOM 0 HA THR B 43 -1.714 9.076 5.837 1.00 0.00 H new ATOM 0 HB THR B 43 0.993 7.668 5.530 1.00 0.00 H new ATOM 0 HG1 THR B 43 -0.035 6.118 6.534 1.00 0.00 H new ATOM 0 HG21 THR B 43 1.465 8.560 7.794 1.00 0.00 H new ATOM 0 HG22 THR B 43 1.199 9.880 6.630 1.00 0.00 H new ATOM 0 HG23 THR B 43 -0.087 9.430 7.776 1.00 0.00 H new ATOM 1785 N LEU B 44 -0.335 11.100 5.151 1.00 0.00 N ATOM 1786 CA LEU B 44 0.230 12.310 4.496 1.00 0.00 C ATOM 1787 C LEU B 44 1.482 12.796 5.226 1.00 0.00 C ATOM 1788 O LEU B 44 1.824 12.317 6.288 1.00 0.00 O ATOM 1789 CB LEU B 44 -0.882 13.341 4.606 1.00 0.00 C ATOM 1790 CG LEU B 44 -2.101 12.850 3.833 1.00 0.00 C ATOM 1791 CD1 LEU B 44 -3.169 13.939 3.828 1.00 0.00 C ATOM 1792 CD2 LEU B 44 -1.691 12.525 2.397 1.00 0.00 C ATOM 0 H LEU B 44 -0.774 11.259 6.058 1.00 0.00 H new ATOM 0 HA LEU B 44 0.534 12.120 3.467 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -1.141 13.503 5.652 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -0.546 14.299 4.209 1.00 0.00 H new ATOM 0 HG LEU B 44 -2.501 11.954 4.307 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -4.042 13.590 3.276 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -3.457 14.171 4.853 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -2.772 14.835 3.351 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -2.560 12.174 1.841 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -1.294 13.421 1.920 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -0.926 11.748 2.404 1.00 0.00 H new ATOM 1804 N LYS B 45 2.170 13.751 4.656 1.00 0.00 N ATOM 1805 CA LYS B 45 3.400 14.273 5.310 1.00 0.00 C ATOM 1806 C LYS B 45 3.035 15.349 6.333 1.00 0.00 C ATOM 1807 O LYS B 45 2.579 16.420 5.986 1.00 0.00 O ATOM 1808 CB LYS B 45 4.230 14.873 4.176 1.00 0.00 C ATOM 1809 CG LYS B 45 5.510 14.054 3.991 1.00 0.00 C ATOM 1810 CD LYS B 45 6.381 14.177 5.242 1.00 0.00 C ATOM 1811 CE LYS B 45 7.856 14.064 4.851 1.00 0.00 C ATOM 1812 NZ LYS B 45 8.572 13.787 6.128 1.00 0.00 N ATOM 0 H LYS B 45 1.931 14.190 3.767 1.00 0.00 H new ATOM 0 HA LYS B 45 3.945 13.495 5.845 1.00 0.00 H new ATOM 0 HB2 LYS B 45 3.652 14.878 3.252 1.00 0.00 H new ATOM 0 HB3 LYS B 45 4.479 15.910 4.402 1.00 0.00 H new ATOM 0 HG2 LYS B 45 5.262 13.008 3.809 1.00 0.00 H new ATOM 0 HG3 LYS B 45 6.058 14.408 3.118 1.00 0.00 H new ATOM 0 HD2 LYS B 45 6.196 15.132 5.734 1.00 0.00 H new ATOM 0 HD3 LYS B 45 6.122 13.395 5.956 1.00 0.00 H new ATOM 0 HE2 LYS B 45 8.013 13.263 4.129 1.00 0.00 H new ATOM 0 HE3 LYS B 45 8.214 14.984 4.389 1.00 0.00 H new ATOM 0 HZ1 LYS B 45 9.591 13.696 5.942 1.00 0.00 H new ATOM 0 HZ2 LYS B 45 8.410 14.569 6.794 1.00 0.00 H new ATOM 0 HZ3 LYS B 45 8.215 12.902 6.541 1.00 0.00 H new ATOM 1826 N GLY B 46 3.231 15.074 7.591 1.00 0.00 N ATOM 1827 CA GLY B 46 2.895 16.078 8.633 1.00 0.00 C ATOM 1828 C GLY B 46 2.096 15.410 9.753 1.00 0.00 C ATOM 1829 O GLY B 46 2.151 15.821 10.895 1.00 0.00 O ATOM 0 H GLY B 46 3.610 14.195 7.942 1.00 0.00 H new ATOM 0 HA2 GLY B 46 3.807 16.517 9.036 1.00 0.00 H new ATOM 0 HA3 GLY B 46 2.316 16.891 8.195 1.00 0.00 H new ATOM 1833 N GLY B 47 1.350 14.384 9.440 1.00 0.00 N ATOM 1834 CA GLY B 47 0.552 13.702 10.493 1.00 0.00 C ATOM 1835 C GLY B 47 -0.928 13.776 10.130 1.00 0.00 C ATOM 1836 O GLY B 47 -1.715 14.419 10.797 1.00 0.00 O ATOM 0 H GLY B 47 1.261 13.992 8.503 1.00 0.00 H new ATOM 0 HA2 GLY B 47 0.864 12.662 10.586 1.00 0.00 H new ATOM 0 HA3 GLY B 47 0.725 14.174 11.460 1.00 0.00 H new ATOM 1840 N GLN B 48 -1.309 13.118 9.076 1.00 0.00 N ATOM 1841 CA GLN B 48 -2.733 13.133 8.650 1.00 0.00 C ATOM 1842 C GLN B 48 -2.988 11.976 7.686 1.00 0.00 C ATOM 1843 O GLN B 48 -2.754 12.081 6.498 1.00 0.00 O ATOM 1844 CB GLN B 48 -2.926 14.476 7.944 1.00 0.00 C ATOM 1845 CG GLN B 48 -3.988 15.294 8.683 1.00 0.00 C ATOM 1846 CD GLN B 48 -4.587 16.331 7.732 1.00 0.00 C ATOM 1847 OE1 GLN B 48 -5.693 16.790 7.935 1.00 0.00 O ATOM 1848 NE2 GLN B 48 -3.898 16.722 6.695 1.00 0.00 N ATOM 0 H GLN B 48 -0.689 12.564 8.485 1.00 0.00 H new ATOM 0 HA GLN B 48 -3.423 13.018 9.486 1.00 0.00 H new ATOM 0 HB2 GLN B 48 -1.984 15.023 7.917 1.00 0.00 H new ATOM 0 HB3 GLN B 48 -3.231 14.315 6.910 1.00 0.00 H new ATOM 0 HG2 GLN B 48 -4.771 14.636 9.061 1.00 0.00 H new ATOM 0 HG3 GLN B 48 -3.544 15.790 9.546 1.00 0.00 H new ATOM 0 HE21 GLN B 48 -2.969 16.336 6.525 1.00 0.00 H new ATOM 0 HE22 GLN B 48 -4.288 17.413 6.055 1.00 0.00 H new ATOM 1857 N LYS B 49 -3.447 10.865 8.188 1.00 0.00 N ATOM 1858 CA LYS B 49 -3.695 9.699 7.300 1.00 0.00 C ATOM 1859 C LYS B 49 -5.188 9.452 7.132 1.00 0.00 C ATOM 1860 O LYS B 49 -6.017 10.058 7.780 1.00 0.00 O ATOM 1861 CB LYS B 49 -3.043 8.519 8.015 1.00 0.00 C ATOM 1862 CG LYS B 49 -3.434 7.202 7.341 1.00 0.00 C ATOM 1863 CD LYS B 49 -2.760 6.037 8.069 1.00 0.00 C ATOM 1864 CE LYS B 49 -3.757 5.397 9.039 1.00 0.00 C ATOM 1865 NZ LYS B 49 -3.283 3.995 9.210 1.00 0.00 N ATOM 0 H LYS B 49 -3.661 10.715 9.174 1.00 0.00 H new ATOM 0 HA LYS B 49 -3.291 9.857 6.300 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -1.959 8.633 8.003 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -3.351 8.505 9.061 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -4.517 7.079 7.360 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -3.133 7.214 6.294 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -2.411 5.297 7.349 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -1.884 6.391 8.612 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -3.776 5.926 9.992 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -4.770 5.425 8.639 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -3.963 3.468 9.794 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -3.201 3.540 8.278 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -2.354 3.997 9.677 1.00 0.00 H new ATOM 1879 N VAL B 50 -5.519 8.559 6.257 1.00 0.00 N ATOM 1880 CA VAL B 50 -6.956 8.239 6.009 1.00 0.00 C ATOM 1881 C VAL B 50 -7.073 6.998 5.117 1.00 0.00 C ATOM 1882 O VAL B 50 -6.142 6.229 4.983 1.00 0.00 O ATOM 1883 CB VAL B 50 -7.513 9.479 5.303 1.00 0.00 C ATOM 1884 CG1 VAL B 50 -7.225 9.394 3.802 1.00 0.00 C ATOM 1885 CG2 VAL B 50 -9.025 9.561 5.530 1.00 0.00 C ATOM 0 H VAL B 50 -4.856 8.027 5.693 1.00 0.00 H new ATOM 0 HA VAL B 50 -7.502 8.015 6.925 1.00 0.00 H new ATOM 0 HB VAL B 50 -7.035 10.370 5.711 1.00 0.00 H new ATOM 0 HG11 VAL B 50 -7.623 10.278 3.304 1.00 0.00 H new ATOM 0 HG12 VAL B 50 -6.148 9.341 3.641 1.00 0.00 H new ATOM 0 HG13 VAL B 50 -7.698 8.502 3.391 1.00 0.00 H new ATOM 0 HG21 VAL B 50 -9.421 10.443 5.028 1.00 0.00 H new ATOM 0 HG22 VAL B 50 -9.503 8.668 5.126 1.00 0.00 H new ATOM 0 HG23 VAL B 50 -9.229 9.630 6.598 1.00 0.00 H new ATOM 1895 N CYS B 51 -8.207 6.801 4.499 1.00 0.00 N ATOM 1896 CA CYS B 51 -8.378 5.616 3.612 1.00 0.00 C ATOM 1897 C CYS B 51 -8.443 6.069 2.154 1.00 0.00 C ATOM 1898 O CYS B 51 -8.914 7.149 1.851 1.00 0.00 O ATOM 1899 CB CYS B 51 -9.699 4.985 4.045 1.00 0.00 C ATOM 1900 SG CYS B 51 -9.422 3.942 5.500 1.00 0.00 S ATOM 0 H CYS B 51 -9.022 7.410 4.571 1.00 0.00 H new ATOM 0 HA CYS B 51 -7.552 4.909 3.690 1.00 0.00 H new ATOM 0 HB2 CYS B 51 -10.427 5.762 4.275 1.00 0.00 H new ATOM 0 HB3 CYS B 51 -10.114 4.390 3.231 1.00 0.00 H new ATOM 0 HG CYS B 51 -9.761 2.717 5.227 1.00 0.00 H new ATOM 1905 N LEU B 52 -7.949 5.271 1.249 1.00 0.00 N ATOM 1906 CA LEU B 52 -7.955 5.670 -0.171 1.00 0.00 C ATOM 1907 C LEU B 52 -8.953 4.839 -0.981 1.00 0.00 C ATOM 1908 O LEU B 52 -9.416 3.798 -0.549 1.00 0.00 O ATOM 1909 CB LEU B 52 -6.532 5.381 -0.615 1.00 0.00 C ATOM 1910 CG LEU B 52 -5.864 6.676 -1.062 1.00 0.00 C ATOM 1911 CD1 LEU B 52 -4.347 6.501 -1.019 1.00 0.00 C ATOM 1912 CD2 LEU B 52 -6.302 7.013 -2.489 1.00 0.00 C ATOM 0 H LEU B 52 -7.541 4.356 1.441 1.00 0.00 H new ATOM 0 HA LEU B 52 -8.254 6.708 -0.317 1.00 0.00 H new ATOM 0 HB2 LEU B 52 -5.969 4.933 0.203 1.00 0.00 H new ATOM 0 HB3 LEU B 52 -6.535 4.660 -1.432 1.00 0.00 H new ATOM 0 HG LEU B 52 -6.157 7.487 -0.396 1.00 0.00 H new ATOM 0 HD11 LEU B 52 -3.865 7.425 -1.338 1.00 0.00 H new ATOM 0 HD12 LEU B 52 -4.037 6.263 -0.002 1.00 0.00 H new ATOM 0 HD13 LEU B 52 -4.055 5.690 -1.687 1.00 0.00 H new ATOM 0 HD21 LEU B 52 -5.824 7.939 -2.807 1.00 0.00 H new ATOM 0 HD22 LEU B 52 -6.010 6.205 -3.160 1.00 0.00 H new ATOM 0 HD23 LEU B 52 -7.385 7.135 -2.518 1.00 0.00 H new ATOM 1924 N ASP B 53 -9.275 5.313 -2.157 1.00 0.00 N ATOM 1925 CA ASP B 53 -10.239 4.602 -3.047 1.00 0.00 C ATOM 1926 C ASP B 53 -9.886 3.113 -3.162 1.00 0.00 C ATOM 1927 O ASP B 53 -9.146 2.587 -2.357 1.00 0.00 O ATOM 1928 CB ASP B 53 -10.075 5.306 -4.395 1.00 0.00 C ATOM 1929 CG ASP B 53 -11.436 5.800 -4.887 1.00 0.00 C ATOM 1930 OD1 ASP B 53 -12.190 6.309 -4.073 1.00 0.00 O ATOM 1931 OD2 ASP B 53 -11.703 5.662 -6.071 1.00 0.00 O ATOM 0 H ASP B 53 -8.902 6.180 -2.544 1.00 0.00 H new ATOM 0 HA ASP B 53 -11.262 4.637 -2.673 1.00 0.00 H new ATOM 0 HB2 ASP B 53 -9.387 6.145 -4.297 1.00 0.00 H new ATOM 0 HB3 ASP B 53 -9.641 4.621 -5.123 1.00 0.00 H new ATOM 1936 N PRO B 54 -10.435 2.476 -4.168 1.00 0.00 N ATOM 1937 CA PRO B 54 -10.179 1.037 -4.383 1.00 0.00 C ATOM 1938 C PRO B 54 -8.907 0.871 -5.210 1.00 0.00 C ATOM 1939 O PRO B 54 -8.944 0.897 -6.419 1.00 0.00 O ATOM 1940 CB PRO B 54 -11.406 0.579 -5.163 1.00 0.00 C ATOM 1941 CG PRO B 54 -11.933 1.806 -5.854 1.00 0.00 C ATOM 1942 CD PRO B 54 -11.329 3.026 -5.193 1.00 0.00 C ATOM 0 HA PRO B 54 -10.033 0.466 -3.466 1.00 0.00 H new ATOM 0 HB2 PRO B 54 -11.144 -0.194 -5.885 1.00 0.00 H new ATOM 0 HB3 PRO B 54 -12.156 0.153 -4.497 1.00 0.00 H new ATOM 0 HG2 PRO B 54 -11.677 1.783 -6.913 1.00 0.00 H new ATOM 0 HG3 PRO B 54 -13.021 1.840 -5.789 1.00 0.00 H new ATOM 0 HD2 PRO B 54 -10.783 3.638 -5.911 1.00 0.00 H new ATOM 0 HD3 PRO B 54 -12.097 3.661 -4.752 1.00 0.00 H new ATOM 1950 N GLU B 55 -7.780 0.743 -4.568 1.00 0.00 N ATOM 1951 CA GLU B 55 -6.508 0.626 -5.331 1.00 0.00 C ATOM 1952 C GLU B 55 -6.379 1.870 -6.202 1.00 0.00 C ATOM 1953 O GLU B 55 -5.668 1.891 -7.182 1.00 0.00 O ATOM 1954 CB GLU B 55 -6.632 -0.660 -6.168 1.00 0.00 C ATOM 1955 CG GLU B 55 -7.256 -0.371 -7.541 1.00 0.00 C ATOM 1956 CD GLU B 55 -6.477 -1.122 -8.622 1.00 0.00 C ATOM 1957 OE1 GLU B 55 -5.347 -0.743 -8.883 1.00 0.00 O ATOM 1958 OE2 GLU B 55 -7.025 -2.063 -9.173 1.00 0.00 O ATOM 0 H GLU B 55 -7.685 0.714 -3.553 1.00 0.00 H new ATOM 0 HA GLU B 55 -5.620 0.564 -4.702 1.00 0.00 H new ATOM 0 HB2 GLU B 55 -5.647 -1.107 -6.300 1.00 0.00 H new ATOM 0 HB3 GLU B 55 -7.243 -1.387 -5.634 1.00 0.00 H new ATOM 0 HG2 GLU B 55 -8.301 -0.680 -7.550 1.00 0.00 H new ATOM 0 HG3 GLU B 55 -7.238 0.700 -7.742 1.00 0.00 H new ATOM 1965 N ALA B 56 -7.085 2.909 -5.840 1.00 0.00 N ATOM 1966 CA ALA B 56 -7.035 4.161 -6.639 1.00 0.00 C ATOM 1967 C ALA B 56 -7.035 3.802 -8.123 1.00 0.00 C ATOM 1968 O ALA B 56 -6.026 3.901 -8.787 1.00 0.00 O ATOM 1969 CB ALA B 56 -5.729 4.851 -6.234 1.00 0.00 C ATOM 0 H ALA B 56 -7.695 2.941 -5.023 1.00 0.00 H new ATOM 0 HA ALA B 56 -7.889 4.815 -6.462 1.00 0.00 H new ATOM 0 HB1 ALA B 56 -5.625 5.785 -6.786 1.00 0.00 H new ATOM 0 HB2 ALA B 56 -5.745 5.061 -5.165 1.00 0.00 H new ATOM 0 HB3 ALA B 56 -4.887 4.198 -6.463 1.00 0.00 H new ATOM 1975 N PRO B 57 -8.182 3.382 -8.588 1.00 0.00 N ATOM 1976 CA PRO B 57 -8.327 2.993 -10.007 1.00 0.00 C ATOM 1977 C PRO B 57 -8.353 4.248 -10.869 1.00 0.00 C ATOM 1978 O PRO B 57 -7.469 4.485 -11.667 1.00 0.00 O ATOM 1979 CB PRO B 57 -9.664 2.261 -10.048 1.00 0.00 C ATOM 1980 CG PRO B 57 -10.436 2.791 -8.882 1.00 0.00 C ATOM 1981 CD PRO B 57 -9.438 3.245 -7.844 1.00 0.00 C ATOM 0 HA PRO B 57 -7.513 2.372 -10.382 1.00 0.00 H new ATOM 0 HB2 PRO B 57 -10.188 2.449 -10.985 1.00 0.00 H new ATOM 0 HB3 PRO B 57 -9.525 1.183 -9.971 1.00 0.00 H new ATOM 0 HG2 PRO B 57 -11.073 3.620 -9.189 1.00 0.00 H new ATOM 0 HG3 PRO B 57 -11.090 2.021 -8.474 1.00 0.00 H new ATOM 0 HD2 PRO B 57 -9.737 4.190 -7.390 1.00 0.00 H new ATOM 0 HD3 PRO B 57 -9.345 2.519 -7.036 1.00 0.00 H new ATOM 1989 N LEU B 58 -9.344 5.074 -10.693 1.00 0.00 N ATOM 1990 CA LEU B 58 -9.395 6.328 -11.481 1.00 0.00 C ATOM 1991 C LEU B 58 -8.095 7.093 -11.242 1.00 0.00 C ATOM 1992 O LEU B 58 -7.514 7.655 -12.148 1.00 0.00 O ATOM 1993 CB LEU B 58 -10.591 7.104 -10.927 1.00 0.00 C ATOM 1994 CG LEU B 58 -11.672 7.222 -12.005 1.00 0.00 C ATOM 1995 CD1 LEU B 58 -11.123 8.006 -13.197 1.00 0.00 C ATOM 1996 CD2 LEU B 58 -12.086 5.822 -12.465 1.00 0.00 C ATOM 0 H LEU B 58 -10.116 4.934 -10.041 1.00 0.00 H new ATOM 0 HA LEU B 58 -9.501 6.163 -12.553 1.00 0.00 H new ATOM 0 HB2 LEU B 58 -10.992 6.596 -10.050 1.00 0.00 H new ATOM 0 HB3 LEU B 58 -10.275 8.096 -10.604 1.00 0.00 H new ATOM 0 HG LEU B 58 -12.537 7.743 -11.595 1.00 0.00 H new ATOM 0 HD11 LEU B 58 -11.893 8.089 -13.964 1.00 0.00 H new ATOM 0 HD12 LEU B 58 -10.826 9.003 -12.871 1.00 0.00 H new ATOM 0 HD13 LEU B 58 -10.258 7.486 -13.607 1.00 0.00 H new ATOM 0 HD21 LEU B 58 -12.856 5.904 -13.233 1.00 0.00 H new ATOM 0 HD22 LEU B 58 -11.220 5.302 -12.874 1.00 0.00 H new ATOM 0 HD23 LEU B 58 -12.478 5.261 -11.616 1.00 0.00 H new ATOM 2008 N VAL B 59 -7.630 7.104 -10.019 1.00 0.00 N ATOM 2009 CA VAL B 59 -6.357 7.821 -9.716 1.00 0.00 C ATOM 2010 C VAL B 59 -5.160 6.874 -9.847 1.00 0.00 C ATOM 2011 O VAL B 59 -4.034 7.241 -9.574 1.00 0.00 O ATOM 2012 CB VAL B 59 -6.505 8.301 -8.278 1.00 0.00 C ATOM 2013 CG1 VAL B 59 -5.251 9.079 -7.876 1.00 0.00 C ATOM 2014 CG2 VAL B 59 -7.731 9.211 -8.178 1.00 0.00 C ATOM 0 H VAL B 59 -8.075 6.650 -9.221 1.00 0.00 H new ATOM 0 HA VAL B 59 -6.179 8.646 -10.406 1.00 0.00 H new ATOM 0 HB VAL B 59 -6.630 7.448 -7.611 1.00 0.00 H new ATOM 0 HG11 VAL B 59 -5.352 9.425 -6.847 1.00 0.00 H new ATOM 0 HG12 VAL B 59 -4.379 8.430 -7.957 1.00 0.00 H new ATOM 0 HG13 VAL B 59 -5.128 9.937 -8.537 1.00 0.00 H new ATOM 0 HG21 VAL B 59 -7.843 9.559 -7.151 1.00 0.00 H new ATOM 0 HG22 VAL B 59 -7.603 10.068 -8.839 1.00 0.00 H new ATOM 0 HG23 VAL B 59 -8.621 8.656 -8.472 1.00 0.00 H new ATOM 2024 N GLN B 60 -5.394 5.659 -10.256 1.00 0.00 N ATOM 2025 CA GLN B 60 -4.269 4.688 -10.398 1.00 0.00 C ATOM 2026 C GLN B 60 -3.075 5.372 -11.052 1.00 0.00 C ATOM 2027 O GLN B 60 -1.950 5.248 -10.608 1.00 0.00 O ATOM 2028 CB GLN B 60 -4.815 3.579 -11.297 1.00 0.00 C ATOM 2029 CG GLN B 60 -3.935 2.328 -11.185 1.00 0.00 C ATOM 2030 CD GLN B 60 -3.523 2.106 -9.726 1.00 0.00 C ATOM 2031 OE1 GLN B 60 -2.463 2.530 -9.312 1.00 0.00 O ATOM 2032 NE2 GLN B 60 -4.320 1.449 -8.926 1.00 0.00 N ATOM 0 H GLN B 60 -6.315 5.294 -10.499 1.00 0.00 H new ATOM 0 HA GLN B 60 -3.929 4.299 -9.438 1.00 0.00 H new ATOM 0 HB2 GLN B 60 -5.839 3.339 -11.011 1.00 0.00 H new ATOM 0 HB3 GLN B 60 -4.845 3.921 -12.332 1.00 0.00 H new ATOM 0 HG2 GLN B 60 -4.477 1.458 -11.555 1.00 0.00 H new ATOM 0 HG3 GLN B 60 -3.048 2.440 -11.809 1.00 0.00 H new ATOM 0 HE21 GLN B 60 -5.210 1.093 -9.273 1.00 0.00 H new ATOM 0 HE22 GLN B 60 -4.052 1.293 -7.954 1.00 0.00 H new ATOM 2041 N LYS B 61 -3.316 6.097 -12.100 1.00 0.00 N ATOM 2042 CA LYS B 61 -2.198 6.802 -12.788 1.00 0.00 C ATOM 2043 C LYS B 61 -1.434 7.656 -11.779 1.00 0.00 C ATOM 2044 O LYS B 61 -0.230 7.555 -11.647 1.00 0.00 O ATOM 2045 CB LYS B 61 -2.868 7.677 -13.849 1.00 0.00 C ATOM 2046 CG LYS B 61 -3.649 6.791 -14.821 1.00 0.00 C ATOM 2047 CD LYS B 61 -4.758 7.612 -15.482 1.00 0.00 C ATOM 2048 CE LYS B 61 -4.964 7.128 -16.919 1.00 0.00 C ATOM 2049 NZ LYS B 61 -4.555 8.276 -17.774 1.00 0.00 N ATOM 0 H LYS B 61 -4.238 6.235 -12.514 1.00 0.00 H new ATOM 0 HA LYS B 61 -1.480 6.115 -13.236 1.00 0.00 H new ATOM 0 HB2 LYS B 61 -3.538 8.394 -13.374 1.00 0.00 H new ATOM 0 HB3 LYS B 61 -2.116 8.253 -14.389 1.00 0.00 H new ATOM 0 HG2 LYS B 61 -2.979 6.387 -15.580 1.00 0.00 H new ATOM 0 HG3 LYS B 61 -4.078 5.941 -14.290 1.00 0.00 H new ATOM 0 HD2 LYS B 61 -5.685 7.512 -14.917 1.00 0.00 H new ATOM 0 HD3 LYS B 61 -4.494 8.670 -15.477 1.00 0.00 H new ATOM 0 HE2 LYS B 61 -4.360 6.245 -17.129 1.00 0.00 H new ATOM 0 HE3 LYS B 61 -6.004 6.853 -17.098 1.00 0.00 H new ATOM 0 HZ1 LYS B 61 -4.668 8.020 -18.776 1.00 0.00 H new ATOM 0 HZ2 LYS B 61 -5.151 9.100 -17.557 1.00 0.00 H new ATOM 0 HZ3 LYS B 61 -3.559 8.511 -17.587 1.00 0.00 H new ATOM 2063 N ILE B 62 -2.127 8.487 -11.055 1.00 0.00 N ATOM 2064 CA ILE B 62 -1.447 9.338 -10.039 1.00 0.00 C ATOM 2065 C ILE B 62 -0.819 8.445 -8.969 1.00 0.00 C ATOM 2066 O ILE B 62 0.159 8.802 -8.344 1.00 0.00 O ATOM 2067 CB ILE B 62 -2.555 10.210 -9.446 1.00 0.00 C ATOM 2068 CG1 ILE B 62 -3.146 11.096 -10.546 1.00 0.00 C ATOM 2069 CG2 ILE B 62 -1.975 11.093 -8.340 1.00 0.00 C ATOM 2070 CD1 ILE B 62 -4.067 12.143 -9.917 1.00 0.00 C ATOM 0 H ILE B 62 -3.137 8.615 -11.122 1.00 0.00 H new ATOM 0 HA ILE B 62 -0.647 9.946 -10.460 1.00 0.00 H new ATOM 0 HB ILE B 62 -3.335 9.573 -9.030 1.00 0.00 H new ATOM 0 HG12 ILE B 62 -2.347 11.586 -11.102 1.00 0.00 H new ATOM 0 HG13 ILE B 62 -3.703 10.487 -11.258 1.00 0.00 H new ATOM 0 HG21 ILE B 62 -2.765 11.714 -7.918 1.00 0.00 H new ATOM 0 HG22 ILE B 62 -1.551 10.464 -7.557 1.00 0.00 H new ATOM 0 HG23 ILE B 62 -1.195 11.731 -8.755 1.00 0.00 H new ATOM 0 HD11 ILE B 62 -4.488 12.774 -10.699 1.00 0.00 H new ATOM 0 HD12 ILE B 62 -4.874 11.643 -9.381 1.00 0.00 H new ATOM 0 HD13 ILE B 62 -3.496 12.759 -9.222 1.00 0.00 H new ATOM 2082 N ILE B 63 -1.360 7.272 -8.774 1.00 0.00 N ATOM 2083 CA ILE B 63 -0.776 6.347 -7.771 1.00 0.00 C ATOM 2084 C ILE B 63 0.521 5.792 -8.338 1.00 0.00 C ATOM 2085 O ILE B 63 1.566 5.872 -7.727 1.00 0.00 O ATOM 2086 CB ILE B 63 -1.831 5.254 -7.591 1.00 0.00 C ATOM 2087 CG1 ILE B 63 -2.550 5.469 -6.261 1.00 0.00 C ATOM 2088 CG2 ILE B 63 -1.169 3.879 -7.602 1.00 0.00 C ATOM 2089 CD1 ILE B 63 -3.027 6.917 -6.190 1.00 0.00 C ATOM 0 H ILE B 63 -2.180 6.918 -9.267 1.00 0.00 H new ATOM 0 HA ILE B 63 -0.540 6.815 -6.815 1.00 0.00 H new ATOM 0 HB ILE B 63 -2.548 5.304 -8.411 1.00 0.00 H new ATOM 0 HG12 ILE B 63 -3.397 4.788 -6.175 1.00 0.00 H new ATOM 0 HG13 ILE B 63 -1.880 5.251 -5.430 1.00 0.00 H new ATOM 0 HG21 ILE B 63 -1.929 3.108 -7.473 1.00 0.00 H new ATOM 0 HG22 ILE B 63 -0.658 3.729 -8.553 1.00 0.00 H new ATOM 0 HG23 ILE B 63 -0.447 3.816 -6.788 1.00 0.00 H new ATOM 0 HD11 ILE B 63 -3.543 7.084 -5.244 1.00 0.00 H new ATOM 0 HD12 ILE B 63 -2.170 7.586 -6.259 1.00 0.00 H new ATOM 0 HD13 ILE B 63 -3.710 7.116 -7.016 1.00 0.00 H new ATOM 2101 N GLN B 64 0.469 5.269 -9.526 1.00 0.00 N ATOM 2102 CA GLN B 64 1.719 4.757 -10.146 1.00 0.00 C ATOM 2103 C GLN B 64 2.773 5.851 -10.012 1.00 0.00 C ATOM 2104 O GLN B 64 3.959 5.596 -9.959 1.00 0.00 O ATOM 2105 CB GLN B 64 1.374 4.502 -11.613 1.00 0.00 C ATOM 2106 CG GLN B 64 1.269 2.997 -11.861 1.00 0.00 C ATOM 2107 CD GLN B 64 1.517 2.704 -13.342 1.00 0.00 C ATOM 2108 OE1 GLN B 64 0.622 2.820 -14.156 1.00 0.00 O ATOM 2109 NE2 GLN B 64 2.705 2.326 -13.730 1.00 0.00 N ATOM 0 H GLN B 64 -0.375 5.174 -10.091 1.00 0.00 H new ATOM 0 HA GLN B 64 2.101 3.847 -9.684 1.00 0.00 H new ATOM 0 HB2 GLN B 64 0.432 4.989 -11.865 1.00 0.00 H new ATOM 0 HB3 GLN B 64 2.139 4.934 -12.258 1.00 0.00 H new ATOM 0 HG2 GLN B 64 1.996 2.465 -11.248 1.00 0.00 H new ATOM 0 HG3 GLN B 64 0.282 2.638 -11.569 1.00 0.00 H new ATOM 0 HE21 GLN B 64 3.457 2.228 -13.048 1.00 0.00 H new ATOM 0 HE22 GLN B 64 2.881 2.129 -14.715 1.00 0.00 H new ATOM 2118 N LYS B 65 2.324 7.076 -9.926 1.00 0.00 N ATOM 2119 CA LYS B 65 3.266 8.211 -9.759 1.00 0.00 C ATOM 2120 C LYS B 65 3.835 8.166 -8.343 1.00 0.00 C ATOM 2121 O LYS B 65 4.995 8.446 -8.114 1.00 0.00 O ATOM 2122 CB LYS B 65 2.419 9.469 -9.962 1.00 0.00 C ATOM 2123 CG LYS B 65 3.288 10.581 -10.549 1.00 0.00 C ATOM 2124 CD LYS B 65 4.133 11.208 -9.439 1.00 0.00 C ATOM 2125 CE LYS B 65 3.746 12.679 -9.272 1.00 0.00 C ATOM 2126 NZ LYS B 65 5.007 13.437 -9.503 1.00 0.00 N ATOM 0 H LYS B 65 1.338 7.336 -9.965 1.00 0.00 H new ATOM 0 HA LYS B 65 4.102 8.182 -10.458 1.00 0.00 H new ATOM 0 HB2 LYS B 65 1.585 9.254 -10.630 1.00 0.00 H new ATOM 0 HB3 LYS B 65 1.992 9.790 -9.012 1.00 0.00 H new ATOM 0 HG2 LYS B 65 3.934 10.179 -11.329 1.00 0.00 H new ATOM 0 HG3 LYS B 65 2.660 11.340 -11.015 1.00 0.00 H new ATOM 0 HD2 LYS B 65 3.978 10.672 -8.503 1.00 0.00 H new ATOM 0 HD3 LYS B 65 5.192 11.125 -9.683 1.00 0.00 H new ATOM 0 HE2 LYS B 65 2.975 12.968 -9.986 1.00 0.00 H new ATOM 0 HE3 LYS B 65 3.346 12.872 -8.276 1.00 0.00 H new ATOM 0 HZ1 LYS B 65 4.822 14.456 -9.405 1.00 0.00 H new ATOM 0 HZ2 LYS B 65 5.720 13.146 -8.804 1.00 0.00 H new ATOM 0 HZ3 LYS B 65 5.360 13.239 -10.461 1.00 0.00 H new ATOM 2140 N ILE B 66 3.020 7.790 -7.393 1.00 0.00 N ATOM 2141 CA ILE B 66 3.501 7.695 -5.989 1.00 0.00 C ATOM 2142 C ILE B 66 4.377 6.448 -5.847 1.00 0.00 C ATOM 2143 O ILE B 66 5.370 6.443 -5.145 1.00 0.00 O ATOM 2144 CB ILE B 66 2.234 7.598 -5.134 1.00 0.00 C ATOM 2145 CG1 ILE B 66 2.467 8.312 -3.801 1.00 0.00 C ATOM 2146 CG2 ILE B 66 1.885 6.135 -4.868 1.00 0.00 C ATOM 2147 CD1 ILE B 66 1.769 9.673 -3.822 1.00 0.00 C ATOM 0 H ILE B 66 2.040 7.545 -7.532 1.00 0.00 H new ATOM 0 HA ILE B 66 4.107 8.548 -5.682 1.00 0.00 H new ATOM 0 HB ILE B 66 1.409 8.068 -5.669 1.00 0.00 H new ATOM 0 HG12 ILE B 66 2.082 7.707 -2.980 1.00 0.00 H new ATOM 0 HG13 ILE B 66 3.535 8.442 -3.628 1.00 0.00 H new ATOM 0 HG21 ILE B 66 0.982 6.081 -4.259 1.00 0.00 H new ATOM 0 HG22 ILE B 66 1.715 5.624 -5.815 1.00 0.00 H new ATOM 0 HG23 ILE B 66 2.708 5.655 -4.339 1.00 0.00 H new ATOM 0 HD11 ILE B 66 1.935 10.182 -2.872 1.00 0.00 H new ATOM 0 HD12 ILE B 66 2.175 10.277 -4.633 1.00 0.00 H new ATOM 0 HD13 ILE B 66 0.699 9.531 -3.975 1.00 0.00 H new ATOM 2159 N LEU B 67 4.026 5.399 -6.541 1.00 0.00 N ATOM 2160 CA LEU B 67 4.838 4.151 -6.490 1.00 0.00 C ATOM 2161 C LEU B 67 6.162 4.383 -7.215 1.00 0.00 C ATOM 2162 O LEU B 67 7.201 3.894 -6.817 1.00 0.00 O ATOM 2163 CB LEU B 67 4.001 3.100 -7.226 1.00 0.00 C ATOM 2164 CG LEU B 67 3.107 2.358 -6.231 1.00 0.00 C ATOM 2165 CD1 LEU B 67 2.298 3.367 -5.419 1.00 0.00 C ATOM 2166 CD2 LEU B 67 2.154 1.436 -6.994 1.00 0.00 C ATOM 0 H LEU B 67 3.205 5.354 -7.145 1.00 0.00 H new ATOM 0 HA LEU B 67 5.069 3.839 -5.472 1.00 0.00 H new ATOM 0 HB2 LEU B 67 3.390 3.579 -7.991 1.00 0.00 H new ATOM 0 HB3 LEU B 67 4.655 2.394 -7.737 1.00 0.00 H new ATOM 0 HG LEU B 67 3.727 1.766 -5.558 1.00 0.00 H new ATOM 0 HD11 LEU B 67 1.661 2.837 -4.710 1.00 0.00 H new ATOM 0 HD12 LEU B 67 2.977 4.025 -4.876 1.00 0.00 H new ATOM 0 HD13 LEU B 67 1.678 3.961 -6.090 1.00 0.00 H new ATOM 0 HD21 LEU B 67 1.516 0.906 -6.287 1.00 0.00 H new ATOM 0 HD22 LEU B 67 1.535 2.029 -7.667 1.00 0.00 H new ATOM 0 HD23 LEU B 67 2.731 0.715 -7.573 1.00 0.00 H new ATOM 2178 N ASN B 68 6.126 5.135 -8.279 1.00 0.00 N ATOM 2179 CA ASN B 68 7.370 5.417 -9.044 1.00 0.00 C ATOM 2180 C ASN B 68 8.045 6.682 -8.504 1.00 0.00 C ATOM 2181 O ASN B 68 8.974 7.200 -9.092 1.00 0.00 O ATOM 2182 CB ASN B 68 6.909 5.630 -10.484 1.00 0.00 C ATOM 2183 CG ASN B 68 7.890 4.951 -11.441 1.00 0.00 C ATOM 2184 OD1 ASN B 68 8.697 5.608 -12.069 1.00 0.00 O ATOM 2185 ND2 ASN B 68 7.857 3.654 -11.580 1.00 0.00 N ATOM 0 H ASN B 68 5.282 5.569 -8.653 1.00 0.00 H new ATOM 0 HA ASN B 68 8.097 4.609 -8.964 1.00 0.00 H new ATOM 0 HB2 ASN B 68 5.908 5.220 -10.621 1.00 0.00 H new ATOM 0 HB3 ASN B 68 6.849 6.696 -10.704 1.00 0.00 H new ATOM 0 HD21 ASN B 68 8.508 3.192 -12.215 1.00 0.00 H new ATOM 0 HD22 ASN B 68 7.180 3.102 -11.053 1.00 0.00 H new ATOM 2192 N LYS B 69 7.583 7.184 -7.391 1.00 0.00 N ATOM 2193 CA LYS B 69 8.196 8.417 -6.817 1.00 0.00 C ATOM 2194 C LYS B 69 9.498 8.080 -6.098 1.00 0.00 C ATOM 2195 O LYS B 69 10.064 8.889 -5.390 1.00 0.00 O ATOM 2196 CB LYS B 69 7.157 8.968 -5.840 1.00 0.00 C ATOM 2197 CG LYS B 69 6.614 10.297 -6.368 1.00 0.00 C ATOM 2198 CD LYS B 69 5.945 11.065 -5.226 1.00 0.00 C ATOM 2199 CE LYS B 69 6.153 12.567 -5.429 1.00 0.00 C ATOM 2200 NZ LYS B 69 4.839 13.184 -5.096 1.00 0.00 N ATOM 0 H LYS B 69 6.808 6.794 -6.854 1.00 0.00 H new ATOM 0 HA LYS B 69 8.447 9.146 -7.587 1.00 0.00 H new ATOM 0 HB2 LYS B 69 6.343 8.254 -5.717 1.00 0.00 H new ATOM 0 HB3 LYS B 69 7.606 9.111 -4.857 1.00 0.00 H new ATOM 0 HG2 LYS B 69 7.424 10.890 -6.793 1.00 0.00 H new ATOM 0 HG3 LYS B 69 5.896 10.117 -7.168 1.00 0.00 H new ATOM 0 HD2 LYS B 69 4.880 10.836 -5.195 1.00 0.00 H new ATOM 0 HD3 LYS B 69 6.366 10.755 -4.270 1.00 0.00 H new ATOM 0 HE2 LYS B 69 6.943 12.947 -4.782 1.00 0.00 H new ATOM 0 HE3 LYS B 69 6.446 12.790 -6.455 1.00 0.00 H new ATOM 0 HZ1 LYS B 69 4.901 14.216 -5.211 1.00 0.00 H new ATOM 0 HZ2 LYS B 69 4.108 12.808 -5.732 1.00 0.00 H new ATOM 0 HZ3 LYS B 69 4.590 12.960 -4.111 1.00 0.00 H new