USER MOD reduce.3.24.130724 H: found=0, std=0, add=870, rem=0, adj=18 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: A 27 SER OG : rot 61:sc= 0.708 USER MOD Set 1.2: B 27 SER OG : rot 180:sc= 0.624 USER MOD Single : A 13 LYS NZ :NH3+ -150:sc= -0.25 (180deg=-1.13) 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= -4.19! C(o=-4.2!,f=-7.5!) USER MOD Single : A 24 GLN : amide:sc= -0.0661 X(o=-0.066,f=0) USER MOD Single : A 25 SER OG : rot 180:sc= -2.95! USER MOD Single : A 29 THR OG1 : rot 51:sc= 0.174 USER MOD Single : A 38 THR OG1 : rot 15:sc= 0.879 USER MOD Single : A 43 THR OG1 : rot 180:sc= -2.05! USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 CYS SG : rot 180:sc= 0 USER MOD Single : A 60 GLN : amide:sc= -16.4! C(o=-16!,f=-22!) 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 X(o=0,f=0) USER MOD Single : A 69 LYS NZ :NH3+ -158:sc= -0.108 (180deg=-0.513) USER MOD Single : B 13 LYS NZ :NH3+ -143:sc= -0.304 (180deg=-1.14) 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= -4.2 K(o=-4.2,f=-7.5!) USER MOD Single : B 24 GLN : amide:sc= -0.0994 X(o=-0.099,f=0) USER MOD Single : B 25 SER OG : rot 180:sc= -3! USER MOD Single : B 29 THR OG1 : rot 53:sc= 0.238 USER MOD Single : B 38 THR OG1 : rot 17:sc= 0.868 USER MOD Single : B 43 THR OG1 : rot 180:sc= -2.06! USER MOD Single : B 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 48 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 51 CYS SG : rot 180:sc= 0 USER MOD Single : B 60 GLN : amide:sc= -16.5! C(o=-16!,f=-22!) 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 X(o=0,f=0) USER MOD Single : B 69 LYS NZ :NH3+ -157:sc= -0.122 (180deg=-0.5) USER MOD ----------------------------------------------------------------- ATOM 177 N LYS A 13 15.695 -6.159 3.747 1.00 0.00 N ATOM 178 CA LYS A 13 15.408 -6.556 2.340 1.00 0.00 C ATOM 179 C LYS A 13 13.902 -6.470 2.084 1.00 0.00 C ATOM 180 O LYS A 13 13.161 -5.926 2.878 1.00 0.00 O ATOM 181 CB LYS A 13 15.887 -8.001 2.227 1.00 0.00 C ATOM 182 CG LYS A 13 17.323 -8.023 1.696 1.00 0.00 C ATOM 183 CD LYS A 13 17.534 -9.281 0.851 1.00 0.00 C ATOM 184 CE LYS A 13 17.108 -9.003 -0.593 1.00 0.00 C ATOM 185 NZ LYS A 13 15.793 -9.685 -0.744 1.00 0.00 N ATOM 0 HA LYS A 13 15.902 -5.911 1.613 1.00 0.00 H new ATOM 0 HB2 LYS A 13 15.841 -8.488 3.201 1.00 0.00 H new ATOM 0 HB3 LYS A 13 15.232 -8.561 1.559 1.00 0.00 H new ATOM 0 HG2 LYS A 13 17.514 -7.133 1.097 1.00 0.00 H new ATOM 0 HG3 LYS A 13 18.029 -8.006 2.526 1.00 0.00 H new ATOM 0 HD2 LYS A 13 18.582 -9.581 0.881 1.00 0.00 H new ATOM 0 HD3 LYS A 13 16.954 -10.108 1.260 1.00 0.00 H new ATOM 0 HE2 LYS A 13 17.021 -7.933 -0.780 1.00 0.00 H new ATOM 0 HE3 LYS A 13 17.838 -9.392 -1.302 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 15.671 -9.989 -1.731 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 15.759 -10.516 -0.119 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 15.029 -9.027 -0.487 1.00 0.00 H new ATOM 199 N THR A 14 13.441 -6.998 0.985 1.00 0.00 N ATOM 200 CA THR A 14 11.989 -6.939 0.689 1.00 0.00 C ATOM 201 C THR A 14 11.605 -8.053 -0.286 1.00 0.00 C ATOM 202 O THR A 14 12.447 -8.635 -0.942 1.00 0.00 O ATOM 203 CB THR A 14 11.788 -5.573 0.045 1.00 0.00 C ATOM 204 OG1 THR A 14 13.015 -5.136 -0.524 1.00 0.00 O ATOM 205 CG2 THR A 14 11.326 -4.570 1.103 1.00 0.00 C ATOM 0 H THR A 14 14.010 -7.467 0.280 1.00 0.00 H new ATOM 0 HA THR A 14 11.373 -7.072 1.578 1.00 0.00 H new ATOM 0 HB THR A 14 11.031 -5.646 -0.735 1.00 0.00 H new ATOM 0 HG1 THR A 14 12.888 -4.258 -0.941 1.00 0.00 H new ATOM 0 HG21 THR A 14 11.183 -3.593 0.641 1.00 0.00 H new ATOM 0 HG22 THR A 14 10.385 -4.907 1.538 1.00 0.00 H new ATOM 0 HG23 THR A 14 12.081 -4.494 1.886 1.00 0.00 H new ATOM 213 N LEU A 15 10.341 -8.359 -0.385 1.00 0.00 N ATOM 214 CA LEU A 15 9.907 -9.437 -1.310 1.00 0.00 C ATOM 215 C LEU A 15 9.185 -8.846 -2.520 1.00 0.00 C ATOM 216 O LEU A 15 8.497 -7.852 -2.412 1.00 0.00 O ATOM 217 CB LEU A 15 8.949 -10.281 -0.482 1.00 0.00 C ATOM 218 CG LEU A 15 9.683 -10.819 0.744 1.00 0.00 C ATOM 219 CD1 LEU A 15 9.527 -9.838 1.907 1.00 0.00 C ATOM 220 CD2 LEU A 15 9.092 -12.171 1.135 1.00 0.00 C ATOM 0 H LEU A 15 9.590 -7.907 0.137 1.00 0.00 H new ATOM 0 HA LEU A 15 10.746 -10.015 -1.698 1.00 0.00 H new ATOM 0 HB2 LEU A 15 8.092 -9.682 -0.174 1.00 0.00 H new ATOM 0 HB3 LEU A 15 8.563 -11.106 -1.080 1.00 0.00 H new ATOM 0 HG LEU A 15 10.741 -10.937 0.511 1.00 0.00 H new ATOM 0 HD11 LEU A 15 10.052 -10.224 2.781 1.00 0.00 H new ATOM 0 HD12 LEU A 15 9.949 -8.872 1.628 1.00 0.00 H new ATOM 0 HD13 LEU A 15 8.469 -9.718 2.142 1.00 0.00 H new ATOM 0 HD21 LEU A 15 9.615 -12.557 2.010 1.00 0.00 H new ATOM 0 HD22 LEU A 15 8.034 -12.052 1.367 1.00 0.00 H new ATOM 0 HD23 LEU A 15 9.205 -12.871 0.307 1.00 0.00 H new ATOM 232 N PRO A 16 9.367 -9.491 -3.637 1.00 0.00 N ATOM 233 CA PRO A 16 8.727 -9.043 -4.887 1.00 0.00 C ATOM 234 C PRO A 16 7.291 -9.564 -4.945 1.00 0.00 C ATOM 235 O PRO A 16 6.494 -9.132 -5.750 1.00 0.00 O ATOM 236 CB PRO A 16 9.581 -9.691 -5.971 1.00 0.00 C ATOM 237 CG PRO A 16 10.199 -10.895 -5.330 1.00 0.00 C ATOM 238 CD PRO A 16 10.181 -10.690 -3.834 1.00 0.00 C ATOM 0 HA PRO A 16 8.671 -7.959 -4.987 1.00 0.00 H new ATOM 0 HB2 PRO A 16 8.975 -9.973 -6.832 1.00 0.00 H new ATOM 0 HB3 PRO A 16 10.346 -9.003 -6.331 1.00 0.00 H new ATOM 0 HG2 PRO A 16 9.646 -11.795 -5.598 1.00 0.00 H new ATOM 0 HG3 PRO A 16 11.221 -11.032 -5.683 1.00 0.00 H new ATOM 0 HD2 PRO A 16 9.751 -11.550 -3.321 1.00 0.00 H new ATOM 0 HD3 PRO A 16 11.188 -10.555 -3.440 1.00 0.00 H new ATOM 246 N ARG A 17 6.965 -10.499 -4.098 1.00 0.00 N ATOM 247 CA ARG A 17 5.588 -11.065 -4.102 1.00 0.00 C ATOM 248 C ARG A 17 5.393 -11.959 -2.876 1.00 0.00 C ATOM 249 O ARG A 17 5.292 -13.164 -2.985 1.00 0.00 O ATOM 250 CB ARG A 17 5.521 -11.892 -5.385 1.00 0.00 C ATOM 251 CG ARG A 17 4.233 -12.714 -5.394 1.00 0.00 C ATOM 252 CD ARG A 17 4.504 -14.083 -6.021 1.00 0.00 C ATOM 253 NE ARG A 17 5.241 -14.847 -4.977 1.00 0.00 N ATOM 254 CZ ARG A 17 6.350 -15.463 -5.281 1.00 0.00 C ATOM 255 NH1 ARG A 17 7.176 -14.932 -6.140 1.00 0.00 N ATOM 256 NH2 ARG A 17 6.632 -16.610 -4.728 1.00 0.00 N ATOM 0 H ARG A 17 7.595 -10.897 -3.401 1.00 0.00 H new ATOM 0 HA ARG A 17 4.814 -10.299 -4.065 1.00 0.00 H new ATOM 0 HB2 ARG A 17 5.553 -11.236 -6.255 1.00 0.00 H new ATOM 0 HB3 ARG A 17 6.386 -12.551 -5.451 1.00 0.00 H new ATOM 0 HG2 ARG A 17 3.860 -12.836 -4.377 1.00 0.00 H new ATOM 0 HG3 ARG A 17 3.460 -12.191 -5.957 1.00 0.00 H new ATOM 0 HD2 ARG A 17 3.575 -14.583 -6.293 1.00 0.00 H new ATOM 0 HD3 ARG A 17 5.095 -13.990 -6.932 1.00 0.00 H new ATOM 0 HE ARG A 17 4.879 -14.889 -4.024 1.00 0.00 H new ATOM 0 HH11 ARG A 17 6.955 -14.036 -6.573 1.00 0.00 H new ATOM 0 HH12 ARG A 17 8.043 -15.413 -6.378 1.00 0.00 H new ATOM 0 HH21 ARG A 17 5.985 -17.026 -4.058 1.00 0.00 H new ATOM 0 HH22 ARG A 17 7.499 -17.091 -4.966 1.00 0.00 H new ATOM 270 N VAL A 18 5.332 -11.379 -1.708 1.00 0.00 N ATOM 271 CA VAL A 18 5.129 -12.207 -0.480 1.00 0.00 C ATOM 272 C VAL A 18 3.997 -13.199 -0.727 1.00 0.00 C ATOM 273 O VAL A 18 3.385 -13.179 -1.772 1.00 0.00 O ATOM 274 CB VAL A 18 4.744 -11.207 0.610 1.00 0.00 C ATOM 275 CG1 VAL A 18 4.633 -11.936 1.946 1.00 0.00 C ATOM 276 CG2 VAL A 18 5.819 -10.123 0.713 1.00 0.00 C ATOM 0 H VAL A 18 5.413 -10.375 -1.549 1.00 0.00 H new ATOM 0 HA VAL A 18 6.013 -12.781 -0.202 1.00 0.00 H new ATOM 0 HB VAL A 18 3.787 -10.748 0.361 1.00 0.00 H new ATOM 0 HG11 VAL A 18 4.359 -11.226 2.726 1.00 0.00 H new ATOM 0 HG12 VAL A 18 3.870 -12.711 1.875 1.00 0.00 H new ATOM 0 HG13 VAL A 18 5.592 -12.393 2.192 1.00 0.00 H new ATOM 0 HG21 VAL A 18 5.544 -9.410 1.490 1.00 0.00 H new ATOM 0 HG22 VAL A 18 6.776 -10.582 0.963 1.00 0.00 H new ATOM 0 HG23 VAL A 18 5.905 -9.604 -0.241 1.00 0.00 H new ATOM 286 N ASP A 19 3.704 -14.059 0.215 1.00 0.00 N ATOM 287 CA ASP A 19 2.596 -15.028 0.010 1.00 0.00 C ATOM 288 C ASP A 19 1.424 -14.281 -0.626 1.00 0.00 C ATOM 289 O ASP A 19 0.414 -14.015 -0.006 1.00 0.00 O ATOM 290 CB ASP A 19 2.257 -15.515 1.413 1.00 0.00 C ATOM 291 CG ASP A 19 1.335 -16.731 1.329 1.00 0.00 C ATOM 292 OD1 ASP A 19 0.977 -17.102 0.223 1.00 0.00 O ATOM 293 OD2 ASP A 19 1.004 -17.273 2.371 1.00 0.00 O ATOM 0 H ASP A 19 4.184 -14.129 1.112 1.00 0.00 H new ATOM 0 HA ASP A 19 2.844 -15.864 -0.644 1.00 0.00 H new ATOM 0 HB2 ASP A 19 3.170 -15.776 1.948 1.00 0.00 H new ATOM 0 HB3 ASP A 19 1.773 -14.718 1.978 1.00 0.00 H new ATOM 298 N PHE A 20 1.600 -13.902 -1.856 1.00 0.00 N ATOM 299 CA PHE A 20 0.573 -13.117 -2.584 1.00 0.00 C ATOM 300 C PHE A 20 -0.849 -13.547 -2.256 1.00 0.00 C ATOM 301 O PHE A 20 -1.558 -12.867 -1.546 1.00 0.00 O ATOM 302 CB PHE A 20 0.879 -13.354 -4.055 1.00 0.00 C ATOM 303 CG PHE A 20 0.789 -12.035 -4.751 1.00 0.00 C ATOM 304 CD1 PHE A 20 1.860 -11.141 -4.683 1.00 0.00 C ATOM 305 CD2 PHE A 20 -0.374 -11.691 -5.436 1.00 0.00 C ATOM 306 CE1 PHE A 20 1.769 -9.901 -5.307 1.00 0.00 C ATOM 307 CE2 PHE A 20 -0.472 -10.453 -6.058 1.00 0.00 C ATOM 308 CZ PHE A 20 0.605 -9.552 -5.995 1.00 0.00 C ATOM 0 H PHE A 20 2.436 -14.110 -2.402 1.00 0.00 H new ATOM 0 HA PHE A 20 0.618 -12.065 -2.301 1.00 0.00 H new ATOM 0 HB2 PHE A 20 1.873 -13.784 -4.175 1.00 0.00 H new ATOM 0 HB3 PHE A 20 0.171 -14.063 -4.484 1.00 0.00 H new ATOM 0 HD1 PHE A 20 2.757 -11.412 -4.147 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -1.199 -12.386 -5.483 1.00 0.00 H new ATOM 0 HE1 PHE A 20 2.597 -9.209 -5.259 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -1.373 -10.183 -6.589 1.00 0.00 H new ATOM 0 HZ PHE A 20 0.532 -8.589 -6.479 1.00 0.00 H new ATOM 318 N LYS A 21 -1.289 -14.640 -2.793 1.00 0.00 N ATOM 319 CA LYS A 21 -2.685 -15.067 -2.525 1.00 0.00 C ATOM 320 C LYS A 21 -3.036 -14.814 -1.054 1.00 0.00 C ATOM 321 O LYS A 21 -4.185 -14.635 -0.701 1.00 0.00 O ATOM 322 CB LYS A 21 -2.723 -16.560 -2.849 1.00 0.00 C ATOM 323 CG LYS A 21 -2.485 -16.766 -4.346 1.00 0.00 C ATOM 324 CD LYS A 21 -1.587 -17.987 -4.557 1.00 0.00 C ATOM 325 CE LYS A 21 -2.347 -19.046 -5.359 1.00 0.00 C ATOM 326 NZ LYS A 21 -1.443 -20.230 -5.387 1.00 0.00 N ATOM 0 H LYS A 21 -0.749 -15.255 -3.402 1.00 0.00 H new ATOM 0 HA LYS A 21 -3.409 -14.514 -3.123 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -1.962 -17.087 -2.274 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -3.687 -16.980 -2.562 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -3.436 -16.907 -4.860 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -2.019 -15.880 -4.776 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -0.679 -17.697 -5.086 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -1.279 -18.396 -3.595 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -3.300 -19.288 -4.889 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -2.568 -18.694 -6.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -1.895 -21.000 -5.920 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -0.546 -19.971 -5.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -1.255 -20.547 -4.414 1.00 0.00 H new ATOM 340 N ASN A 22 -2.050 -14.789 -0.194 1.00 0.00 N ATOM 341 CA ASN A 22 -2.318 -14.540 1.248 1.00 0.00 C ATOM 342 C ASN A 22 -2.277 -13.042 1.542 1.00 0.00 C ATOM 343 O ASN A 22 -2.887 -12.565 2.478 1.00 0.00 O ATOM 344 CB ASN A 22 -1.181 -15.240 1.978 1.00 0.00 C ATOM 345 CG ASN A 22 -1.752 -16.149 3.069 1.00 0.00 C ATOM 346 OD1 ASN A 22 -2.899 -16.542 3.009 1.00 0.00 O ATOM 347 ND2 ASN A 22 -0.993 -16.501 4.071 1.00 0.00 N ATOM 0 H ASN A 22 -1.069 -14.931 -0.433 1.00 0.00 H new ATOM 0 HA ASN A 22 -3.299 -14.904 1.553 1.00 0.00 H new ATOM 0 HB2 ASN A 22 -0.591 -15.827 1.274 1.00 0.00 H new ATOM 0 HB3 ASN A 22 -0.511 -14.503 2.419 1.00 0.00 H new ATOM 0 HD21 ASN A 22 -1.364 -17.106 4.804 1.00 0.00 H new ATOM 0 HD22 ASN A 22 -0.029 -16.171 4.121 1.00 0.00 H new ATOM 354 N ILE A 23 -1.548 -12.301 0.756 1.00 0.00 N ATOM 355 CA ILE A 23 -1.447 -10.834 0.993 1.00 0.00 C ATOM 356 C ILE A 23 -2.809 -10.273 1.410 1.00 0.00 C ATOM 357 O ILE A 23 -3.671 -10.023 0.590 1.00 0.00 O ATOM 358 CB ILE A 23 -0.988 -10.242 -0.346 1.00 0.00 C ATOM 359 CG1 ILE A 23 0.515 -9.965 -0.292 1.00 0.00 C ATOM 360 CG2 ILE A 23 -1.725 -8.932 -0.626 1.00 0.00 C ATOM 361 CD1 ILE A 23 1.256 -11.256 0.047 1.00 0.00 C ATOM 0 H ILE A 23 -1.016 -12.649 -0.042 1.00 0.00 H new ATOM 0 HA ILE A 23 -0.751 -10.588 1.795 1.00 0.00 H new ATOM 0 HB ILE A 23 -1.209 -10.956 -1.140 1.00 0.00 H new ATOM 0 HG12 ILE A 23 0.859 -9.576 -1.250 1.00 0.00 H new ATOM 0 HG13 ILE A 23 0.729 -9.202 0.457 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -1.390 -8.523 -1.579 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -2.798 -9.120 -0.669 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -1.513 -8.218 0.170 1.00 0.00 H new ATOM 0 HD11 ILE A 23 2.328 -11.061 0.086 1.00 0.00 H new ATOM 0 HD12 ILE A 23 0.919 -11.625 1.016 1.00 0.00 H new ATOM 0 HD13 ILE A 23 1.051 -12.005 -0.718 1.00 0.00 H new ATOM 373 N GLN A 24 -3.004 -10.073 2.682 1.00 0.00 N ATOM 374 CA GLN A 24 -4.307 -9.525 3.161 1.00 0.00 C ATOM 375 C GLN A 24 -4.248 -7.997 3.206 1.00 0.00 C ATOM 376 O GLN A 24 -5.230 -7.333 3.472 1.00 0.00 O ATOM 377 CB GLN A 24 -4.487 -10.098 4.567 1.00 0.00 C ATOM 378 CG GLN A 24 -5.968 -10.395 4.811 1.00 0.00 C ATOM 379 CD GLN A 24 -6.609 -9.222 5.552 1.00 0.00 C ATOM 380 OE1 GLN A 24 -7.489 -8.566 5.030 1.00 0.00 O ATOM 381 NE2 GLN A 24 -6.202 -8.926 6.756 1.00 0.00 N ATOM 0 H GLN A 24 -2.319 -10.265 3.413 1.00 0.00 H new ATOM 0 HA GLN A 24 -5.136 -9.793 2.505 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -3.899 -11.009 4.678 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -4.120 -9.390 5.310 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -6.477 -10.561 3.862 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -6.075 -11.309 5.395 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -5.464 -9.476 7.194 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -6.622 -8.144 7.259 1.00 0.00 H new ATOM 390 N SER A 25 -3.102 -7.438 2.942 1.00 0.00 N ATOM 391 CA SER A 25 -2.967 -5.954 2.960 1.00 0.00 C ATOM 392 C SER A 25 -1.608 -5.559 2.382 1.00 0.00 C ATOM 393 O SER A 25 -0.662 -6.318 2.430 1.00 0.00 O ATOM 394 CB SER A 25 -3.060 -5.561 4.435 1.00 0.00 C ATOM 395 OG SER A 25 -3.171 -6.735 5.230 1.00 0.00 O ATOM 0 H SER A 25 -2.248 -7.947 2.713 1.00 0.00 H new ATOM 0 HA SER A 25 -3.732 -5.456 2.364 1.00 0.00 H new ATOM 0 HB2 SER A 25 -2.177 -4.992 4.728 1.00 0.00 H new ATOM 0 HB3 SER A 25 -3.923 -4.916 4.597 1.00 0.00 H new ATOM 0 HG SER A 25 -3.229 -6.485 6.176 1.00 0.00 H new ATOM 401 N LEU A 26 -1.498 -4.386 1.830 1.00 0.00 N ATOM 402 CA LEU A 26 -0.189 -3.969 1.250 1.00 0.00 C ATOM 403 C LEU A 26 0.117 -2.514 1.597 1.00 0.00 C ATOM 404 O LEU A 26 -0.740 -1.660 1.545 1.00 0.00 O ATOM 405 CB LEU A 26 -0.349 -4.135 -0.261 1.00 0.00 C ATOM 406 CG LEU A 26 0.907 -4.789 -0.842 1.00 0.00 C ATOM 407 CD1 LEU A 26 1.018 -4.452 -2.330 1.00 0.00 C ATOM 408 CD2 LEU A 26 2.142 -4.262 -0.109 1.00 0.00 C ATOM 0 H LEU A 26 -2.250 -3.701 1.754 1.00 0.00 H new ATOM 0 HA LEU A 26 0.635 -4.564 1.643 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -1.224 -4.747 -0.479 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -0.515 -3.164 -0.728 1.00 0.00 H new ATOM 0 HG LEU A 26 0.842 -5.870 -0.718 1.00 0.00 H new ATOM 0 HD11 LEU A 26 1.913 -4.918 -2.743 1.00 0.00 H new ATOM 0 HD12 LEU A 26 0.139 -4.826 -2.854 1.00 0.00 H new ATOM 0 HD13 LEU A 26 1.082 -3.371 -2.454 1.00 0.00 H new ATOM 0 HD21 LEU A 26 3.037 -4.728 -0.522 1.00 0.00 H new ATOM 0 HD22 LEU A 26 2.205 -3.181 -0.233 1.00 0.00 H new ATOM 0 HD23 LEU A 26 2.065 -4.502 0.952 1.00 0.00 H new ATOM 420 N SER A 27 1.341 -2.228 1.947 1.00 0.00 N ATOM 421 CA SER A 27 1.712 -0.830 2.296 1.00 0.00 C ATOM 422 C SER A 27 2.865 -0.353 1.408 1.00 0.00 C ATOM 423 O SER A 27 3.649 -1.141 0.921 1.00 0.00 O ATOM 424 CB SER A 27 2.148 -0.894 3.757 1.00 0.00 C ATOM 425 OG SER A 27 1.478 0.121 4.492 1.00 0.00 O ATOM 0 H SER A 27 2.101 -2.905 2.006 1.00 0.00 H new ATOM 0 HA SER A 27 0.889 -0.131 2.147 1.00 0.00 H new ATOM 0 HB2 SER A 27 1.917 -1.874 4.175 1.00 0.00 H new ATOM 0 HB3 SER A 27 3.227 -0.761 3.833 1.00 0.00 H new ATOM 0 HG SER A 27 0.510 -0.029 4.450 1.00 0.00 H new ATOM 431 N VAL A 28 2.971 0.928 1.190 1.00 0.00 N ATOM 432 CA VAL A 28 4.072 1.447 0.330 1.00 0.00 C ATOM 433 C VAL A 28 4.595 2.776 0.878 1.00 0.00 C ATOM 434 O VAL A 28 3.881 3.756 0.945 1.00 0.00 O ATOM 435 CB VAL A 28 3.437 1.649 -1.046 1.00 0.00 C ATOM 436 CG1 VAL A 28 4.341 2.539 -1.902 1.00 0.00 C ATOM 437 CG2 VAL A 28 3.265 0.292 -1.731 1.00 0.00 C ATOM 0 H VAL A 28 2.344 1.638 1.569 1.00 0.00 H new ATOM 0 HA VAL A 28 4.921 0.765 0.293 1.00 0.00 H new ATOM 0 HB VAL A 28 2.464 2.126 -0.929 1.00 0.00 H new ATOM 0 HG11 VAL A 28 3.887 2.682 -2.883 1.00 0.00 H new ATOM 0 HG12 VAL A 28 4.466 3.506 -1.415 1.00 0.00 H new ATOM 0 HG13 VAL A 28 5.315 2.063 -2.019 1.00 0.00 H new ATOM 0 HG21 VAL A 28 2.812 0.435 -2.712 1.00 0.00 H new ATOM 0 HG22 VAL A 28 4.239 -0.183 -1.846 1.00 0.00 H new ATOM 0 HG23 VAL A 28 2.621 -0.343 -1.123 1.00 0.00 H new ATOM 447 N THR A 29 5.842 2.820 1.264 1.00 0.00 N ATOM 448 CA THR A 29 6.410 4.090 1.800 1.00 0.00 C ATOM 449 C THR A 29 7.653 4.476 0.992 1.00 0.00 C ATOM 450 O THR A 29 8.543 3.671 0.799 1.00 0.00 O ATOM 451 CB THR A 29 6.786 3.777 3.250 1.00 0.00 C ATOM 452 OG1 THR A 29 7.287 4.952 3.870 1.00 0.00 O ATOM 453 CG2 THR A 29 7.856 2.686 3.277 1.00 0.00 C ATOM 0 H THR A 29 6.490 2.033 1.231 1.00 0.00 H new ATOM 0 HA THR A 29 5.710 4.923 1.737 1.00 0.00 H new ATOM 0 HB THR A 29 5.904 3.429 3.789 1.00 0.00 H new ATOM 0 HG1 THR A 29 6.661 5.691 3.724 1.00 0.00 H new ATOM 0 HG21 THR A 29 8.123 2.464 4.310 1.00 0.00 H new ATOM 0 HG22 THR A 29 7.469 1.785 2.800 1.00 0.00 H new ATOM 0 HG23 THR A 29 8.740 3.030 2.740 1.00 0.00 H new ATOM 461 N PRO A 30 7.666 5.698 0.538 1.00 0.00 N ATOM 462 CA PRO A 30 8.806 6.198 -0.271 1.00 0.00 C ATOM 463 C PRO A 30 10.047 6.408 0.602 1.00 0.00 C ATOM 464 O PRO A 30 10.016 6.178 1.795 1.00 0.00 O ATOM 465 CB PRO A 30 8.291 7.524 -0.827 1.00 0.00 C ATOM 466 CG PRO A 30 7.233 7.964 0.135 1.00 0.00 C ATOM 467 CD PRO A 30 6.632 6.719 0.731 1.00 0.00 C ATOM 0 HA PRO A 30 9.113 5.502 -1.052 1.00 0.00 H new ATOM 0 HB2 PRO A 30 9.092 8.260 -0.896 1.00 0.00 H new ATOM 0 HB3 PRO A 30 7.884 7.400 -1.831 1.00 0.00 H new ATOM 0 HG2 PRO A 30 7.659 8.597 0.913 1.00 0.00 H new ATOM 0 HG3 PRO A 30 6.471 8.554 -0.374 1.00 0.00 H new ATOM 0 HD2 PRO A 30 6.398 6.855 1.787 1.00 0.00 H new ATOM 0 HD3 PRO A 30 5.703 6.446 0.231 1.00 0.00 H new ATOM 475 N PRO A 31 11.108 6.835 -0.033 1.00 0.00 N ATOM 476 CA PRO A 31 12.389 7.076 0.683 1.00 0.00 C ATOM 477 C PRO A 31 12.285 8.280 1.616 1.00 0.00 C ATOM 478 O PRO A 31 11.794 9.329 1.251 1.00 0.00 O ATOM 479 CB PRO A 31 13.383 7.345 -0.446 1.00 0.00 C ATOM 480 CG PRO A 31 12.548 7.828 -1.585 1.00 0.00 C ATOM 481 CD PRO A 31 11.217 7.133 -1.467 1.00 0.00 C ATOM 0 HA PRO A 31 12.680 6.239 1.318 1.00 0.00 H new ATOM 0 HB2 PRO A 31 14.121 8.091 -0.153 1.00 0.00 H new ATOM 0 HB3 PRO A 31 13.931 6.442 -0.713 1.00 0.00 H new ATOM 0 HG2 PRO A 31 12.425 8.910 -1.544 1.00 0.00 H new ATOM 0 HG3 PRO A 31 13.023 7.597 -2.539 1.00 0.00 H new ATOM 0 HD2 PRO A 31 10.401 7.770 -1.807 1.00 0.00 H new ATOM 0 HD3 PRO A 31 11.184 6.225 -2.069 1.00 0.00 H new ATOM 564 N THR A 38 12.950 3.255 -1.682 1.00 0.00 N ATOM 565 CA THR A 38 11.489 2.972 -1.575 1.00 0.00 C ATOM 566 C THR A 38 11.265 1.586 -0.969 1.00 0.00 C ATOM 567 O THR A 38 11.987 0.652 -1.254 1.00 0.00 O ATOM 568 CB THR A 38 10.965 3.021 -3.011 1.00 0.00 C ATOM 569 OG1 THR A 38 12.012 3.420 -3.884 1.00 0.00 O ATOM 570 CG2 THR A 38 9.811 4.020 -3.104 1.00 0.00 C ATOM 0 HA THR A 38 10.976 3.688 -0.933 1.00 0.00 H new ATOM 0 HB THR A 38 10.609 2.032 -3.300 1.00 0.00 H new ATOM 0 HG1 THR A 38 12.872 3.342 -3.420 1.00 0.00 H new ATOM 0 HG21 THR A 38 9.440 4.053 -4.128 1.00 0.00 H new ATOM 0 HG22 THR A 38 9.007 3.710 -2.436 1.00 0.00 H new ATOM 0 HG23 THR A 38 10.163 5.010 -2.814 1.00 0.00 H new ATOM 578 N GLU A 39 10.275 1.444 -0.132 1.00 0.00 N ATOM 579 CA GLU A 39 10.022 0.115 0.488 1.00 0.00 C ATOM 580 C GLU A 39 8.521 -0.144 0.630 1.00 0.00 C ATOM 581 O GLU A 39 7.726 0.771 0.714 1.00 0.00 O ATOM 582 CB GLU A 39 10.678 0.194 1.863 1.00 0.00 C ATOM 583 CG GLU A 39 11.152 -1.196 2.267 1.00 0.00 C ATOM 584 CD GLU A 39 12.475 -1.088 3.027 1.00 0.00 C ATOM 585 OE1 GLU A 39 13.462 -0.721 2.409 1.00 0.00 O ATOM 586 OE2 GLU A 39 12.480 -1.371 4.213 1.00 0.00 O ATOM 0 H GLU A 39 9.634 2.186 0.148 1.00 0.00 H new ATOM 0 HA GLU A 39 10.422 -0.698 -0.118 1.00 0.00 H new ATOM 0 HB2 GLU A 39 11.519 0.887 1.839 1.00 0.00 H new ATOM 0 HB3 GLU A 39 9.969 0.578 2.597 1.00 0.00 H new ATOM 0 HG2 GLU A 39 10.401 -1.680 2.892 1.00 0.00 H new ATOM 0 HG3 GLU A 39 11.280 -1.819 1.382 1.00 0.00 H new ATOM 593 N VAL A 40 8.131 -1.390 0.657 1.00 0.00 N ATOM 594 CA VAL A 40 6.683 -1.715 0.794 1.00 0.00 C ATOM 595 C VAL A 40 6.454 -2.622 2.008 1.00 0.00 C ATOM 596 O VAL A 40 7.354 -3.291 2.473 1.00 0.00 O ATOM 597 CB VAL A 40 6.328 -2.448 -0.501 1.00 0.00 C ATOM 598 CG1 VAL A 40 4.897 -2.985 -0.424 1.00 0.00 C ATOM 599 CG2 VAL A 40 6.441 -1.478 -1.677 1.00 0.00 C ATOM 0 H VAL A 40 8.752 -2.196 0.590 1.00 0.00 H new ATOM 0 HA VAL A 40 6.069 -0.827 0.946 1.00 0.00 H new ATOM 0 HB VAL A 40 7.016 -3.282 -0.640 1.00 0.00 H new ATOM 0 HG11 VAL A 40 4.653 -3.505 -1.350 1.00 0.00 H new ATOM 0 HG12 VAL A 40 4.813 -3.677 0.414 1.00 0.00 H new ATOM 0 HG13 VAL A 40 4.204 -2.156 -0.281 1.00 0.00 H new ATOM 0 HG21 VAL A 40 6.189 -1.997 -2.602 1.00 0.00 H new ATOM 0 HG22 VAL A 40 5.754 -0.645 -1.529 1.00 0.00 H new ATOM 0 HG23 VAL A 40 7.461 -1.100 -1.740 1.00 0.00 H new ATOM 609 N ILE A 41 5.254 -2.656 2.515 1.00 0.00 N ATOM 610 CA ILE A 41 4.955 -3.529 3.686 1.00 0.00 C ATOM 611 C ILE A 41 3.640 -4.261 3.441 1.00 0.00 C ATOM 612 O ILE A 41 2.574 -3.682 3.492 1.00 0.00 O ATOM 613 CB ILE A 41 4.835 -2.587 4.883 1.00 0.00 C ATOM 614 CG1 ILE A 41 5.875 -1.469 4.765 1.00 0.00 C ATOM 615 CG2 ILE A 41 5.077 -3.368 6.175 1.00 0.00 C ATOM 616 CD1 ILE A 41 5.745 -0.523 5.961 1.00 0.00 C ATOM 0 H ILE A 41 4.463 -2.114 2.168 1.00 0.00 H new ATOM 0 HA ILE A 41 5.726 -4.281 3.855 1.00 0.00 H new ATOM 0 HB ILE A 41 3.835 -2.153 4.900 1.00 0.00 H new ATOM 0 HG12 ILE A 41 6.878 -1.893 4.731 1.00 0.00 H new ATOM 0 HG13 ILE A 41 5.730 -0.919 3.835 1.00 0.00 H new ATOM 0 HG21 ILE A 41 4.991 -2.695 7.028 1.00 0.00 H new ATOM 0 HG22 ILE A 41 4.337 -4.163 6.264 1.00 0.00 H new ATOM 0 HG23 ILE A 41 6.076 -3.803 6.155 1.00 0.00 H new ATOM 0 HD11 ILE A 41 6.485 0.273 5.877 1.00 0.00 H new ATOM 0 HD12 ILE A 41 4.745 -0.089 5.975 1.00 0.00 H new ATOM 0 HD13 ILE A 41 5.912 -1.078 6.884 1.00 0.00 H new ATOM 628 N ALA A 42 3.708 -5.526 3.149 1.00 0.00 N ATOM 629 CA ALA A 42 2.463 -6.289 2.869 1.00 0.00 C ATOM 630 C ALA A 42 2.183 -7.317 3.963 1.00 0.00 C ATOM 631 O ALA A 42 3.083 -7.909 4.524 1.00 0.00 O ATOM 632 CB ALA A 42 2.750 -6.990 1.546 1.00 0.00 C ATOM 0 H ALA A 42 4.572 -6.066 3.092 1.00 0.00 H new ATOM 0 HA ALA A 42 1.586 -5.643 2.831 1.00 0.00 H new ATOM 0 HB1 ALA A 42 1.884 -7.583 1.253 1.00 0.00 H new ATOM 0 HB2 ALA A 42 2.957 -6.246 0.777 1.00 0.00 H new ATOM 0 HB3 ALA A 42 3.615 -7.643 1.661 1.00 0.00 H new ATOM 638 N THR A 43 0.931 -7.550 4.249 1.00 0.00 N ATOM 639 CA THR A 43 0.574 -8.557 5.285 1.00 0.00 C ATOM 640 C THR A 43 -0.042 -9.775 4.600 1.00 0.00 C ATOM 641 O THR A 43 -0.535 -9.686 3.494 1.00 0.00 O ATOM 642 CB THR A 43 -0.454 -7.875 6.191 1.00 0.00 C ATOM 643 OG1 THR A 43 0.188 -6.864 6.955 1.00 0.00 O ATOM 644 CG2 THR A 43 -1.077 -8.914 7.131 1.00 0.00 C ATOM 0 H THR A 43 0.138 -7.084 3.808 1.00 0.00 H new ATOM 0 HA THR A 43 1.439 -8.893 5.857 1.00 0.00 H new ATOM 0 HB THR A 43 -1.237 -7.426 5.581 1.00 0.00 H new ATOM 0 HG1 THR A 43 -0.469 -6.425 7.535 1.00 0.00 H new ATOM 0 HG21 THR A 43 -1.809 -8.428 7.776 1.00 0.00 H new ATOM 0 HG22 THR A 43 -1.569 -9.688 6.542 1.00 0.00 H new ATOM 0 HG23 THR A 43 -0.296 -9.365 7.743 1.00 0.00 H new ATOM 652 N LEU A 44 -0.004 -10.911 5.230 1.00 0.00 N ATOM 653 CA LEU A 44 -0.569 -12.128 4.587 1.00 0.00 C ATOM 654 C LEU A 44 -1.864 -12.566 5.272 1.00 0.00 C ATOM 655 O LEU A 44 -2.266 -12.017 6.278 1.00 0.00 O ATOM 656 CB LEU A 44 0.508 -13.184 4.782 1.00 0.00 C ATOM 657 CG LEU A 44 1.740 -12.820 3.960 1.00 0.00 C ATOM 658 CD1 LEU A 44 2.699 -14.009 3.933 1.00 0.00 C ATOM 659 CD2 LEU A 44 1.313 -12.476 2.535 1.00 0.00 C ATOM 0 H LEU A 44 0.392 -11.052 6.159 1.00 0.00 H new ATOM 0 HA LEU A 44 -0.819 -11.959 3.540 1.00 0.00 H new ATOM 0 HB2 LEU A 44 0.772 -13.258 5.837 1.00 0.00 H new ATOM 0 HB3 LEU A 44 0.132 -14.161 4.478 1.00 0.00 H new ATOM 0 HG LEU A 44 2.239 -11.960 4.407 1.00 0.00 H new ATOM 0 HD11 LEU A 44 3.581 -13.752 3.346 1.00 0.00 H new ATOM 0 HD12 LEU A 44 3.000 -14.257 4.951 1.00 0.00 H new ATOM 0 HD13 LEU A 44 2.201 -14.868 3.483 1.00 0.00 H new ATOM 0 HD21 LEU A 44 2.192 -12.215 1.945 1.00 0.00 H new ATOM 0 HD22 LEU A 44 0.817 -13.336 2.086 1.00 0.00 H new ATOM 0 HD23 LEU A 44 0.626 -11.630 2.555 1.00 0.00 H new ATOM 671 N LYS A 45 -2.518 -13.558 4.728 1.00 0.00 N ATOM 672 CA LYS A 45 -3.786 -14.041 5.342 1.00 0.00 C ATOM 673 C LYS A 45 -3.487 -15.113 6.389 1.00 0.00 C ATOM 674 O LYS A 45 -3.067 -16.207 6.070 1.00 0.00 O ATOM 675 CB LYS A 45 -4.588 -14.635 4.184 1.00 0.00 C ATOM 676 CG LYS A 45 -5.816 -13.764 3.914 1.00 0.00 C ATOM 677 CD LYS A 45 -7.056 -14.654 3.792 1.00 0.00 C ATOM 678 CE LYS A 45 -6.753 -15.829 2.860 1.00 0.00 C ATOM 679 NZ LYS A 45 -7.831 -15.791 1.833 1.00 0.00 N ATOM 0 H LYS A 45 -2.228 -14.054 3.885 1.00 0.00 H new ATOM 0 HA LYS A 45 -4.330 -13.243 5.847 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -3.967 -14.694 3.290 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -4.896 -15.652 4.425 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -5.950 -13.045 4.722 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -5.675 -13.191 2.997 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -7.350 -15.022 4.775 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -7.895 -14.076 3.404 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -5.768 -15.727 2.403 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -6.757 -16.775 3.402 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -7.693 -16.568 1.156 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -8.756 -15.897 2.297 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -7.798 -14.882 1.329 1.00 0.00 H new ATOM 693 N GLY A 46 -3.701 -14.809 7.639 1.00 0.00 N ATOM 694 CA GLY A 46 -3.428 -15.811 8.702 1.00 0.00 C ATOM 695 C GLY A 46 -2.647 -15.152 9.840 1.00 0.00 C ATOM 696 O GLY A 46 -2.743 -15.552 10.983 1.00 0.00 O ATOM 0 H GLY A 46 -4.053 -13.910 7.968 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -4.365 -16.220 9.080 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -2.859 -16.645 8.292 1.00 0.00 H new ATOM 700 N GLY A 47 -1.870 -14.146 9.539 1.00 0.00 N ATOM 701 CA GLY A 47 -1.087 -13.471 10.608 1.00 0.00 C ATOM 702 C GLY A 47 0.403 -13.568 10.286 1.00 0.00 C ATOM 703 O GLY A 47 1.116 -14.395 10.817 1.00 0.00 O ATOM 0 H GLY A 47 -1.745 -13.765 8.601 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -1.386 -12.426 10.687 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -1.293 -13.935 11.573 1.00 0.00 H new ATOM 707 N GLN A 48 0.873 -12.726 9.413 1.00 0.00 N ATOM 708 CA GLN A 48 2.314 -12.754 9.041 1.00 0.00 C ATOM 709 C GLN A 48 2.589 -11.669 8.000 1.00 0.00 C ATOM 710 O GLN A 48 2.271 -11.819 6.837 1.00 0.00 O ATOM 711 CB GLN A 48 2.545 -14.144 8.448 1.00 0.00 C ATOM 712 CG GLN A 48 3.460 -14.947 9.373 1.00 0.00 C ATOM 713 CD GLN A 48 4.720 -15.359 8.612 1.00 0.00 C ATOM 714 OE1 GLN A 48 5.744 -14.713 8.713 1.00 0.00 O ATOM 715 NE2 GLN A 48 4.688 -16.416 7.848 1.00 0.00 N ATOM 0 H GLN A 48 0.318 -12.014 8.937 1.00 0.00 H new ATOM 0 HA GLN A 48 2.973 -12.567 9.889 1.00 0.00 H new ATOM 0 HB2 GLN A 48 1.593 -14.660 8.323 1.00 0.00 H new ATOM 0 HB3 GLN A 48 2.994 -14.059 7.459 1.00 0.00 H new ATOM 0 HG2 GLN A 48 3.728 -14.350 10.245 1.00 0.00 H new ATOM 0 HG3 GLN A 48 2.939 -15.831 9.740 1.00 0.00 H new ATOM 0 HE21 GLN A 48 3.828 -16.958 7.763 1.00 0.00 H new ATOM 0 HE22 GLN A 48 5.523 -16.700 7.335 1.00 0.00 H new ATOM 724 N LYS A 49 3.158 -10.572 8.408 1.00 0.00 N ATOM 725 CA LYS A 49 3.429 -9.477 7.438 1.00 0.00 C ATOM 726 C LYS A 49 4.920 -9.345 7.164 1.00 0.00 C ATOM 727 O LYS A 49 5.748 -9.972 7.796 1.00 0.00 O ATOM 728 CB LYS A 49 2.903 -8.216 8.118 1.00 0.00 C ATOM 729 CG LYS A 49 3.351 -6.970 7.353 1.00 0.00 C ATOM 730 CD LYS A 49 2.751 -5.725 8.011 1.00 0.00 C ATOM 731 CE LYS A 49 3.140 -5.692 9.491 1.00 0.00 C ATOM 732 NZ LYS A 49 2.468 -4.480 10.038 1.00 0.00 N ATOM 0 H LYS A 49 3.447 -10.386 9.368 1.00 0.00 H new ATOM 0 HA LYS A 49 2.953 -9.663 6.475 1.00 0.00 H new ATOM 0 HB2 LYS A 49 1.815 -8.249 8.167 1.00 0.00 H new ATOM 0 HB3 LYS A 49 3.267 -8.170 9.145 1.00 0.00 H new ATOM 0 HG2 LYS A 49 4.439 -6.904 7.349 1.00 0.00 H new ATOM 0 HG3 LYS A 49 3.032 -7.034 6.313 1.00 0.00 H new ATOM 0 HD2 LYS A 49 3.111 -4.827 7.509 1.00 0.00 H new ATOM 0 HD3 LYS A 49 1.666 -5.734 7.909 1.00 0.00 H new ATOM 0 HE2 LYS A 49 2.809 -6.594 10.006 1.00 0.00 H new ATOM 0 HE3 LYS A 49 4.221 -5.633 9.614 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 2.687 -4.389 11.050 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 2.808 -3.637 9.533 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 1.439 -4.567 9.913 1.00 0.00 H new ATOM 746 N VAL A 50 5.253 -8.526 6.218 1.00 0.00 N ATOM 747 CA VAL A 50 6.688 -8.318 5.860 1.00 0.00 C ATOM 748 C VAL A 50 6.829 -7.102 4.941 1.00 0.00 C ATOM 749 O VAL A 50 5.912 -6.320 4.786 1.00 0.00 O ATOM 750 CB VAL A 50 7.112 -9.592 5.126 1.00 0.00 C ATOM 751 CG1 VAL A 50 7.545 -10.652 6.140 1.00 0.00 C ATOM 752 CG2 VAL A 50 5.938 -10.127 4.301 1.00 0.00 C ATOM 0 H VAL A 50 4.590 -7.982 5.666 1.00 0.00 H new ATOM 0 HA VAL A 50 7.306 -8.133 6.738 1.00 0.00 H new ATOM 0 HB VAL A 50 7.946 -9.362 4.464 1.00 0.00 H new ATOM 0 HG11 VAL A 50 7.846 -11.558 5.613 1.00 0.00 H new ATOM 0 HG12 VAL A 50 8.385 -10.275 6.724 1.00 0.00 H new ATOM 0 HG13 VAL A 50 6.713 -10.879 6.806 1.00 0.00 H new ATOM 0 HG21 VAL A 50 6.243 -11.034 3.780 1.00 0.00 H new ATOM 0 HG22 VAL A 50 5.101 -10.353 4.962 1.00 0.00 H new ATOM 0 HG23 VAL A 50 5.632 -9.375 3.573 1.00 0.00 H new ATOM 762 N CYS A 51 7.968 -6.938 4.327 1.00 0.00 N ATOM 763 CA CYS A 51 8.164 -5.777 3.416 1.00 0.00 C ATOM 764 C CYS A 51 8.235 -6.256 1.967 1.00 0.00 C ATOM 765 O CYS A 51 8.682 -7.351 1.686 1.00 0.00 O ATOM 766 CB CYS A 51 9.489 -5.155 3.853 1.00 0.00 C ATOM 767 SG CYS A 51 9.218 -4.119 5.312 1.00 0.00 S ATOM 0 H CYS A 51 8.772 -7.559 4.417 1.00 0.00 H new ATOM 0 HA CYS A 51 7.346 -5.059 3.469 1.00 0.00 H new ATOM 0 HB2 CYS A 51 10.213 -5.938 4.079 1.00 0.00 H new ATOM 0 HB3 CYS A 51 9.907 -4.558 3.043 1.00 0.00 H new ATOM 0 HG CYS A 51 10.346 -3.591 5.685 1.00 0.00 H new ATOM 772 N LEU A 52 7.772 -5.457 1.046 1.00 0.00 N ATOM 773 CA LEU A 52 7.783 -5.873 -0.371 1.00 0.00 C ATOM 774 C LEU A 52 8.807 -5.070 -1.179 1.00 0.00 C ATOM 775 O LEU A 52 9.306 -4.050 -0.739 1.00 0.00 O ATOM 776 CB LEU A 52 6.369 -5.560 -0.832 1.00 0.00 C ATOM 777 CG LEU A 52 5.678 -6.849 -1.266 1.00 0.00 C ATOM 778 CD1 LEU A 52 4.164 -6.669 -1.163 1.00 0.00 C ATOM 779 CD2 LEU A 52 6.057 -7.175 -2.713 1.00 0.00 C ATOM 0 H LEU A 52 7.386 -4.530 1.222 1.00 0.00 H new ATOM 0 HA LEU A 52 8.061 -6.918 -0.504 1.00 0.00 H new ATOM 0 HB2 LEU A 52 5.808 -5.088 -0.025 1.00 0.00 H new ATOM 0 HB3 LEU A 52 6.394 -4.851 -1.660 1.00 0.00 H new ATOM 0 HG LEU A 52 5.995 -7.667 -0.619 1.00 0.00 H new ATOM 0 HD11 LEU A 52 3.666 -7.588 -1.472 1.00 0.00 H new ATOM 0 HD12 LEU A 52 3.894 -6.440 -0.132 1.00 0.00 H new ATOM 0 HD13 LEU A 52 3.850 -5.851 -1.811 1.00 0.00 H new ATOM 0 HD21 LEU A 52 5.562 -8.096 -3.020 1.00 0.00 H new ATOM 0 HD22 LEU A 52 5.742 -6.359 -3.364 1.00 0.00 H new ATOM 0 HD23 LEU A 52 7.137 -7.302 -2.786 1.00 0.00 H new ATOM 791 N ASP A 53 9.110 -5.542 -2.360 1.00 0.00 N ATOM 792 CA ASP A 53 10.096 -4.854 -3.248 1.00 0.00 C ATOM 793 C ASP A 53 9.868 -3.334 -3.262 1.00 0.00 C ATOM 794 O ASP A 53 9.191 -2.800 -2.409 1.00 0.00 O ATOM 795 CB ASP A 53 9.828 -5.454 -4.628 1.00 0.00 C ATOM 796 CG ASP A 53 11.131 -6.006 -5.211 1.00 0.00 C ATOM 797 OD1 ASP A 53 11.992 -6.382 -4.432 1.00 0.00 O ATOM 798 OD2 ASP A 53 11.247 -6.042 -6.424 1.00 0.00 O ATOM 0 H ASP A 53 8.708 -6.392 -2.755 1.00 0.00 H new ATOM 0 HA ASP A 53 11.124 -4.996 -2.916 1.00 0.00 H new ATOM 0 HB2 ASP A 53 9.086 -6.249 -4.552 1.00 0.00 H new ATOM 0 HB3 ASP A 53 9.414 -4.695 -5.291 1.00 0.00 H new ATOM 803 N PRO A 54 10.452 -2.682 -4.236 1.00 0.00 N ATOM 804 CA PRO A 54 10.315 -1.214 -4.347 1.00 0.00 C ATOM 805 C PRO A 54 9.001 -0.882 -5.044 1.00 0.00 C ATOM 806 O PRO A 54 8.968 -0.595 -6.224 1.00 0.00 O ATOM 807 CB PRO A 54 11.511 -0.811 -5.203 1.00 0.00 C ATOM 808 CG PRO A 54 11.865 -2.029 -6.006 1.00 0.00 C ATOM 809 CD PRO A 54 11.276 -3.239 -5.318 1.00 0.00 C ATOM 0 HA PRO A 54 10.300 -0.695 -3.389 1.00 0.00 H new ATOM 0 HB2 PRO A 54 11.262 0.028 -5.853 1.00 0.00 H new ATOM 0 HB3 PRO A 54 12.349 -0.495 -4.581 1.00 0.00 H new ATOM 0 HG2 PRO A 54 11.475 -1.942 -7.020 1.00 0.00 H new ATOM 0 HG3 PRO A 54 12.947 -2.128 -6.088 1.00 0.00 H new ATOM 0 HD2 PRO A 54 10.677 -3.835 -6.007 1.00 0.00 H new ATOM 0 HD3 PRO A 54 12.056 -3.892 -4.927 1.00 0.00 H new ATOM 817 N GLU A 55 7.910 -0.953 -4.332 1.00 0.00 N ATOM 818 CA GLU A 55 6.593 -0.682 -4.968 1.00 0.00 C ATOM 819 C GLU A 55 6.266 -1.861 -5.883 1.00 0.00 C ATOM 820 O GLU A 55 5.439 -1.773 -6.768 1.00 0.00 O ATOM 821 CB GLU A 55 6.780 0.620 -5.762 1.00 0.00 C ATOM 822 CG GLU A 55 6.800 0.330 -7.268 1.00 0.00 C ATOM 823 CD GLU A 55 7.488 1.483 -8.001 1.00 0.00 C ATOM 824 OE1 GLU A 55 8.602 1.815 -7.627 1.00 0.00 O ATOM 825 OE2 GLU A 55 6.892 2.013 -8.923 1.00 0.00 O ATOM 0 H GLU A 55 7.875 -1.187 -3.340 1.00 0.00 H new ATOM 0 HA GLU A 55 5.774 -0.572 -4.257 1.00 0.00 H new ATOM 0 HB2 GLU A 55 5.972 1.314 -5.530 1.00 0.00 H new ATOM 0 HB3 GLU A 55 7.711 1.103 -5.466 1.00 0.00 H new ATOM 0 HG2 GLU A 55 7.327 -0.604 -7.462 1.00 0.00 H new ATOM 0 HG3 GLU A 55 5.783 0.205 -7.639 1.00 0.00 H new ATOM 832 N ALA A 56 6.935 -2.965 -5.673 1.00 0.00 N ATOM 833 CA ALA A 56 6.699 -4.158 -6.527 1.00 0.00 C ATOM 834 C ALA A 56 6.573 -3.719 -7.985 1.00 0.00 C ATOM 835 O ALA A 56 5.521 -3.826 -8.578 1.00 0.00 O ATOM 836 CB ALA A 56 5.393 -4.773 -6.015 1.00 0.00 C ATOM 0 H ALA A 56 7.637 -3.088 -4.943 1.00 0.00 H new ATOM 0 HA ALA A 56 7.514 -4.881 -6.479 1.00 0.00 H new ATOM 0 HB1 ALA A 56 5.155 -5.661 -6.601 1.00 0.00 H new ATOM 0 HB2 ALA A 56 5.507 -5.049 -4.967 1.00 0.00 H new ATOM 0 HB3 ALA A 56 4.586 -4.047 -6.113 1.00 0.00 H new ATOM 842 N PRO A 57 7.664 -3.229 -8.512 1.00 0.00 N ATOM 843 CA PRO A 57 7.689 -2.760 -9.916 1.00 0.00 C ATOM 844 C PRO A 57 7.704 -3.962 -10.855 1.00 0.00 C ATOM 845 O PRO A 57 6.717 -4.278 -11.489 1.00 0.00 O ATOM 846 CB PRO A 57 8.989 -1.968 -10.009 1.00 0.00 C ATOM 847 CG PRO A 57 9.866 -2.523 -8.931 1.00 0.00 C ATOM 848 CD PRO A 57 8.966 -3.076 -7.854 1.00 0.00 C ATOM 0 HA PRO A 57 6.823 -2.160 -10.195 1.00 0.00 H new ATOM 0 HB2 PRO A 57 9.450 -2.083 -10.990 1.00 0.00 H new ATOM 0 HB3 PRO A 57 8.812 -0.902 -9.863 1.00 0.00 H new ATOM 0 HG2 PRO A 57 10.514 -3.305 -9.328 1.00 0.00 H new ATOM 0 HG3 PRO A 57 10.515 -1.746 -8.527 1.00 0.00 H new ATOM 0 HD2 PRO A 57 9.336 -4.030 -7.478 1.00 0.00 H new ATOM 0 HD3 PRO A 57 8.904 -2.399 -7.002 1.00 0.00 H new ATOM 856 N LEU A 58 8.804 -4.655 -10.931 1.00 0.00 N ATOM 857 CA LEU A 58 8.851 -5.850 -11.810 1.00 0.00 C ATOM 858 C LEU A 58 7.647 -6.735 -11.489 1.00 0.00 C ATOM 859 O LEU A 58 7.008 -7.280 -12.366 1.00 0.00 O ATOM 860 CB LEU A 58 10.159 -6.559 -11.453 1.00 0.00 C ATOM 861 CG LEU A 58 10.271 -7.860 -12.248 1.00 0.00 C ATOM 862 CD1 LEU A 58 10.585 -7.542 -13.711 1.00 0.00 C ATOM 863 CD2 LEU A 58 11.395 -8.718 -11.662 1.00 0.00 C ATOM 0 H LEU A 58 9.665 -4.447 -10.426 1.00 0.00 H new ATOM 0 HA LEU A 58 8.815 -5.607 -12.872 1.00 0.00 H new ATOM 0 HB2 LEU A 58 11.007 -5.912 -11.674 1.00 0.00 H new ATOM 0 HB3 LEU A 58 10.190 -6.770 -10.384 1.00 0.00 H new ATOM 0 HG LEU A 58 9.328 -8.403 -12.190 1.00 0.00 H new ATOM 0 HD11 LEU A 58 10.665 -8.471 -14.276 1.00 0.00 H new ATOM 0 HD12 LEU A 58 9.786 -6.930 -14.130 1.00 0.00 H new ATOM 0 HD13 LEU A 58 11.528 -6.999 -13.771 1.00 0.00 H new ATOM 0 HD21 LEU A 58 11.477 -9.646 -12.227 1.00 0.00 H new ATOM 0 HD22 LEU A 58 12.337 -8.173 -11.721 1.00 0.00 H new ATOM 0 HD23 LEU A 58 11.173 -8.946 -10.620 1.00 0.00 H new ATOM 875 N VAL A 59 7.329 -6.868 -10.227 1.00 0.00 N ATOM 876 CA VAL A 59 6.158 -7.704 -9.837 1.00 0.00 C ATOM 877 C VAL A 59 4.888 -6.850 -9.769 1.00 0.00 C ATOM 878 O VAL A 59 3.834 -7.323 -9.390 1.00 0.00 O ATOM 879 CB VAL A 59 6.506 -8.247 -8.457 1.00 0.00 C ATOM 880 CG1 VAL A 59 5.339 -9.086 -7.938 1.00 0.00 C ATOM 881 CG2 VAL A 59 7.759 -9.120 -8.556 1.00 0.00 C ATOM 0 H VAL A 59 7.830 -6.434 -9.452 1.00 0.00 H new ATOM 0 HA VAL A 59 5.965 -8.500 -10.556 1.00 0.00 H new ATOM 0 HB VAL A 59 6.694 -7.420 -7.773 1.00 0.00 H new ATOM 0 HG11 VAL A 59 5.583 -9.477 -6.950 1.00 0.00 H new ATOM 0 HG12 VAL A 59 4.446 -8.465 -7.872 1.00 0.00 H new ATOM 0 HG13 VAL A 59 5.155 -9.915 -8.621 1.00 0.00 H new ATOM 0 HG21 VAL A 59 8.010 -9.510 -7.569 1.00 0.00 H new ATOM 0 HG22 VAL A 59 7.571 -9.950 -9.237 1.00 0.00 H new ATOM 0 HG23 VAL A 59 8.590 -8.523 -8.932 1.00 0.00 H new ATOM 891 N GLN A 60 4.977 -5.598 -10.121 1.00 0.00 N ATOM 892 CA GLN A 60 3.770 -4.724 -10.060 1.00 0.00 C ATOM 893 C GLN A 60 2.600 -5.391 -10.775 1.00 0.00 C ATOM 894 O GLN A 60 1.501 -5.459 -10.259 1.00 0.00 O ATOM 895 CB GLN A 60 4.167 -3.423 -10.760 1.00 0.00 C ATOM 896 CG GLN A 60 3.293 -2.277 -10.238 1.00 0.00 C ATOM 897 CD GLN A 60 3.600 -2.020 -8.759 1.00 0.00 C ATOM 898 OE1 GLN A 60 3.512 -2.912 -7.941 1.00 0.00 O ATOM 899 NE2 GLN A 60 3.951 -0.822 -8.375 1.00 0.00 N ATOM 0 H GLN A 60 5.829 -5.142 -10.447 1.00 0.00 H new ATOM 0 HA GLN A 60 3.450 -4.541 -9.034 1.00 0.00 H new ATOM 0 HB2 GLN A 60 5.219 -3.205 -10.577 1.00 0.00 H new ATOM 0 HB3 GLN A 60 4.046 -3.526 -11.838 1.00 0.00 H new ATOM 0 HG2 GLN A 60 3.477 -1.373 -10.819 1.00 0.00 H new ATOM 0 HG3 GLN A 60 2.239 -2.526 -10.362 1.00 0.00 H new ATOM 0 HE21 GLN A 60 4.026 -0.069 -9.059 1.00 0.00 H new ATOM 0 HE22 GLN A 60 4.150 -0.640 -7.391 1.00 0.00 H new ATOM 908 N LYS A 61 2.824 -5.895 -11.953 1.00 0.00 N ATOM 909 CA LYS A 61 1.718 -6.568 -12.689 1.00 0.00 C ATOM 910 C LYS A 61 0.963 -7.487 -11.730 1.00 0.00 C ATOM 911 O LYS A 61 -0.244 -7.425 -11.609 1.00 0.00 O ATOM 912 CB LYS A 61 2.401 -7.376 -13.793 1.00 0.00 C ATOM 913 CG LYS A 61 1.380 -8.303 -14.454 1.00 0.00 C ATOM 914 CD LYS A 61 0.556 -7.511 -15.471 1.00 0.00 C ATOM 915 CE LYS A 61 -0.627 -8.360 -15.941 1.00 0.00 C ATOM 916 NZ LYS A 61 -1.073 -7.725 -17.212 1.00 0.00 N ATOM 0 H LYS A 61 3.721 -5.871 -12.438 1.00 0.00 H new ATOM 0 HA LYS A 61 0.996 -5.864 -13.104 1.00 0.00 H new ATOM 0 HB2 LYS A 61 2.832 -6.705 -14.535 1.00 0.00 H new ATOM 0 HB3 LYS A 61 3.222 -7.960 -13.376 1.00 0.00 H new ATOM 0 HG2 LYS A 61 1.890 -9.130 -14.948 1.00 0.00 H new ATOM 0 HG3 LYS A 61 0.725 -8.738 -13.699 1.00 0.00 H new ATOM 0 HD2 LYS A 61 0.197 -6.585 -15.022 1.00 0.00 H new ATOM 0 HD3 LYS A 61 1.178 -7.233 -16.322 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -0.331 -9.397 -16.100 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -1.427 -8.367 -15.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -1.883 -8.251 -17.597 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -1.355 -6.741 -17.028 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -0.293 -7.739 -17.899 1.00 0.00 H new ATOM 930 N ILE A 62 1.676 -8.322 -11.032 1.00 0.00 N ATOM 931 CA ILE A 62 1.018 -9.234 -10.056 1.00 0.00 C ATOM 932 C ILE A 62 0.420 -8.399 -8.924 1.00 0.00 C ATOM 933 O ILE A 62 -0.554 -8.780 -8.304 1.00 0.00 O ATOM 934 CB ILE A 62 2.143 -10.138 -9.551 1.00 0.00 C ATOM 935 CG1 ILE A 62 2.439 -11.214 -10.599 1.00 0.00 C ATOM 936 CG2 ILE A 62 1.717 -10.808 -8.246 1.00 0.00 C ATOM 937 CD1 ILE A 62 1.232 -12.145 -10.734 1.00 0.00 C ATOM 0 H ILE A 62 2.690 -8.414 -11.095 1.00 0.00 H new ATOM 0 HA ILE A 62 0.206 -9.820 -10.485 1.00 0.00 H new ATOM 0 HB ILE A 62 3.037 -9.539 -9.376 1.00 0.00 H new ATOM 0 HG12 ILE A 62 2.662 -10.749 -11.559 1.00 0.00 H new ATOM 0 HG13 ILE A 62 3.321 -11.785 -10.309 1.00 0.00 H new ATOM 0 HG21 ILE A 62 2.521 -11.452 -7.888 1.00 0.00 H new ATOM 0 HG22 ILE A 62 1.503 -10.045 -7.498 1.00 0.00 H new ATOM 0 HG23 ILE A 62 0.823 -11.406 -8.419 1.00 0.00 H new ATOM 0 HD11 ILE A 62 1.445 -12.910 -11.480 1.00 0.00 H new ATOM 0 HD12 ILE A 62 1.030 -12.620 -9.774 1.00 0.00 H new ATOM 0 HD13 ILE A 62 0.360 -11.568 -11.044 1.00 0.00 H new ATOM 949 N ILE A 63 0.976 -7.243 -8.674 1.00 0.00 N ATOM 950 CA ILE A 63 0.420 -6.362 -7.614 1.00 0.00 C ATOM 951 C ILE A 63 -0.877 -5.765 -8.134 1.00 0.00 C ATOM 952 O ILE A 63 -1.914 -5.854 -7.509 1.00 0.00 O ATOM 953 CB ILE A 63 1.489 -5.288 -7.398 1.00 0.00 C ATOM 954 CG1 ILE A 63 2.159 -5.515 -6.045 1.00 0.00 C ATOM 955 CG2 ILE A 63 0.860 -3.895 -7.434 1.00 0.00 C ATOM 956 CD1 ILE A 63 2.526 -6.991 -5.924 1.00 0.00 C ATOM 0 H ILE A 63 1.793 -6.873 -9.161 1.00 0.00 H new ATOM 0 HA ILE A 63 0.196 -6.875 -6.679 1.00 0.00 H new ATOM 0 HB ILE A 63 2.230 -5.355 -8.195 1.00 0.00 H new ATOM 0 HG12 ILE A 63 3.051 -4.895 -5.956 1.00 0.00 H new ATOM 0 HG13 ILE A 63 1.487 -5.225 -5.237 1.00 0.00 H new ATOM 0 HG21 ILE A 63 1.633 -3.143 -7.279 1.00 0.00 H new ATOM 0 HG22 ILE A 63 0.387 -3.734 -8.403 1.00 0.00 H new ATOM 0 HG23 ILE A 63 0.111 -3.813 -6.646 1.00 0.00 H new ATOM 0 HD11 ILE A 63 3.006 -7.169 -4.962 1.00 0.00 H new ATOM 0 HD12 ILE A 63 1.623 -7.598 -5.997 1.00 0.00 H new ATOM 0 HD13 ILE A 63 3.211 -7.263 -6.727 1.00 0.00 H new ATOM 968 N GLN A 64 -0.832 -5.193 -9.300 1.00 0.00 N ATOM 969 CA GLN A 64 -2.080 -4.635 -9.880 1.00 0.00 C ATOM 970 C GLN A 64 -3.148 -5.717 -9.782 1.00 0.00 C ATOM 971 O GLN A 64 -4.329 -5.446 -9.693 1.00 0.00 O ATOM 972 CB GLN A 64 -1.747 -4.319 -11.338 1.00 0.00 C ATOM 973 CG GLN A 64 -0.930 -3.026 -11.405 1.00 0.00 C ATOM 974 CD GLN A 64 -1.167 -2.340 -12.751 1.00 0.00 C ATOM 975 OE1 GLN A 64 -0.576 -2.705 -13.747 1.00 0.00 O ATOM 976 NE2 GLN A 64 -2.016 -1.350 -12.823 1.00 0.00 N ATOM 0 H GLN A 64 0.006 -5.088 -9.872 1.00 0.00 H new ATOM 0 HA GLN A 64 -2.443 -3.741 -9.373 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -1.184 -5.141 -11.780 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -2.664 -4.213 -11.917 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -1.216 -2.360 -10.591 1.00 0.00 H new ATOM 0 HG3 GLN A 64 0.130 -3.247 -11.279 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -2.513 -1.043 -11.987 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -2.182 -0.884 -13.715 1.00 0.00 H new ATOM 985 N LYS A 65 -2.721 -6.953 -9.764 1.00 0.00 N ATOM 986 CA LYS A 65 -3.682 -8.077 -9.633 1.00 0.00 C ATOM 987 C LYS A 65 -4.221 -8.088 -8.205 1.00 0.00 C ATOM 988 O LYS A 65 -5.381 -8.364 -7.964 1.00 0.00 O ATOM 989 CB LYS A 65 -2.868 -9.340 -9.917 1.00 0.00 C ATOM 990 CG LYS A 65 -3.738 -10.351 -10.667 1.00 0.00 C ATOM 991 CD LYS A 65 -4.506 -11.212 -9.661 1.00 0.00 C ATOM 992 CE LYS A 65 -3.568 -12.265 -9.067 1.00 0.00 C ATOM 993 NZ LYS A 65 -4.442 -13.126 -8.224 1.00 0.00 N ATOM 0 H LYS A 65 -1.742 -7.229 -9.835 1.00 0.00 H new ATOM 0 HA LYS A 65 -4.531 -7.999 -10.312 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -1.987 -9.092 -10.509 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -2.512 -9.774 -8.983 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -4.436 -9.830 -11.323 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -3.115 -10.982 -11.301 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -4.915 -10.586 -8.868 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -5.350 -11.697 -10.151 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -3.079 -12.845 -9.850 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -2.779 -11.802 -8.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -3.870 -13.874 -7.782 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -4.889 -12.548 -7.484 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -5.179 -13.559 -8.817 1.00 0.00 H new ATOM 1007 N ILE A 66 -3.382 -7.766 -7.257 1.00 0.00 N ATOM 1008 CA ILE A 66 -3.834 -7.729 -5.840 1.00 0.00 C ATOM 1009 C ILE A 66 -4.664 -6.465 -5.617 1.00 0.00 C ATOM 1010 O ILE A 66 -5.637 -6.463 -4.888 1.00 0.00 O ATOM 1011 CB ILE A 66 -2.550 -7.709 -5.001 1.00 0.00 C ATOM 1012 CG1 ILE A 66 -2.771 -8.519 -3.721 1.00 0.00 C ATOM 1013 CG2 ILE A 66 -2.182 -6.270 -4.629 1.00 0.00 C ATOM 1014 CD1 ILE A 66 -1.886 -9.767 -3.745 1.00 0.00 C ATOM 0 H ILE A 66 -2.402 -7.527 -7.405 1.00 0.00 H new ATOM 0 HA ILE A 66 -4.458 -8.580 -5.569 1.00 0.00 H new ATOM 0 HB ILE A 66 -1.738 -8.144 -5.584 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -2.535 -7.910 -2.848 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -3.819 -8.806 -3.636 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -1.269 -6.270 -4.034 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -2.023 -5.689 -5.537 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -2.992 -5.825 -4.051 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -2.044 -10.343 -2.833 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -2.143 -10.379 -4.610 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -0.839 -9.470 -3.809 1.00 0.00 H new ATOM 1026 N LEU A 67 -4.291 -5.395 -6.262 1.00 0.00 N ATOM 1027 CA LEU A 67 -5.058 -4.128 -6.120 1.00 0.00 C ATOM 1028 C LEU A 67 -6.405 -4.275 -6.826 1.00 0.00 C ATOM 1029 O LEU A 67 -7.412 -3.753 -6.390 1.00 0.00 O ATOM 1030 CB LEU A 67 -4.198 -3.069 -6.812 1.00 0.00 C ATOM 1031 CG LEU A 67 -3.243 -2.441 -5.796 1.00 0.00 C ATOM 1032 CD1 LEU A 67 -1.958 -3.265 -5.729 1.00 0.00 C ATOM 1033 CD2 LEU A 67 -2.910 -1.011 -6.227 1.00 0.00 C ATOM 0 H LEU A 67 -3.484 -5.344 -6.884 1.00 0.00 H new ATOM 0 HA LEU A 67 -5.260 -3.865 -5.082 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -3.633 -3.521 -7.627 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -4.833 -2.301 -7.252 1.00 0.00 H new ATOM 0 HG LEU A 67 -3.716 -2.424 -4.814 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -1.277 -2.818 -5.005 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -2.195 -4.284 -5.423 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -1.485 -3.281 -6.711 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -2.229 -0.562 -5.504 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -2.437 -1.028 -7.209 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -3.827 -0.423 -6.276 1.00 0.00 H new ATOM 1045 N ASN A 68 -6.423 -4.993 -7.914 1.00 0.00 N ATOM 1046 CA ASN A 68 -7.695 -5.195 -8.659 1.00 0.00 C ATOM 1047 C ASN A 68 -8.413 -6.445 -8.142 1.00 0.00 C ATOM 1048 O ASN A 68 -9.374 -6.905 -8.725 1.00 0.00 O ATOM 1049 CB ASN A 68 -7.276 -5.382 -10.116 1.00 0.00 C ATOM 1050 CG ASN A 68 -8.271 -4.666 -11.030 1.00 0.00 C ATOM 1051 OD1 ASN A 68 -9.283 -5.226 -11.403 1.00 0.00 O ATOM 1052 ND2 ASN A 68 -8.027 -3.440 -11.409 1.00 0.00 N ATOM 0 H ASN A 68 -5.607 -5.450 -8.320 1.00 0.00 H new ATOM 0 HA ASN A 68 -8.383 -4.358 -8.539 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -6.273 -4.984 -10.271 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -7.239 -6.443 -10.361 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -8.686 -2.954 -12.017 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -7.178 -2.969 -11.097 1.00 0.00 H new ATOM 1059 N LYS A 69 -7.951 -7.000 -7.052 1.00 0.00 N ATOM 1060 CA LYS A 69 -8.607 -8.222 -6.502 1.00 0.00 C ATOM 1061 C LYS A 69 -9.914 -7.863 -5.802 1.00 0.00 C ATOM 1062 O LYS A 69 -10.512 -8.669 -5.117 1.00 0.00 O ATOM 1063 CB LYS A 69 -7.603 -8.813 -5.513 1.00 0.00 C ATOM 1064 CG LYS A 69 -7.122 -10.172 -6.021 1.00 0.00 C ATOM 1065 CD LYS A 69 -6.548 -10.981 -4.856 1.00 0.00 C ATOM 1066 CE LYS A 69 -7.642 -11.872 -4.265 1.00 0.00 C ATOM 1067 NZ LYS A 69 -8.034 -11.205 -2.993 1.00 0.00 N ATOM 0 H LYS A 69 -7.150 -6.660 -6.520 1.00 0.00 H new ATOM 0 HA LYS A 69 -8.863 -8.933 -7.288 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -6.756 -8.138 -5.392 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -8.065 -8.923 -4.532 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -7.949 -10.713 -6.480 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -6.363 -10.036 -6.791 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -5.713 -11.592 -5.200 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -6.158 -10.310 -4.091 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -8.491 -11.958 -4.944 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -7.274 -12.882 -4.084 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -8.479 -11.899 -2.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -7.189 -10.810 -2.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -8.708 -10.439 -3.196 1.00 0.00 H new ATOM 1310 N LYS B 13 -15.661 6.115 3.932 1.00 0.00 N ATOM 1311 CA LYS B 13 -15.389 6.520 2.525 1.00 0.00 C ATOM 1312 C LYS B 13 -13.886 6.439 2.253 1.00 0.00 C ATOM 1313 O LYS B 13 -13.136 5.891 3.037 1.00 0.00 O ATOM 1314 CB LYS B 13 -15.873 7.966 2.425 1.00 0.00 C ATOM 1315 CG LYS B 13 -17.313 7.989 1.909 1.00 0.00 C ATOM 1316 CD LYS B 13 -17.534 9.251 1.074 1.00 0.00 C ATOM 1317 CE LYS B 13 -17.123 8.983 -0.376 1.00 0.00 C ATOM 1318 NZ LYS B 13 -15.810 9.667 -0.535 1.00 0.00 N ATOM 0 HA LYS B 13 -15.889 5.878 1.800 1.00 0.00 H new ATOM 0 HB2 LYS B 13 -15.818 8.447 3.401 1.00 0.00 H new ATOM 0 HB3 LYS B 13 -15.226 8.531 1.754 1.00 0.00 H new ATOM 0 HG2 LYS B 13 -17.509 7.102 1.306 1.00 0.00 H new ATOM 0 HG3 LYS B 13 -18.011 7.967 2.746 1.00 0.00 H new ATOM 0 HD2 LYS B 13 -18.582 9.549 1.117 1.00 0.00 H new ATOM 0 HD3 LYS B 13 -16.951 10.076 1.482 1.00 0.00 H new ATOM 0 HE2 LYS B 13 -17.038 7.914 -0.571 1.00 0.00 H new ATOM 0 HE3 LYS B 13 -17.861 9.377 -1.075 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 -15.747 10.081 -1.487 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 -15.722 10.420 0.177 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 -15.042 8.978 -0.406 1.00 0.00 H new ATOM 1332 N THR B 14 -13.437 6.975 1.154 1.00 0.00 N ATOM 1333 CA THR B 14 -11.987 6.919 0.843 1.00 0.00 C ATOM 1334 C THR B 14 -11.614 8.041 -0.130 1.00 0.00 C ATOM 1335 O THR B 14 -12.464 8.625 -0.773 1.00 0.00 O ATOM 1336 CB THR B 14 -11.789 5.559 0.188 1.00 0.00 C ATOM 1337 OG1 THR B 14 -13.021 5.122 -0.370 1.00 0.00 O ATOM 1338 CG2 THR B 14 -11.315 4.550 1.237 1.00 0.00 C ATOM 0 H THR B 14 -14.013 7.449 0.459 1.00 0.00 H new ATOM 0 HA THR B 14 -11.363 7.046 1.728 1.00 0.00 H new ATOM 0 HB THR B 14 -11.040 5.639 -0.600 1.00 0.00 H new ATOM 0 HG1 THR B 14 -12.896 4.247 -0.794 1.00 0.00 H new ATOM 0 HG21 THR B 14 -11.173 3.577 0.768 1.00 0.00 H new ATOM 0 HG22 THR B 14 -10.371 4.887 1.666 1.00 0.00 H new ATOM 0 HG23 THR B 14 -12.063 4.467 2.026 1.00 0.00 H new ATOM 1346 N LEU B 15 -10.353 8.351 -0.238 1.00 0.00 N ATOM 1347 CA LEU B 15 -9.929 9.434 -1.161 1.00 0.00 C ATOM 1348 C LEU B 15 -9.219 8.852 -2.382 1.00 0.00 C ATOM 1349 O LEU B 15 -8.528 7.859 -2.286 1.00 0.00 O ATOM 1350 CB LEU B 15 -8.965 10.275 -0.337 1.00 0.00 C ATOM 1351 CG LEU B 15 -9.688 10.803 0.898 1.00 0.00 C ATOM 1352 CD1 LEU B 15 -9.518 9.817 2.055 1.00 0.00 C ATOM 1353 CD2 LEU B 15 -9.096 12.156 1.292 1.00 0.00 C ATOM 0 H LEU B 15 -9.597 7.898 0.276 1.00 0.00 H new ATOM 0 HA LEU B 15 -10.772 10.013 -1.538 1.00 0.00 H new ATOM 0 HB2 LEU B 15 -8.104 9.676 -0.040 1.00 0.00 H new ATOM 0 HB3 LEU B 15 -8.586 11.105 -0.934 1.00 0.00 H new ATOM 0 HG LEU B 15 -10.749 10.918 0.675 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -10.036 10.197 2.936 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -9.939 8.851 1.775 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -8.458 9.699 2.280 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -9.611 12.535 2.174 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -8.035 12.038 1.514 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -9.219 12.860 0.469 1.00 0.00 H new ATOM 1365 N PRO B 16 -9.412 9.503 -3.493 1.00 0.00 N ATOM 1366 CA PRO B 16 -8.784 9.064 -4.752 1.00 0.00 C ATOM 1367 C PRO B 16 -7.351 9.589 -4.822 1.00 0.00 C ATOM 1368 O PRO B 16 -6.560 9.163 -5.637 1.00 0.00 O ATOM 1369 CB PRO B 16 -9.648 9.717 -5.824 1.00 0.00 C ATOM 1370 CG PRO B 16 -10.265 10.917 -5.169 1.00 0.00 C ATOM 1371 CD PRO B 16 -10.231 10.703 -3.675 1.00 0.00 C ATOM 0 HA PRO B 16 -8.728 7.981 -4.858 1.00 0.00 H new ATOM 0 HB2 PRO B 16 -9.049 10.006 -6.688 1.00 0.00 H new ATOM 0 HB3 PRO B 16 -10.414 9.029 -6.183 1.00 0.00 H new ATOM 0 HG2 PRO B 16 -9.718 11.821 -5.437 1.00 0.00 H new ATOM 0 HG3 PRO B 16 -11.291 11.052 -5.511 1.00 0.00 H new ATOM 0 HD2 PRO B 16 -9.797 11.561 -3.161 1.00 0.00 H new ATOM 0 HD3 PRO B 16 -11.234 10.564 -3.271 1.00 0.00 H new ATOM 1379 N ARG B 17 -7.017 10.519 -3.972 1.00 0.00 N ATOM 1380 CA ARG B 17 -5.642 11.088 -3.985 1.00 0.00 C ATOM 1381 C ARG B 17 -5.436 11.974 -2.755 1.00 0.00 C ATOM 1382 O ARG B 17 -5.338 13.181 -2.860 1.00 0.00 O ATOM 1383 CB ARG B 17 -5.589 11.923 -5.264 1.00 0.00 C ATOM 1384 CG ARG B 17 -4.303 12.747 -5.281 1.00 0.00 C ATOM 1385 CD ARG B 17 -4.582 14.120 -5.897 1.00 0.00 C ATOM 1386 NE ARG B 17 -5.310 14.875 -4.841 1.00 0.00 N ATOM 1387 CZ ARG B 17 -6.423 15.492 -5.131 1.00 0.00 C ATOM 1388 NH1 ARG B 17 -7.256 14.964 -5.984 1.00 0.00 N ATOM 1389 NH2 ARG B 17 -6.702 16.635 -4.567 1.00 0.00 N ATOM 0 H ARG B 17 -7.640 10.911 -3.266 1.00 0.00 H new ATOM 0 HA ARG B 17 -4.866 10.323 -3.960 1.00 0.00 H new ATOM 0 HB2 ARG B 17 -5.628 11.272 -6.138 1.00 0.00 H new ATOM 0 HB3 ARG B 17 -6.456 12.581 -5.318 1.00 0.00 H new ATOM 0 HG2 ARG B 17 -3.920 12.863 -4.267 1.00 0.00 H new ATOM 0 HG3 ARG B 17 -3.535 12.229 -5.855 1.00 0.00 H new ATOM 0 HD2 ARG B 17 -3.656 14.623 -6.175 1.00 0.00 H new ATOM 0 HD3 ARG B 17 -5.181 14.032 -6.803 1.00 0.00 H new ATOM 0 HE ARG B 17 -4.939 14.910 -3.891 1.00 0.00 H new ATOM 0 HH11 ARG B 17 -7.037 14.070 -6.424 1.00 0.00 H new ATOM 0 HH12 ARG B 17 -8.126 15.445 -6.212 1.00 0.00 H new ATOM 0 HH21 ARG B 17 -6.050 17.047 -3.899 1.00 0.00 H new ATOM 0 HH22 ARG B 17 -7.572 17.117 -4.794 1.00 0.00 H new ATOM 1403 N VAL B 18 -5.363 11.388 -1.592 1.00 0.00 N ATOM 1404 CA VAL B 18 -5.149 12.208 -0.361 1.00 0.00 C ATOM 1405 C VAL B 18 -4.021 13.204 -0.615 1.00 0.00 C ATOM 1406 O VAL B 18 -3.419 13.191 -1.666 1.00 0.00 O ATOM 1407 CB VAL B 18 -4.751 11.204 0.719 1.00 0.00 C ATOM 1408 CG1 VAL B 18 -4.630 11.924 2.058 1.00 0.00 C ATOM 1409 CG2 VAL B 18 -5.822 10.116 0.826 1.00 0.00 C ATOM 0 H VAL B 18 -5.441 10.383 -1.438 1.00 0.00 H new ATOM 0 HA VAL B 18 -6.031 12.778 -0.070 1.00 0.00 H new ATOM 0 HB VAL B 18 -3.795 10.750 0.458 1.00 0.00 H new ATOM 0 HG11 VAL B 18 -4.346 11.210 2.831 1.00 0.00 H new ATOM 0 HG12 VAL B 18 -3.870 12.702 1.986 1.00 0.00 H new ATOM 0 HG13 VAL B 18 -5.588 12.376 2.316 1.00 0.00 H new ATOM 0 HG21 VAL B 18 -5.537 9.400 1.597 1.00 0.00 H new ATOM 0 HG22 VAL B 18 -6.777 10.571 1.088 1.00 0.00 H new ATOM 0 HG23 VAL B 18 -5.915 9.602 -0.131 1.00 0.00 H new ATOM 1419 N ASP B 19 -3.720 14.059 0.331 1.00 0.00 N ATOM 1420 CA ASP B 19 -2.616 15.031 0.120 1.00 0.00 C ATOM 1421 C ASP B 19 -1.449 14.291 -0.532 1.00 0.00 C ATOM 1422 O ASP B 19 -0.432 14.024 0.077 1.00 0.00 O ATOM 1423 CB ASP B 19 -2.265 15.510 1.523 1.00 0.00 C ATOM 1424 CG ASP B 19 -1.346 16.729 1.436 1.00 0.00 C ATOM 1425 OD1 ASP B 19 -0.999 17.107 0.329 1.00 0.00 O ATOM 1426 OD2 ASP B 19 -1.005 17.265 2.479 1.00 0.00 O ATOM 0 H ASP B 19 -4.191 14.122 1.234 1.00 0.00 H new ATOM 0 HA ASP B 19 -2.872 15.870 -0.528 1.00 0.00 H new ATOM 0 HB2 ASP B 19 -3.173 15.765 2.068 1.00 0.00 H new ATOM 0 HB3 ASP B 19 -1.774 14.711 2.078 1.00 0.00 H new ATOM 1431 N PHE B 20 -1.637 13.919 -1.761 1.00 0.00 N ATOM 1432 CA PHE B 20 -0.615 13.140 -2.505 1.00 0.00 C ATOM 1433 C PHE B 20 0.809 13.571 -2.189 1.00 0.00 C ATOM 1434 O PHE B 20 1.528 12.888 -1.489 1.00 0.00 O ATOM 1435 CB PHE B 20 -0.935 13.386 -3.971 1.00 0.00 C ATOM 1436 CG PHE B 20 -0.852 12.072 -4.677 1.00 0.00 C ATOM 1437 CD1 PHE B 20 -1.920 11.175 -4.602 1.00 0.00 C ATOM 1438 CD2 PHE B 20 0.306 11.734 -5.375 1.00 0.00 C ATOM 1439 CE1 PHE B 20 -1.832 9.938 -5.236 1.00 0.00 C ATOM 1440 CE2 PHE B 20 0.401 10.499 -6.005 1.00 0.00 C ATOM 1441 CZ PHE B 20 -0.674 9.597 -5.938 1.00 0.00 C ATOM 0 H PHE B 20 -2.480 14.128 -2.296 1.00 0.00 H new ATOM 0 HA PHE B 20 -0.656 12.087 -2.228 1.00 0.00 H new ATOM 0 HB2 PHE B 20 -1.931 13.817 -4.079 1.00 0.00 H new ATOM 0 HB3 PHE B 20 -0.231 14.098 -4.403 1.00 0.00 H new ATOM 0 HD1 PHE B 20 -2.812 11.440 -4.054 1.00 0.00 H new ATOM 0 HD2 PHE B 20 1.129 12.431 -5.426 1.00 0.00 H new ATOM 0 HE1 PHE B 20 -2.658 9.244 -5.185 1.00 0.00 H new ATOM 0 HE2 PHE B 20 1.298 10.233 -6.544 1.00 0.00 H new ATOM 0 HZ PHE B 20 -0.605 8.638 -6.430 1.00 0.00 H new ATOM 1451 N LYS B 21 1.242 14.669 -2.723 1.00 0.00 N ATOM 1452 CA LYS B 21 2.640 15.096 -2.467 1.00 0.00 C ATOM 1453 C LYS B 21 3.006 14.834 -1.000 1.00 0.00 C ATOM 1454 O LYS B 21 4.158 14.656 -0.659 1.00 0.00 O ATOM 1455 CB LYS B 21 2.671 16.592 -2.780 1.00 0.00 C ATOM 1456 CG LYS B 21 2.418 16.805 -4.274 1.00 0.00 C ATOM 1457 CD LYS B 21 1.517 18.026 -4.469 1.00 0.00 C ATOM 1458 CE LYS B 21 2.267 19.092 -5.273 1.00 0.00 C ATOM 1459 NZ LYS B 21 1.359 20.274 -5.285 1.00 0.00 N ATOM 0 H LYS B 21 0.695 15.287 -3.322 1.00 0.00 H new ATOM 0 HA LYS B 21 3.359 14.549 -3.076 1.00 0.00 H new ATOM 0 HB2 LYS B 21 1.914 17.113 -2.194 1.00 0.00 H new ATOM 0 HB3 LYS B 21 3.636 17.013 -2.500 1.00 0.00 H new ATOM 0 HG2 LYS B 21 3.363 16.950 -4.797 1.00 0.00 H new ATOM 0 HG3 LYS B 21 1.948 15.920 -4.704 1.00 0.00 H new ATOM 0 HD2 LYS B 21 0.604 17.738 -4.990 1.00 0.00 H new ATOM 0 HD3 LYS B 21 1.218 18.429 -3.501 1.00 0.00 H new ATOM 0 HE2 LYS B 21 3.224 19.334 -4.811 1.00 0.00 H new ATOM 0 HE3 LYS B 21 2.479 18.747 -6.285 1.00 0.00 H new ATOM 0 HZ1 LYS B 21 1.804 21.048 -5.818 1.00 0.00 H new ATOM 0 HZ2 LYS B 21 0.458 20.015 -5.736 1.00 0.00 H new ATOM 0 HZ3 LYS B 21 1.180 20.584 -4.309 1.00 0.00 H new ATOM 1473 N ASN B 22 2.029 14.803 -0.130 1.00 0.00 N ATOM 1474 CA ASN B 22 2.311 14.545 1.307 1.00 0.00 C ATOM 1475 C ASN B 22 2.276 13.046 1.592 1.00 0.00 C ATOM 1476 O ASN B 22 2.895 12.564 2.520 1.00 0.00 O ATOM 1477 CB ASN B 22 1.179 15.239 2.052 1.00 0.00 C ATOM 1478 CG ASN B 22 1.759 16.142 3.143 1.00 0.00 C ATOM 1479 OD1 ASN B 22 2.905 16.538 3.073 1.00 0.00 O ATOM 1480 ND2 ASN B 22 1.010 16.486 4.155 1.00 0.00 N ATOM 0 H ASN B 22 1.045 14.946 -0.358 1.00 0.00 H new ATOM 0 HA ASN B 22 3.294 14.908 1.606 1.00 0.00 H new ATOM 0 HB2 ASN B 22 0.581 15.829 1.357 1.00 0.00 H new ATOM 0 HB3 ASN B 22 0.514 14.498 2.495 1.00 0.00 H new ATOM 0 HD21 ASN B 22 1.387 17.088 4.887 1.00 0.00 H new ATOM 0 HD22 ASN B 22 0.048 16.153 4.214 1.00 0.00 H new ATOM 1487 N ILE B 23 1.539 12.308 0.809 1.00 0.00 N ATOM 1488 CA ILE B 23 1.444 10.840 1.039 1.00 0.00 C ATOM 1489 C ILE B 23 2.811 10.279 1.438 1.00 0.00 C ATOM 1490 O ILE B 23 3.665 10.034 0.609 1.00 0.00 O ATOM 1491 CB ILE B 23 0.973 10.254 -0.301 1.00 0.00 C ATOM 1492 CG1 ILE B 23 -0.530 9.975 -0.232 1.00 0.00 C ATOM 1493 CG2 ILE B 23 1.711 8.947 -0.595 1.00 0.00 C ATOM 1494 CD1 ILE B 23 -1.269 11.263 0.121 1.00 0.00 C ATOM 0 H ILE B 23 0.998 12.659 0.019 1.00 0.00 H new ATOM 0 HA ILE B 23 0.757 10.589 1.847 1.00 0.00 H new ATOM 0 HB ILE B 23 1.184 10.971 -1.094 1.00 0.00 H new ATOM 0 HG12 ILE B 23 -0.884 9.590 -1.188 1.00 0.00 H new ATOM 0 HG13 ILE B 23 -0.735 9.209 0.516 1.00 0.00 H new ATOM 0 HG21 ILE B 23 1.368 8.542 -1.547 1.00 0.00 H new ATOM 0 HG22 ILE B 23 2.783 9.138 -0.647 1.00 0.00 H new ATOM 0 HG23 ILE B 23 1.509 8.228 0.199 1.00 0.00 H new ATOM 0 HD11 ILE B 23 -2.340 11.066 0.171 1.00 0.00 H new ATOM 0 HD12 ILE B 23 -0.922 11.628 1.088 1.00 0.00 H new ATOM 0 HD13 ILE B 23 -1.073 12.016 -0.643 1.00 0.00 H new ATOM 1506 N GLN B 24 3.020 10.071 2.708 1.00 0.00 N ATOM 1507 CA GLN B 24 4.329 9.521 3.169 1.00 0.00 C ATOM 1508 C GLN B 24 4.272 7.994 3.205 1.00 0.00 C ATOM 1509 O GLN B 24 5.258 7.330 3.459 1.00 0.00 O ATOM 1510 CB GLN B 24 4.521 10.087 4.577 1.00 0.00 C ATOM 1511 CG GLN B 24 6.004 10.387 4.808 1.00 0.00 C ATOM 1512 CD GLN B 24 6.655 9.210 5.536 1.00 0.00 C ATOM 1513 OE1 GLN B 24 7.531 8.559 5.002 1.00 0.00 O ATOM 1514 NE2 GLN B 24 6.260 8.905 6.742 1.00 0.00 N ATOM 0 H GLN B 24 2.343 10.257 3.448 1.00 0.00 H new ATOM 0 HA GLN B 24 5.151 9.793 2.507 1.00 0.00 H new ATOM 0 HB2 GLN B 24 3.932 10.996 4.699 1.00 0.00 H new ATOM 0 HB3 GLN B 24 4.163 9.373 5.319 1.00 0.00 H new ATOM 0 HG2 GLN B 24 6.504 10.560 3.855 1.00 0.00 H new ATOM 0 HG3 GLN B 24 6.114 11.298 5.396 1.00 0.00 H new ATOM 0 HE21 GLN B 24 5.525 9.451 7.191 1.00 0.00 H new ATOM 0 HE22 GLN B 24 6.687 8.121 7.235 1.00 0.00 H new ATOM 1523 N SER B 25 3.124 7.435 2.949 1.00 0.00 N ATOM 1524 CA SER B 25 2.992 5.951 2.961 1.00 0.00 C ATOM 1525 C SER B 25 1.630 5.556 2.393 1.00 0.00 C ATOM 1526 O SER B 25 0.682 6.313 2.455 1.00 0.00 O ATOM 1527 CB SER B 25 3.101 5.549 4.432 1.00 0.00 C ATOM 1528 OG SER B 25 3.217 6.718 5.233 1.00 0.00 O ATOM 0 H SER B 25 2.267 7.943 2.731 1.00 0.00 H new ATOM 0 HA SER B 25 3.753 5.458 2.356 1.00 0.00 H new ATOM 0 HB2 SER B 25 2.223 4.976 4.730 1.00 0.00 H new ATOM 0 HB3 SER B 25 3.968 4.905 4.581 1.00 0.00 H new ATOM 0 HG SER B 25 3.285 6.463 6.177 1.00 0.00 H new ATOM 1534 N LEU B 26 1.517 4.385 1.834 1.00 0.00 N ATOM 1535 CA LEU B 26 0.203 3.970 1.265 1.00 0.00 C ATOM 1536 C LEU B 26 -0.099 2.513 1.606 1.00 0.00 C ATOM 1537 O LEU B 26 0.760 1.660 1.542 1.00 0.00 O ATOM 1538 CB LEU B 26 0.347 4.147 -0.246 1.00 0.00 C ATOM 1539 CG LEU B 26 -0.916 4.802 -0.810 1.00 0.00 C ATOM 1540 CD1 LEU B 26 -1.041 4.472 -2.299 1.00 0.00 C ATOM 1541 CD2 LEU B 26 -2.144 4.267 -0.069 1.00 0.00 C ATOM 0 H LEU B 26 2.269 3.702 1.746 1.00 0.00 H new ATOM 0 HA LEU B 26 -0.618 4.561 1.670 1.00 0.00 H new ATOM 0 HB2 LEU B 26 1.218 4.763 -0.469 1.00 0.00 H new ATOM 0 HB3 LEU B 26 0.510 3.180 -0.721 1.00 0.00 H new ATOM 0 HG LEU B 26 -0.852 5.882 -0.679 1.00 0.00 H new ATOM 0 HD11 LEU B 26 -1.941 4.938 -2.701 1.00 0.00 H new ATOM 0 HD12 LEU B 26 -0.168 4.851 -2.830 1.00 0.00 H new ATOM 0 HD13 LEU B 26 -1.104 3.392 -2.428 1.00 0.00 H new ATOM 0 HD21 LEU B 26 -3.043 4.734 -0.471 1.00 0.00 H new ATOM 0 HD22 LEU B 26 -2.206 3.187 -0.200 1.00 0.00 H new ATOM 0 HD23 LEU B 26 -2.058 4.499 0.993 1.00 0.00 H new ATOM 1553 N SER B 27 -1.319 2.222 1.968 1.00 0.00 N ATOM 1554 CA SER B 27 -1.684 0.821 2.311 1.00 0.00 C ATOM 1555 C SER B 27 -2.843 0.348 1.431 1.00 0.00 C ATOM 1556 O SER B 27 -3.634 1.137 0.956 1.00 0.00 O ATOM 1557 CB SER B 27 -2.105 0.875 3.776 1.00 0.00 C ATOM 1558 OG SER B 27 -1.425 -0.143 4.499 1.00 0.00 O ATOM 0 H SER B 27 -2.080 2.897 2.041 1.00 0.00 H new ATOM 0 HA SER B 27 -0.862 0.124 2.149 1.00 0.00 H new ATOM 0 HB2 SER B 27 -1.872 1.853 4.197 1.00 0.00 H new ATOM 0 HB3 SER B 27 -3.183 0.739 3.862 1.00 0.00 H new ATOM 0 HG SER B 27 -1.693 -0.110 5.441 1.00 0.00 H new ATOM 1564 N VAL B 28 -2.950 -0.932 1.207 1.00 0.00 N ATOM 1565 CA VAL B 28 -4.059 -1.447 0.354 1.00 0.00 C ATOM 1566 C VAL B 28 -4.574 -2.782 0.900 1.00 0.00 C ATOM 1567 O VAL B 28 -3.857 -3.761 0.953 1.00 0.00 O ATOM 1568 CB VAL B 28 -3.436 -1.640 -1.028 1.00 0.00 C ATOM 1569 CG1 VAL B 28 -4.346 -2.527 -1.880 1.00 0.00 C ATOM 1570 CG2 VAL B 28 -3.273 -0.279 -1.707 1.00 0.00 C ATOM 0 H VAL B 28 -2.319 -1.643 1.577 1.00 0.00 H new ATOM 0 HA VAL B 28 -4.910 -0.766 0.329 1.00 0.00 H new ATOM 0 HB VAL B 28 -2.461 -2.115 -0.923 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -3.901 -2.664 -2.866 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -4.464 -3.497 -1.397 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -5.322 -2.053 -1.985 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -2.829 -0.415 -2.693 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -4.249 0.195 -1.811 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -2.625 0.354 -1.101 1.00 0.00 H new ATOM 1580 N THR B 29 -5.815 -2.830 1.297 1.00 0.00 N ATOM 1581 CA THR B 29 -6.378 -4.103 1.831 1.00 0.00 C ATOM 1582 C THR B 29 -7.627 -4.487 1.033 1.00 0.00 C ATOM 1583 O THR B 29 -8.520 -3.682 0.854 1.00 0.00 O ATOM 1584 CB THR B 29 -6.738 -3.801 3.286 1.00 0.00 C ATOM 1585 OG1 THR B 29 -7.231 -4.981 3.905 1.00 0.00 O ATOM 1586 CG2 THR B 29 -7.810 -2.712 3.332 1.00 0.00 C ATOM 0 H THR B 29 -6.464 -2.043 1.275 1.00 0.00 H new ATOM 0 HA THR B 29 -5.678 -4.935 1.756 1.00 0.00 H new ATOM 0 HB THR B 29 -5.850 -3.456 3.817 1.00 0.00 H new ATOM 0 HG1 THR B 29 -6.589 -5.711 3.776 1.00 0.00 H new ATOM 0 HG21 THR B 29 -8.066 -2.497 4.369 1.00 0.00 H new ATOM 0 HG22 THR B 29 -7.430 -1.807 2.857 1.00 0.00 H new ATOM 0 HG23 THR B 29 -8.699 -3.054 2.802 1.00 0.00 H new ATOM 1594 N PRO B 30 -7.643 -5.706 0.572 1.00 0.00 N ATOM 1595 CA PRO B 30 -8.789 -6.204 -0.229 1.00 0.00 C ATOM 1596 C PRO B 30 -10.021 -6.422 0.655 1.00 0.00 C ATOM 1597 O PRO B 30 -9.979 -6.199 1.850 1.00 0.00 O ATOM 1598 CB PRO B 30 -8.277 -7.527 -0.797 1.00 0.00 C ATOM 1599 CG PRO B 30 -7.209 -7.970 0.151 1.00 0.00 C ATOM 1600 CD PRO B 30 -6.604 -6.727 0.749 1.00 0.00 C ATOM 0 HA PRO B 30 -9.104 -5.505 -1.004 1.00 0.00 H new ATOM 0 HB2 PRO B 30 -9.077 -8.264 -0.862 1.00 0.00 H new ATOM 0 HB3 PRO B 30 -7.881 -7.397 -1.804 1.00 0.00 H new ATOM 0 HG2 PRO B 30 -7.626 -8.608 0.930 1.00 0.00 H new ATOM 0 HG3 PRO B 30 -6.451 -8.555 -0.369 1.00 0.00 H new ATOM 0 HD2 PRO B 30 -6.359 -6.869 1.802 1.00 0.00 H new ATOM 0 HD3 PRO B 30 -5.680 -6.449 0.242 1.00 0.00 H new ATOM 1608 N PRO B 31 -11.087 -6.848 0.028 1.00 0.00 N ATOM 1609 CA PRO B 31 -12.360 -7.095 0.755 1.00 0.00 C ATOM 1610 C PRO B 31 -12.246 -8.305 1.680 1.00 0.00 C ATOM 1611 O PRO B 31 -11.757 -9.351 1.303 1.00 0.00 O ATOM 1612 CB PRO B 31 -13.365 -7.359 -0.365 1.00 0.00 C ATOM 1613 CG PRO B 31 -12.540 -7.834 -1.516 1.00 0.00 C ATOM 1614 CD PRO B 31 -11.210 -7.137 -1.406 1.00 0.00 C ATOM 0 HA PRO B 31 -12.645 -6.262 1.398 1.00 0.00 H new ATOM 0 HB2 PRO B 31 -14.099 -8.108 -0.069 1.00 0.00 H new ATOM 0 HB3 PRO B 31 -13.918 -6.455 -0.621 1.00 0.00 H new ATOM 0 HG2 PRO B 31 -12.415 -8.916 -1.483 1.00 0.00 H new ATOM 0 HG3 PRO B 31 -13.024 -7.598 -2.464 1.00 0.00 H new ATOM 0 HD2 PRO B 31 -10.396 -7.770 -1.758 1.00 0.00 H new ATOM 0 HD3 PRO B 31 -11.185 -6.225 -2.002 1.00 0.00 H new ATOM 1697 N THR B 38 -12.951 -3.260 -1.580 1.00 0.00 N ATOM 1698 CA THR B 38 -11.490 -2.976 -1.486 1.00 0.00 C ATOM 1699 C THR B 38 -11.264 -1.593 -0.875 1.00 0.00 C ATOM 1700 O THR B 38 -11.990 -0.659 -1.146 1.00 0.00 O ATOM 1701 CB THR B 38 -10.980 -3.015 -2.928 1.00 0.00 C ATOM 1702 OG1 THR B 38 -12.036 -3.410 -3.794 1.00 0.00 O ATOM 1703 CG2 THR B 38 -9.826 -4.012 -3.038 1.00 0.00 C ATOM 0 HA THR B 38 -10.970 -3.695 -0.853 1.00 0.00 H new ATOM 0 HB THR B 38 -10.628 -2.024 -3.214 1.00 0.00 H new ATOM 0 HG1 THR B 38 -12.894 -3.306 -3.332 1.00 0.00 H new ATOM 0 HG21 THR B 38 -9.464 -4.038 -4.066 1.00 0.00 H new ATOM 0 HG22 THR B 38 -9.016 -3.706 -2.376 1.00 0.00 H new ATOM 0 HG23 THR B 38 -10.174 -5.004 -2.750 1.00 0.00 H new ATOM 1711 N GLU B 39 -10.266 -1.453 -0.047 1.00 0.00 N ATOM 1712 CA GLU B 39 -10.009 -0.128 0.580 1.00 0.00 C ATOM 1713 C GLU B 39 -8.507 0.133 0.708 1.00 0.00 C ATOM 1714 O GLU B 39 -7.710 -0.780 0.779 1.00 0.00 O ATOM 1715 CB GLU B 39 -10.651 -0.217 1.959 1.00 0.00 C ATOM 1716 CG GLU B 39 -11.124 1.170 2.377 1.00 0.00 C ATOM 1717 CD GLU B 39 -12.439 1.054 3.149 1.00 0.00 C ATOM 1718 OE1 GLU B 39 -13.430 0.689 2.540 1.00 0.00 O ATOM 1719 OE2 GLU B 39 -12.432 1.330 4.338 1.00 0.00 O ATOM 0 H GLU B 39 -9.620 -2.196 0.221 1.00 0.00 H new ATOM 0 HA GLU B 39 -10.416 0.689 -0.016 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -11.491 -0.911 1.939 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -9.935 -0.605 2.683 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -10.368 1.651 2.997 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -11.262 1.799 1.497 1.00 0.00 H new ATOM 1726 N VAL B 40 -8.118 1.380 0.739 1.00 0.00 N ATOM 1727 CA VAL B 40 -6.669 1.706 0.864 1.00 0.00 C ATOM 1728 C VAL B 40 -6.431 2.607 2.080 1.00 0.00 C ATOM 1729 O VAL B 40 -7.328 3.271 2.558 1.00 0.00 O ATOM 1730 CB VAL B 40 -6.329 2.449 -0.430 1.00 0.00 C ATOM 1731 CG1 VAL B 40 -4.898 2.987 -0.364 1.00 0.00 C ATOM 1732 CG2 VAL B 40 -6.453 1.485 -1.611 1.00 0.00 C ATOM 0 H VAL B 40 -8.741 2.186 0.683 1.00 0.00 H new ATOM 0 HA VAL B 40 -6.052 0.819 1.005 1.00 0.00 H new ATOM 0 HB VAL B 40 -7.019 3.283 -0.557 1.00 0.00 H new ATOM 0 HG11 VAL B 40 -4.665 3.514 -1.289 1.00 0.00 H new ATOM 0 HG12 VAL B 40 -4.806 3.673 0.478 1.00 0.00 H new ATOM 0 HG13 VAL B 40 -4.203 2.157 -0.234 1.00 0.00 H new ATOM 0 HG21 VAL B 40 -6.212 2.009 -2.536 1.00 0.00 H new ATOM 0 HG22 VAL B 40 -5.763 0.653 -1.475 1.00 0.00 H new ATOM 0 HG23 VAL B 40 -7.473 1.105 -1.665 1.00 0.00 H new ATOM 1742 N ILE B 41 -5.226 2.639 2.576 1.00 0.00 N ATOM 1743 CA ILE B 41 -4.918 3.507 3.749 1.00 0.00 C ATOM 1744 C ILE B 41 -3.607 4.242 3.496 1.00 0.00 C ATOM 1745 O ILE B 41 -2.539 3.664 3.532 1.00 0.00 O ATOM 1746 CB ILE B 41 -4.784 2.556 4.940 1.00 0.00 C ATOM 1747 CG1 ILE B 41 -5.823 1.437 4.825 1.00 0.00 C ATOM 1748 CG2 ILE B 41 -5.015 3.330 6.239 1.00 0.00 C ATOM 1749 CD1 ILE B 41 -5.679 0.485 6.013 1.00 0.00 C ATOM 0 H ILE B 41 -4.437 2.100 2.219 1.00 0.00 H new ATOM 0 HA ILE B 41 -5.688 4.257 3.930 1.00 0.00 H new ATOM 0 HB ILE B 41 -3.784 2.123 4.945 1.00 0.00 H new ATOM 0 HG12 ILE B 41 -6.828 1.860 4.803 1.00 0.00 H new ATOM 0 HG13 ILE B 41 -5.686 0.893 3.890 1.00 0.00 H new ATOM 0 HG21 ILE B 41 -4.920 2.653 7.088 1.00 0.00 H new ATOM 0 HG22 ILE B 41 -4.275 4.126 6.325 1.00 0.00 H new ATOM 0 HG23 ILE B 41 -6.015 3.764 6.231 1.00 0.00 H new ATOM 0 HD11 ILE B 41 -6.418 -0.312 5.932 1.00 0.00 H new ATOM 0 HD12 ILE B 41 -4.678 0.053 6.014 1.00 0.00 H new ATOM 0 HD13 ILE B 41 -5.838 1.034 6.941 1.00 0.00 H new ATOM 1761 N ALA B 42 -3.680 5.508 3.212 1.00 0.00 N ATOM 1762 CA ALA B 42 -2.439 6.274 2.924 1.00 0.00 C ATOM 1763 C ALA B 42 -2.150 7.297 4.022 1.00 0.00 C ATOM 1764 O ALA B 42 -3.045 7.884 4.595 1.00 0.00 O ATOM 1765 CB ALA B 42 -2.740 6.985 1.608 1.00 0.00 C ATOM 0 H ALA B 42 -4.545 6.047 3.166 1.00 0.00 H new ATOM 0 HA ALA B 42 -1.562 5.629 2.872 1.00 0.00 H new ATOM 0 HB1 ALA B 42 -1.877 7.581 1.311 1.00 0.00 H new ATOM 0 HB2 ALA B 42 -2.954 6.246 0.836 1.00 0.00 H new ATOM 0 HB3 ALA B 42 -3.604 7.637 1.736 1.00 0.00 H new ATOM 1771 N THR B 43 -0.896 7.530 4.297 1.00 0.00 N ATOM 1772 CA THR B 43 -0.529 8.534 5.336 1.00 0.00 C ATOM 1773 C THR B 43 0.078 9.755 4.652 1.00 0.00 C ATOM 1774 O THR B 43 0.559 9.674 3.541 1.00 0.00 O ATOM 1775 CB THR B 43 0.509 7.848 6.228 1.00 0.00 C ATOM 1776 OG1 THR B 43 -0.124 6.830 6.993 1.00 0.00 O ATOM 1777 CG2 THR B 43 1.139 8.881 7.168 1.00 0.00 C ATOM 0 H THR B 43 -0.107 7.067 3.846 1.00 0.00 H new ATOM 0 HA THR B 43 -1.388 8.867 5.919 1.00 0.00 H new ATOM 0 HB THR B 43 1.287 7.404 5.607 1.00 0.00 H new ATOM 0 HG1 THR B 43 0.540 6.389 7.563 1.00 0.00 H new ATOM 0 HG21 THR B 43 1.878 8.392 7.803 1.00 0.00 H new ATOM 0 HG22 THR B 43 1.624 9.660 6.580 1.00 0.00 H new ATOM 0 HG23 THR B 43 0.364 9.327 7.791 1.00 0.00 H new ATOM 1785 N LEU B 44 0.042 10.888 5.288 1.00 0.00 N ATOM 1786 CA LEU B 44 0.600 12.110 4.648 1.00 0.00 C ATOM 1787 C LEU B 44 1.899 12.546 5.324 1.00 0.00 C ATOM 1788 O LEU B 44 2.313 11.991 6.322 1.00 0.00 O ATOM 1789 CB LEU B 44 -0.479 13.163 4.860 1.00 0.00 C ATOM 1790 CG LEU B 44 -1.717 12.801 4.049 1.00 0.00 C ATOM 1791 CD1 LEU B 44 -2.678 13.988 4.039 1.00 0.00 C ATOM 1792 CD2 LEU B 44 -1.302 12.467 2.617 1.00 0.00 C ATOM 0 H LEU B 44 -0.348 11.023 6.221 1.00 0.00 H new ATOM 0 HA LEU B 44 0.842 11.948 3.598 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -0.732 13.230 5.918 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -0.109 14.143 4.558 1.00 0.00 H new ATOM 0 HG LEU B 44 -2.210 11.938 4.495 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -3.565 13.733 3.460 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -2.969 14.229 5.061 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -2.186 14.850 3.589 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -2.185 12.207 2.033 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -0.812 13.332 2.169 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -0.612 11.623 2.626 1.00 0.00 H new ATOM 1804 N LYS B 45 2.547 13.543 4.780 1.00 0.00 N ATOM 1805 CA LYS B 45 3.820 14.024 5.383 1.00 0.00 C ATOM 1806 C LYS B 45 3.530 15.090 6.441 1.00 0.00 C ATOM 1807 O LYS B 45 3.105 16.185 6.133 1.00 0.00 O ATOM 1808 CB LYS B 45 4.609 14.626 4.222 1.00 0.00 C ATOM 1809 CG LYS B 45 5.837 13.760 3.933 1.00 0.00 C ATOM 1810 CD LYS B 45 7.073 14.653 3.805 1.00 0.00 C ATOM 1811 CE LYS B 45 6.758 15.833 2.883 1.00 0.00 C ATOM 1812 NZ LYS B 45 7.827 15.804 1.844 1.00 0.00 N ATOM 0 H LYS B 45 2.247 14.044 3.943 1.00 0.00 H new ATOM 0 HA LYS B 45 4.371 13.223 5.877 1.00 0.00 H new ATOM 0 HB2 LYS B 45 3.979 14.689 3.335 1.00 0.00 H new ATOM 0 HB3 LYS B 45 4.918 15.642 4.467 1.00 0.00 H new ATOM 0 HG2 LYS B 45 5.981 13.035 4.734 1.00 0.00 H new ATOM 0 HG3 LYS B 45 5.688 13.194 3.014 1.00 0.00 H new ATOM 0 HD2 LYS B 45 7.375 15.016 4.787 1.00 0.00 H new ATOM 0 HD3 LYS B 45 7.909 14.079 3.406 1.00 0.00 H new ATOM 0 HE2 LYS B 45 5.769 15.732 2.435 1.00 0.00 H new ATOM 0 HE3 LYS B 45 6.765 16.775 3.431 1.00 0.00 H new ATOM 0 HZ1 LYS B 45 7.680 16.585 1.173 1.00 0.00 H new ATOM 0 HZ2 LYS B 45 8.756 15.909 2.299 1.00 0.00 H new ATOM 0 HZ3 LYS B 45 7.791 14.898 1.335 1.00 0.00 H new ATOM 1826 N GLY B 46 3.756 14.778 7.686 1.00 0.00 N ATOM 1827 CA GLY B 46 3.492 15.773 8.758 1.00 0.00 C ATOM 1828 C GLY B 46 2.723 15.106 9.899 1.00 0.00 C ATOM 1829 O GLY B 46 2.831 15.499 11.044 1.00 0.00 O ATOM 0 H GLY B 46 4.112 13.877 8.006 1.00 0.00 H new ATOM 0 HA2 GLY B 46 4.432 16.181 9.129 1.00 0.00 H new ATOM 0 HA3 GLY B 46 2.918 16.609 8.359 1.00 0.00 H new ATOM 1833 N GLY B 47 1.946 14.100 9.600 1.00 0.00 N ATOM 1834 CA GLY B 47 1.174 13.418 10.673 1.00 0.00 C ATOM 1835 C GLY B 47 -0.318 13.513 10.365 1.00 0.00 C ATOM 1836 O GLY B 47 -1.028 14.336 10.909 1.00 0.00 O ATOM 0 H GLY B 47 1.814 13.723 8.661 1.00 0.00 H new ATOM 0 HA2 GLY B 47 1.476 12.373 10.745 1.00 0.00 H new ATOM 0 HA3 GLY B 47 1.387 13.878 11.638 1.00 0.00 H new ATOM 1840 N GLN B 48 -0.796 12.676 9.492 1.00 0.00 N ATOM 1841 CA GLN B 48 -2.240 12.703 9.134 1.00 0.00 C ATOM 1842 C GLN B 48 -2.524 11.624 8.090 1.00 0.00 C ATOM 1843 O GLN B 48 -2.219 11.782 6.924 1.00 0.00 O ATOM 1844 CB GLN B 48 -2.480 14.096 8.552 1.00 0.00 C ATOM 1845 CG GLN B 48 -3.387 14.892 9.492 1.00 0.00 C ATOM 1846 CD GLN B 48 -4.656 15.306 8.745 1.00 0.00 C ATOM 1847 OE1 GLN B 48 -5.677 14.658 8.852 1.00 0.00 O ATOM 1848 NE2 GLN B 48 -4.633 16.368 7.986 1.00 0.00 N ATOM 0 H GLN B 48 -0.245 11.968 9.007 1.00 0.00 H new ATOM 0 HA GLN B 48 -2.890 12.509 9.987 1.00 0.00 H new ATOM 0 HB2 GLN B 48 -1.531 14.615 8.419 1.00 0.00 H new ATOM 0 HB3 GLN B 48 -2.940 14.016 7.567 1.00 0.00 H new ATOM 0 HG2 GLN B 48 -3.645 14.289 10.363 1.00 0.00 H new ATOM 0 HG3 GLN B 48 -2.864 15.775 9.859 1.00 0.00 H new ATOM 0 HE21 GLN B 48 -3.775 16.912 7.896 1.00 0.00 H new ATOM 0 HE22 GLN B 48 -5.473 16.653 7.483 1.00 0.00 H new ATOM 1857 N LYS B 49 -3.088 10.523 8.497 1.00 0.00 N ATOM 1858 CA LYS B 49 -3.366 9.434 7.523 1.00 0.00 C ATOM 1859 C LYS B 49 -4.860 9.302 7.263 1.00 0.00 C ATOM 1860 O LYS B 49 -5.682 9.921 7.906 1.00 0.00 O ATOM 1861 CB LYS B 49 -2.830 8.171 8.189 1.00 0.00 C ATOM 1862 CG LYS B 49 -3.283 6.928 7.421 1.00 0.00 C ATOM 1863 CD LYS B 49 -2.675 5.681 8.066 1.00 0.00 C ATOM 1864 CE LYS B 49 -3.049 5.638 9.549 1.00 0.00 C ATOM 1865 NZ LYS B 49 -2.370 4.424 10.083 1.00 0.00 N ATOM 0 H LYS B 49 -3.368 10.330 9.459 1.00 0.00 H new ATOM 0 HA LYS B 49 -2.901 9.626 6.556 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -1.741 8.206 8.226 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -3.183 8.118 9.219 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -4.371 6.860 7.427 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -2.974 6.999 6.378 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -3.038 4.785 7.563 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -1.591 5.693 7.954 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -2.715 6.537 10.067 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -4.129 5.577 9.682 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -2.580 4.327 11.097 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -2.713 3.583 9.576 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -1.343 4.514 9.949 1.00 0.00 H new ATOM 1879 N VAL B 50 -5.199 8.488 6.315 1.00 0.00 N ATOM 1880 CA VAL B 50 -6.638 8.278 5.970 1.00 0.00 C ATOM 1881 C VAL B 50 -6.785 7.067 5.045 1.00 0.00 C ATOM 1882 O VAL B 50 -5.868 6.288 4.875 1.00 0.00 O ATOM 1883 CB VAL B 50 -7.071 9.556 5.247 1.00 0.00 C ATOM 1884 CG1 VAL B 50 -7.496 10.608 6.273 1.00 0.00 C ATOM 1885 CG2 VAL B 50 -5.907 10.099 4.415 1.00 0.00 C ATOM 0 H VAL B 50 -4.540 7.949 5.753 1.00 0.00 H new ATOM 0 HA VAL B 50 -7.248 8.086 6.853 1.00 0.00 H new ATOM 0 HB VAL B 50 -7.910 9.328 4.590 1.00 0.00 H new ATOM 0 HG11 VAL B 50 -7.804 11.517 5.756 1.00 0.00 H new ATOM 0 HG12 VAL B 50 -8.330 10.226 6.862 1.00 0.00 H new ATOM 0 HG13 VAL B 50 -6.658 10.832 6.933 1.00 0.00 H new ATOM 0 HG21 VAL B 50 -6.220 11.009 3.902 1.00 0.00 H new ATOM 0 HG22 VAL B 50 -5.065 10.323 5.070 1.00 0.00 H new ATOM 0 HG23 VAL B 50 -5.606 9.353 3.680 1.00 0.00 H new ATOM 1895 N CYS B 51 -7.931 6.906 4.441 1.00 0.00 N ATOM 1896 CA CYS B 51 -8.133 5.749 3.526 1.00 0.00 C ATOM 1897 C CYS B 51 -8.220 6.237 2.079 1.00 0.00 C ATOM 1898 O CYS B 51 -8.671 7.332 1.810 1.00 0.00 O ATOM 1899 CB CYS B 51 -9.453 5.122 3.970 1.00 0.00 C ATOM 1900 SG CYS B 51 -9.165 4.077 5.421 1.00 0.00 S ATOM 0 H CYS B 51 -8.735 7.526 4.542 1.00 0.00 H new ATOM 0 HA CYS B 51 -7.312 5.033 3.569 1.00 0.00 H new ATOM 0 HB2 CYS B 51 -10.177 5.902 4.208 1.00 0.00 H new ATOM 0 HB3 CYS B 51 -9.877 4.529 3.160 1.00 0.00 H new ATOM 0 HG CYS B 51 -10.288 3.544 5.802 1.00 0.00 H new ATOM 1905 N LEU B 52 -7.764 5.445 1.149 1.00 0.00 N ATOM 1906 CA LEU B 52 -7.790 5.869 -0.265 1.00 0.00 C ATOM 1907 C LEU B 52 -8.820 5.069 -1.068 1.00 0.00 C ATOM 1908 O LEU B 52 -9.312 4.046 -0.630 1.00 0.00 O ATOM 1909 CB LEU B 52 -6.380 5.562 -0.743 1.00 0.00 C ATOM 1910 CG LEU B 52 -5.696 6.854 -1.175 1.00 0.00 C ATOM 1911 CD1 LEU B 52 -4.180 6.677 -1.088 1.00 0.00 C ATOM 1912 CD2 LEU B 52 -6.089 7.187 -2.615 1.00 0.00 C ATOM 0 H LEU B 52 -7.373 4.518 1.316 1.00 0.00 H new ATOM 0 HA LEU B 52 -8.072 6.915 -0.388 1.00 0.00 H new ATOM 0 HB2 LEU B 52 -5.810 5.086 0.055 1.00 0.00 H new ATOM 0 HB3 LEU B 52 -6.412 4.859 -1.576 1.00 0.00 H new ATOM 0 HG LEU B 52 -6.008 7.667 -0.519 1.00 0.00 H new ATOM 0 HD11 LEU B 52 -3.688 7.599 -1.396 1.00 0.00 H new ATOM 0 HD12 LEU B 52 -3.899 6.442 -0.061 1.00 0.00 H new ATOM 0 HD13 LEU B 52 -3.870 5.864 -1.744 1.00 0.00 H new ATOM 0 HD21 LEU B 52 -5.599 8.111 -2.922 1.00 0.00 H new ATOM 0 HD22 LEU B 52 -5.779 6.376 -3.274 1.00 0.00 H new ATOM 0 HD23 LEU B 52 -7.170 7.312 -2.678 1.00 0.00 H new ATOM 1924 N ASP B 53 -9.135 5.548 -2.243 1.00 0.00 N ATOM 1925 CA ASP B 53 -10.128 4.863 -3.125 1.00 0.00 C ATOM 1926 C ASP B 53 -9.899 3.344 -3.150 1.00 0.00 C ATOM 1927 O ASP B 53 -9.212 2.805 -2.307 1.00 0.00 O ATOM 1928 CB ASP B 53 -9.876 5.472 -4.505 1.00 0.00 C ATOM 1929 CG ASP B 53 -11.186 6.024 -5.070 1.00 0.00 C ATOM 1930 OD1 ASP B 53 -12.040 6.394 -4.281 1.00 0.00 O ATOM 1931 OD2 ASP B 53 -11.313 6.069 -6.282 1.00 0.00 O ATOM 0 H ASP B 53 -8.738 6.401 -2.636 1.00 0.00 H new ATOM 0 HA ASP B 53 -11.153 5.001 -2.781 1.00 0.00 H new ATOM 0 HB2 ASP B 53 -9.135 6.269 -4.432 1.00 0.00 H new ATOM 0 HB3 ASP B 53 -9.468 4.718 -5.177 1.00 0.00 H new ATOM 1936 N PRO B 54 -10.491 2.697 -4.123 1.00 0.00 N ATOM 1937 CA PRO B 54 -10.353 1.230 -4.244 1.00 0.00 C ATOM 1938 C PRO B 54 -9.044 0.905 -4.956 1.00 0.00 C ATOM 1939 O PRO B 54 -9.023 0.625 -6.138 1.00 0.00 O ATOM 1940 CB PRO B 54 -11.556 0.829 -5.091 1.00 0.00 C ATOM 1941 CG PRO B 54 -11.920 2.051 -5.883 1.00 0.00 C ATOM 1942 CD PRO B 54 -11.326 3.259 -5.194 1.00 0.00 C ATOM 0 HA PRO B 54 -10.329 0.706 -3.289 1.00 0.00 H new ATOM 0 HB2 PRO B 54 -11.311 -0.005 -5.748 1.00 0.00 H new ATOM 0 HB3 PRO B 54 -12.387 0.507 -4.463 1.00 0.00 H new ATOM 0 HG2 PRO B 54 -11.540 1.970 -6.902 1.00 0.00 H new ATOM 0 HG3 PRO B 54 -13.003 2.149 -5.954 1.00 0.00 H new ATOM 0 HD2 PRO B 54 -10.734 3.859 -5.885 1.00 0.00 H new ATOM 0 HD3 PRO B 54 -12.103 3.909 -4.792 1.00 0.00 H new ATOM 1950 N GLU B 55 -7.945 0.972 -4.254 1.00 0.00 N ATOM 1951 CA GLU B 55 -6.635 0.709 -4.905 1.00 0.00 C ATOM 1952 C GLU B 55 -6.320 1.893 -5.816 1.00 0.00 C ATOM 1953 O GLU B 55 -5.501 1.813 -6.709 1.00 0.00 O ATOM 1954 CB GLU B 55 -6.828 -0.589 -5.705 1.00 0.00 C ATOM 1955 CG GLU B 55 -6.864 -0.290 -7.209 1.00 0.00 C ATOM 1956 CD GLU B 55 -7.558 -1.440 -7.942 1.00 0.00 C ATOM 1957 OE1 GLU B 55 -8.666 -1.777 -7.560 1.00 0.00 O ATOM 1958 OE2 GLU B 55 -6.968 -1.963 -8.873 1.00 0.00 O ATOM 0 H GLU B 55 -7.900 1.197 -3.260 1.00 0.00 H new ATOM 0 HA GLU B 55 -5.808 0.598 -4.204 1.00 0.00 H new ATOM 0 HB2 GLU B 55 -6.017 -1.283 -5.485 1.00 0.00 H new ATOM 0 HB3 GLU B 55 -7.755 -1.076 -5.402 1.00 0.00 H new ATOM 0 HG2 GLU B 55 -7.394 0.645 -7.392 1.00 0.00 H new ATOM 0 HG3 GLU B 55 -5.851 -0.161 -7.589 1.00 0.00 H new ATOM 1965 N ALA B 56 -6.990 2.995 -5.594 1.00 0.00 N ATOM 1966 CA ALA B 56 -6.764 4.194 -6.441 1.00 0.00 C ATOM 1967 C ALA B 56 -6.651 3.764 -7.904 1.00 0.00 C ATOM 1968 O ALA B 56 -5.606 3.877 -8.506 1.00 0.00 O ATOM 1969 CB ALA B 56 -5.454 4.807 -5.939 1.00 0.00 C ATOM 0 H ALA B 56 -7.686 3.112 -4.858 1.00 0.00 H new ATOM 0 HA ALA B 56 -7.579 4.915 -6.380 1.00 0.00 H new ATOM 0 HB1 ALA B 56 -5.223 5.699 -6.521 1.00 0.00 H new ATOM 0 HB2 ALA B 56 -5.557 5.076 -4.888 1.00 0.00 H new ATOM 0 HB3 ALA B 56 -4.647 4.083 -6.051 1.00 0.00 H new ATOM 1975 N PRO B 57 -7.746 3.276 -8.423 1.00 0.00 N ATOM 1976 CA PRO B 57 -7.783 2.814 -9.829 1.00 0.00 C ATOM 1977 C PRO B 57 -7.810 4.022 -10.761 1.00 0.00 C ATOM 1978 O PRO B 57 -6.830 4.344 -11.403 1.00 0.00 O ATOM 1979 CB PRO B 57 -9.083 2.020 -9.914 1.00 0.00 C ATOM 1980 CG PRO B 57 -9.952 2.567 -8.825 1.00 0.00 C ATOM 1981 CD PRO B 57 -9.041 3.116 -7.753 1.00 0.00 C ATOM 0 HA PRO B 57 -6.918 2.217 -10.119 1.00 0.00 H new ATOM 0 HB2 PRO B 57 -9.554 2.139 -10.890 1.00 0.00 H new ATOM 0 HB3 PRO B 57 -8.903 0.954 -9.775 1.00 0.00 H new ATOM 0 HG2 PRO B 57 -10.605 3.350 -9.212 1.00 0.00 H new ATOM 0 HG3 PRO B 57 -10.596 1.787 -8.419 1.00 0.00 H new ATOM 0 HD2 PRO B 57 -9.409 4.067 -7.367 1.00 0.00 H new ATOM 0 HD3 PRO B 57 -8.969 2.434 -6.905 1.00 0.00 H new ATOM 1989 N LEU B 58 -8.913 4.714 -10.823 1.00 0.00 N ATOM 1990 CA LEU B 58 -8.970 5.913 -11.693 1.00 0.00 C ATOM 1991 C LEU B 58 -7.765 6.798 -11.379 1.00 0.00 C ATOM 1992 O LEU B 58 -7.135 7.350 -12.259 1.00 0.00 O ATOM 1993 CB LEU B 58 -10.277 6.618 -11.320 1.00 0.00 C ATOM 1994 CG LEU B 58 -10.399 7.925 -12.105 1.00 0.00 C ATOM 1995 CD1 LEU B 58 -10.727 7.614 -13.566 1.00 0.00 C ATOM 1996 CD2 LEU B 58 -11.518 8.776 -11.502 1.00 0.00 C ATOM 0 H LEU B 58 -9.770 4.501 -10.312 1.00 0.00 H new ATOM 0 HA LEU B 58 -8.943 5.676 -12.757 1.00 0.00 H new ATOM 0 HB2 LEU B 58 -11.126 5.970 -11.539 1.00 0.00 H new ATOM 0 HB3 LEU B 58 -10.299 6.822 -10.249 1.00 0.00 H new ATOM 0 HG LEU B 58 -9.457 8.471 -12.053 1.00 0.00 H new ATOM 0 HD11 LEU B 58 -10.814 8.545 -14.126 1.00 0.00 H new ATOM 0 HD12 LEU B 58 -9.932 7.005 -13.996 1.00 0.00 H new ATOM 0 HD13 LEU B 58 -11.670 7.069 -13.619 1.00 0.00 H new ATOM 0 HD21 LEU B 58 -11.607 9.708 -12.060 1.00 0.00 H new ATOM 0 HD22 LEU B 58 -12.460 8.230 -11.556 1.00 0.00 H new ATOM 0 HD23 LEU B 58 -11.286 8.997 -10.460 1.00 0.00 H new ATOM 2008 N VAL B 59 -7.435 6.924 -10.119 1.00 0.00 N ATOM 2009 CA VAL B 59 -6.261 7.760 -9.736 1.00 0.00 C ATOM 2010 C VAL B 59 -4.989 6.909 -9.685 1.00 0.00 C ATOM 2011 O VAL B 59 -3.933 7.381 -9.314 1.00 0.00 O ATOM 2012 CB VAL B 59 -6.597 8.295 -8.349 1.00 0.00 C ATOM 2013 CG1 VAL B 59 -5.426 9.133 -7.836 1.00 0.00 C ATOM 2014 CG2 VAL B 59 -7.852 9.165 -8.430 1.00 0.00 C ATOM 0 H VAL B 59 -7.928 6.485 -9.341 1.00 0.00 H new ATOM 0 HA VAL B 59 -6.076 8.560 -10.453 1.00 0.00 H new ATOM 0 HB VAL B 59 -6.777 7.463 -7.668 1.00 0.00 H new ATOM 0 HG11 VAL B 59 -5.661 9.518 -6.844 1.00 0.00 H new ATOM 0 HG12 VAL B 59 -4.531 8.513 -7.782 1.00 0.00 H new ATOM 0 HG13 VAL B 59 -5.249 9.966 -8.516 1.00 0.00 H new ATOM 0 HG21 VAL B 59 -8.094 9.548 -7.439 1.00 0.00 H new ATOM 0 HG22 VAL B 59 -7.673 9.999 -9.108 1.00 0.00 H new ATOM 0 HG23 VAL B 59 -8.685 8.568 -8.801 1.00 0.00 H new ATOM 2024 N GLN B 60 -5.080 5.659 -10.043 1.00 0.00 N ATOM 2025 CA GLN B 60 -3.871 4.786 -10.000 1.00 0.00 C ATOM 2026 C GLN B 60 -2.708 5.461 -10.723 1.00 0.00 C ATOM 2027 O GLN B 60 -1.605 5.528 -10.217 1.00 0.00 O ATOM 2028 CB GLN B 60 -4.272 3.489 -10.704 1.00 0.00 C ATOM 2029 CG GLN B 60 -3.391 2.342 -10.198 1.00 0.00 C ATOM 2030 CD GLN B 60 -3.682 2.074 -8.717 1.00 0.00 C ATOM 2031 OE1 GLN B 60 -3.588 2.963 -7.895 1.00 0.00 O ATOM 2032 NE2 GLN B 60 -4.028 0.874 -8.338 1.00 0.00 N ATOM 0 H GLN B 60 -5.935 5.204 -10.363 1.00 0.00 H new ATOM 0 HA GLN B 60 -3.541 4.596 -8.979 1.00 0.00 H new ATOM 0 HB2 GLN B 60 -5.322 3.268 -10.512 1.00 0.00 H new ATOM 0 HB3 GLN B 60 -4.161 3.599 -11.783 1.00 0.00 H new ATOM 0 HG2 GLN B 60 -3.579 1.442 -10.783 1.00 0.00 H new ATOM 0 HG3 GLN B 60 -2.339 2.594 -10.331 1.00 0.00 H new ATOM 0 HE21 GLN B 60 -4.108 0.125 -9.026 1.00 0.00 H new ATOM 0 HE22 GLN B 60 -4.219 0.685 -7.354 1.00 0.00 H new ATOM 2041 N LYS B 61 -2.946 5.971 -11.895 1.00 0.00 N ATOM 2042 CA LYS B 61 -1.847 6.651 -12.638 1.00 0.00 C ATOM 2043 C LYS B 61 -1.086 7.565 -11.681 1.00 0.00 C ATOM 2044 O LYS B 61 0.123 7.505 -11.572 1.00 0.00 O ATOM 2045 CB LYS B 61 -2.543 7.464 -13.730 1.00 0.00 C ATOM 2046 CG LYS B 61 -1.530 8.397 -14.396 1.00 0.00 C ATOM 2047 CD LYS B 61 -0.715 7.613 -15.425 1.00 0.00 C ATOM 2048 CE LYS B 61 0.463 8.467 -15.902 1.00 0.00 C ATOM 2049 NZ LYS B 61 0.897 7.839 -17.181 1.00 0.00 N ATOM 0 H LYS B 61 -3.848 5.948 -12.371 1.00 0.00 H new ATOM 0 HA LYS B 61 -1.128 5.952 -13.064 1.00 0.00 H new ATOM 0 HB2 LYS B 61 -2.981 6.796 -14.472 1.00 0.00 H new ATOM 0 HB3 LYS B 61 -3.360 8.044 -13.301 1.00 0.00 H new ATOM 0 HG2 LYS B 61 -2.046 9.226 -14.880 1.00 0.00 H new ATOM 0 HG3 LYS B 61 -0.869 8.829 -13.645 1.00 0.00 H new ATOM 0 HD2 LYS B 61 -0.350 6.685 -14.985 1.00 0.00 H new ATOM 0 HD3 LYS B 61 -1.345 7.339 -16.271 1.00 0.00 H new ATOM 0 HE2 LYS B 61 0.164 9.504 -16.052 1.00 0.00 H new ATOM 0 HE3 LYS B 61 1.270 8.471 -15.170 1.00 0.00 H new ATOM 0 HZ1 LYS B 61 1.703 8.368 -17.572 1.00 0.00 H new ATOM 0 HZ2 LYS B 61 1.182 6.854 -17.005 1.00 0.00 H new ATOM 0 HZ3 LYS B 61 0.110 7.856 -17.860 1.00 0.00 H new ATOM 2063 N ILE B 62 -1.793 8.395 -10.971 1.00 0.00 N ATOM 2064 CA ILE B 62 -1.128 9.302 -9.996 1.00 0.00 C ATOM 2065 C ILE B 62 -0.515 8.461 -8.874 1.00 0.00 C ATOM 2066 O ILE B 62 0.463 8.840 -8.263 1.00 0.00 O ATOM 2067 CB ILE B 62 -2.249 10.202 -9.475 1.00 0.00 C ATOM 2068 CG1 ILE B 62 -2.557 11.283 -10.513 1.00 0.00 C ATOM 2069 CG2 ILE B 62 -1.812 10.863 -8.169 1.00 0.00 C ATOM 2070 CD1 ILE B 62 -1.353 12.216 -10.654 1.00 0.00 C ATOM 0 H ILE B 62 -2.808 8.485 -11.023 1.00 0.00 H new ATOM 0 HA ILE B 62 -0.321 9.893 -10.430 1.00 0.00 H new ATOM 0 HB ILE B 62 -3.141 9.602 -9.296 1.00 0.00 H new ATOM 0 HG12 ILE B 62 -2.788 10.823 -11.474 1.00 0.00 H new ATOM 0 HG13 ILE B 62 -3.437 11.851 -10.211 1.00 0.00 H new ATOM 0 HG21 ILE B 62 -2.613 11.504 -7.800 1.00 0.00 H new ATOM 0 HG22 ILE B 62 -1.592 10.094 -7.428 1.00 0.00 H new ATOM 0 HG23 ILE B 62 -0.919 11.463 -8.346 1.00 0.00 H new ATOM 0 HD11 ILE B 62 -1.574 12.986 -11.394 1.00 0.00 H new ATOM 0 HD12 ILE B 62 -1.142 12.686 -9.693 1.00 0.00 H new ATOM 0 HD13 ILE B 62 -0.484 11.642 -10.976 1.00 0.00 H new ATOM 2082 N ILE B 63 -1.068 7.302 -8.627 1.00 0.00 N ATOM 2083 CA ILE B 63 -0.499 6.416 -7.577 1.00 0.00 C ATOM 2084 C ILE B 63 0.793 5.825 -8.114 1.00 0.00 C ATOM 2085 O ILE B 63 1.837 5.912 -7.498 1.00 0.00 O ATOM 2086 CB ILE B 63 -1.565 5.339 -7.356 1.00 0.00 C ATOM 2087 CG1 ILE B 63 -2.221 5.556 -5.996 1.00 0.00 C ATOM 2088 CG2 ILE B 63 -0.933 3.947 -7.407 1.00 0.00 C ATOM 2089 CD1 ILE B 63 -2.590 7.030 -5.863 1.00 0.00 C ATOM 0 H ILE B 63 -1.888 6.934 -9.108 1.00 0.00 H new ATOM 0 HA ILE B 63 -0.266 6.924 -6.641 1.00 0.00 H new ATOM 0 HB ILE B 63 -2.315 5.410 -8.144 1.00 0.00 H new ATOM 0 HG12 ILE B 63 -3.111 4.933 -5.902 1.00 0.00 H new ATOM 0 HG13 ILE B 63 -1.540 5.263 -5.197 1.00 0.00 H new ATOM 0 HG21 ILE B 63 -1.703 3.192 -7.248 1.00 0.00 H new ATOM 0 HG22 ILE B 63 -0.469 3.793 -8.381 1.00 0.00 H new ATOM 0 HG23 ILE B 63 -0.176 3.862 -6.628 1.00 0.00 H new ATOM 0 HD11 ILE B 63 -3.061 7.201 -4.895 1.00 0.00 H new ATOM 0 HD12 ILE B 63 -1.689 7.639 -5.942 1.00 0.00 H new ATOM 0 HD13 ILE B 63 -3.284 7.304 -6.657 1.00 0.00 H new ATOM 2101 N GLN B 64 0.739 5.260 -9.282 1.00 0.00 N ATOM 2102 CA GLN B 64 1.981 4.707 -9.878 1.00 0.00 C ATOM 2103 C GLN B 64 3.049 5.791 -9.784 1.00 0.00 C ATOM 2104 O GLN B 64 4.230 5.521 -9.708 1.00 0.00 O ATOM 2105 CB GLN B 64 1.634 4.399 -11.335 1.00 0.00 C ATOM 2106 CG GLN B 64 0.819 3.106 -11.402 1.00 0.00 C ATOM 2107 CD GLN B 64 1.045 2.428 -12.754 1.00 0.00 C ATOM 2108 OE1 GLN B 64 0.442 2.799 -13.742 1.00 0.00 O ATOM 2109 NE2 GLN B 64 1.894 1.440 -12.841 1.00 0.00 N ATOM 0 H GLN B 64 -0.104 5.157 -9.847 1.00 0.00 H new ATOM 0 HA GLN B 64 2.350 3.810 -9.380 1.00 0.00 H new ATOM 0 HB2 GLN B 64 1.065 5.223 -11.767 1.00 0.00 H new ATOM 0 HB3 GLN B 64 2.546 4.298 -11.924 1.00 0.00 H new ATOM 0 HG2 GLN B 64 1.113 2.436 -10.594 1.00 0.00 H new ATOM 0 HG3 GLN B 64 -0.240 3.324 -11.265 1.00 0.00 H new ATOM 0 HE21 GLN B 64 2.400 1.128 -12.012 1.00 0.00 H new ATOM 0 HE22 GLN B 64 2.051 0.980 -13.738 1.00 0.00 H new ATOM 2118 N LYS B 65 2.618 7.027 -9.755 1.00 0.00 N ATOM 2119 CA LYS B 65 3.580 8.151 -9.627 1.00 0.00 C ATOM 2120 C LYS B 65 4.132 8.155 -8.204 1.00 0.00 C ATOM 2121 O LYS B 65 5.293 8.432 -7.973 1.00 0.00 O ATOM 2122 CB LYS B 65 2.760 9.415 -9.894 1.00 0.00 C ATOM 2123 CG LYS B 65 3.621 10.431 -10.647 1.00 0.00 C ATOM 2124 CD LYS B 65 4.397 11.288 -9.643 1.00 0.00 C ATOM 2125 CE LYS B 65 3.463 12.335 -9.034 1.00 0.00 C ATOM 2126 NZ LYS B 65 4.343 13.192 -8.193 1.00 0.00 N ATOM 0 H LYS B 65 1.637 7.301 -9.815 1.00 0.00 H new ATOM 0 HA LYS B 65 4.422 8.077 -10.315 1.00 0.00 H new ATOM 0 HB2 LYS B 65 1.873 9.170 -10.478 1.00 0.00 H new ATOM 0 HB3 LYS B 65 2.413 9.842 -8.953 1.00 0.00 H new ATOM 0 HG2 LYS B 65 4.313 9.915 -11.312 1.00 0.00 H new ATOM 0 HG3 LYS B 65 2.992 11.065 -11.272 1.00 0.00 H new ATOM 0 HD2 LYS B 65 4.815 10.658 -8.858 1.00 0.00 H new ATOM 0 HD3 LYS B 65 5.235 11.778 -10.139 1.00 0.00 H new ATOM 0 HE2 LYS B 65 2.966 12.919 -9.809 1.00 0.00 H new ATOM 0 HE3 LYS B 65 2.681 11.867 -8.437 1.00 0.00 H new ATOM 0 HZ1 LYS B 65 3.774 13.936 -7.741 1.00 0.00 H new ATOM 0 HZ2 LYS B 65 4.797 12.610 -7.460 1.00 0.00 H new ATOM 0 HZ3 LYS B 65 5.074 13.630 -8.789 1.00 0.00 H new ATOM 2140 N ILE B 66 3.303 7.826 -7.249 1.00 0.00 N ATOM 2141 CA ILE B 66 3.769 7.781 -5.838 1.00 0.00 C ATOM 2142 C ILE B 66 4.603 6.517 -5.630 1.00 0.00 C ATOM 2143 O ILE B 66 5.584 6.512 -4.912 1.00 0.00 O ATOM 2144 CB ILE B 66 2.494 7.754 -4.986 1.00 0.00 C ATOM 2145 CG1 ILE B 66 2.726 8.556 -3.703 1.00 0.00 C ATOM 2146 CG2 ILE B 66 2.133 6.311 -4.619 1.00 0.00 C ATOM 2147 CD1 ILE B 66 1.837 9.801 -3.711 1.00 0.00 C ATOM 0 H ILE B 66 2.321 7.586 -7.389 1.00 0.00 H new ATOM 0 HA ILE B 66 4.395 8.632 -5.569 1.00 0.00 H new ATOM 0 HB ILE B 66 1.676 8.192 -5.558 1.00 0.00 H new ATOM 0 HG12 ILE B 66 2.501 7.941 -2.832 1.00 0.00 H new ATOM 0 HG13 ILE B 66 3.774 8.845 -3.627 1.00 0.00 H new ATOM 0 HG21 ILE B 66 1.226 6.305 -4.014 1.00 0.00 H new ATOM 0 HG22 ILE B 66 1.966 5.735 -5.529 1.00 0.00 H new ATOM 0 HG23 ILE B 66 2.950 5.864 -4.052 1.00 0.00 H new ATOM 0 HD11 ILE B 66 2.002 10.372 -2.797 1.00 0.00 H new ATOM 0 HD12 ILE B 66 2.084 10.419 -4.575 1.00 0.00 H new ATOM 0 HD13 ILE B 66 0.791 9.501 -3.767 1.00 0.00 H new ATOM 2159 N LEU B 67 4.227 5.451 -6.278 1.00 0.00 N ATOM 2160 CA LEU B 67 4.996 4.184 -6.152 1.00 0.00 C ATOM 2161 C LEU B 67 6.336 4.337 -6.870 1.00 0.00 C ATOM 2162 O LEU B 67 7.348 3.814 -6.447 1.00 0.00 O ATOM 2163 CB LEU B 67 4.131 3.127 -6.841 1.00 0.00 C ATOM 2164 CG LEU B 67 3.190 2.492 -5.819 1.00 0.00 C ATOM 2165 CD1 LEU B 67 1.903 3.312 -5.734 1.00 0.00 C ATOM 2166 CD2 LEU B 67 2.854 1.063 -6.255 1.00 0.00 C ATOM 0 H LEU B 67 3.415 5.403 -6.893 1.00 0.00 H new ATOM 0 HA LEU B 67 5.208 3.915 -5.117 1.00 0.00 H new ATOM 0 HB2 LEU B 67 3.556 3.582 -7.647 1.00 0.00 H new ATOM 0 HB3 LEU B 67 4.763 2.363 -7.293 1.00 0.00 H new ATOM 0 HG LEU B 67 3.674 2.471 -4.843 1.00 0.00 H new ATOM 0 HD11 LEU B 67 1.231 2.860 -5.005 1.00 0.00 H new ATOM 0 HD12 LEU B 67 2.140 4.330 -5.426 1.00 0.00 H new ATOM 0 HD13 LEU B 67 1.419 3.332 -6.710 1.00 0.00 H new ATOM 0 HD21 LEU B 67 2.183 0.609 -5.526 1.00 0.00 H new ATOM 0 HD22 LEU B 67 2.369 1.085 -7.231 1.00 0.00 H new ATOM 0 HD23 LEU B 67 3.771 0.477 -6.318 1.00 0.00 H new ATOM 2178 N ASN B 68 6.344 5.063 -7.953 1.00 0.00 N ATOM 2179 CA ASN B 68 7.607 5.271 -8.709 1.00 0.00 C ATOM 2180 C ASN B 68 8.327 6.519 -8.192 1.00 0.00 C ATOM 2181 O ASN B 68 9.281 6.985 -8.781 1.00 0.00 O ATOM 2182 CB ASN B 68 7.173 5.466 -10.161 1.00 0.00 C ATOM 2183 CG ASN B 68 8.161 4.757 -11.089 1.00 0.00 C ATOM 2184 OD1 ASN B 68 9.168 5.321 -11.469 1.00 0.00 O ATOM 2185 ND2 ASN B 68 7.914 3.534 -11.472 1.00 0.00 N ATOM 0 H ASN B 68 5.524 5.523 -8.348 1.00 0.00 H new ATOM 0 HA ASN B 68 8.298 4.435 -8.601 1.00 0.00 H new ATOM 0 HB2 ASN B 68 6.169 5.067 -10.308 1.00 0.00 H new ATOM 0 HB3 ASN B 68 7.132 6.529 -10.400 1.00 0.00 H new ATOM 0 HD21 ASN B 68 8.566 3.052 -12.090 1.00 0.00 H new ATOM 0 HD22 ASN B 68 7.069 3.061 -11.153 1.00 0.00 H new ATOM 2192 N LYS B 69 7.876 7.066 -7.094 1.00 0.00 N ATOM 2193 CA LYS B 69 8.535 8.287 -6.542 1.00 0.00 C ATOM 2194 C LYS B 69 9.850 7.926 -5.858 1.00 0.00 C ATOM 2195 O LYS B 69 10.452 8.728 -5.173 1.00 0.00 O ATOM 2196 CB LYS B 69 7.539 8.869 -5.540 1.00 0.00 C ATOM 2197 CG LYS B 69 7.051 10.231 -6.037 1.00 0.00 C ATOM 2198 CD LYS B 69 6.486 11.031 -4.861 1.00 0.00 C ATOM 2199 CE LYS B 69 7.584 11.921 -4.275 1.00 0.00 C ATOM 2200 NZ LYS B 69 7.991 11.246 -3.010 1.00 0.00 N ATOM 0 H LYS B 69 7.081 6.721 -6.556 1.00 0.00 H new ATOM 0 HA LYS B 69 8.781 9.005 -7.325 1.00 0.00 H new ATOM 0 HB2 LYS B 69 6.694 8.191 -5.416 1.00 0.00 H new ATOM 0 HB3 LYS B 69 8.010 8.974 -4.563 1.00 0.00 H new ATOM 0 HG2 LYS B 69 7.873 10.777 -6.500 1.00 0.00 H new ATOM 0 HG3 LYS B 69 6.285 10.098 -6.801 1.00 0.00 H new ATOM 0 HD2 LYS B 69 5.646 11.642 -5.193 1.00 0.00 H new ATOM 0 HD3 LYS B 69 6.105 10.354 -4.096 1.00 0.00 H new ATOM 0 HE2 LYS B 69 8.425 12.014 -4.962 1.00 0.00 H new ATOM 0 HE3 LYS B 69 7.216 12.929 -4.084 1.00 0.00 H new ATOM 0 HZ1 LYS B 69 8.426 11.941 -2.370 1.00 0.00 H new ATOM 0 HZ2 LYS B 69 7.154 10.831 -2.553 1.00 0.00 H new ATOM 0 HZ3 LYS B 69 8.678 10.495 -3.223 1.00 0.00 H new