USER MOD reduce.3.24.130724 H: found=0, std=0, add=512, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 513 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 Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 CYS SG : rot 180:sc= -2.62 USER MOD Single : A 22 MET CE :methyl -164:sc= -11! (180deg=-13.3!) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 ASN : amide:sc= 1.08 K(o=1.1,f=-0.28) USER MOD Single : A 29 ASN : amide:sc= -0.314 K(o=-0.31,f=-4.4!) USER MOD Single : A 30 GLN : amide:sc= -6.98! C(o=-7!,f=-4.4!) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 ASN : amide:sc= 0.0547 X(o=0.055,f=-0.28) USER MOD Single : A 44 CYS SG : rot 180:sc= -1.84 USER MOD Single : A 45 ASN : amide:sc= -1.38 K(o=-1.4,f=-10!) USER MOD Single : A 49 GLN : amide:sc= -7.46! C(o=-7.5!,f=-13!) USER MOD Single : A 50 LYS NZ :NH3+ 136:sc= 0.0929 (180deg=0) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot 180:sc= -0.0175 USER MOD Single : A 65 LYS NZ :NH3+ 163:sc= 1.41 (180deg=0.445) USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 ASN : amide:sc= -0.0487 X(o=-0.049,f=-0.55) USER MOD Single : A 72 ASN : amide:sc= -0.608 K(o=-0.61,f=-2) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 166 N TRP A 14 11.130 -10.228 -2.118 1.00 0.00 N ATOM 167 CA TRP A 14 10.232 -11.095 -2.872 1.00 0.00 C ATOM 168 C TRP A 14 10.753 -11.319 -4.288 1.00 0.00 C ATOM 169 O TRP A 14 11.112 -10.369 -4.984 1.00 0.00 O ATOM 170 CB TRP A 14 8.828 -10.491 -2.922 1.00 0.00 C ATOM 171 CG TRP A 14 7.995 -10.825 -1.721 1.00 0.00 C ATOM 172 CD1 TRP A 14 7.620 -9.974 -0.721 1.00 0.00 C ATOM 173 CD2 TRP A 14 7.437 -12.102 -1.393 1.00 0.00 C ATOM 174 NE1 TRP A 14 6.862 -10.645 0.208 1.00 0.00 N ATOM 175 CE2 TRP A 14 6.734 -11.952 -0.182 1.00 0.00 C ATOM 176 CE3 TRP A 14 7.460 -13.358 -2.007 1.00 0.00 C ATOM 177 CZ2 TRP A 14 6.064 -13.010 0.426 1.00 0.00 C ATOM 178 CZ3 TRP A 14 6.795 -14.407 -1.402 1.00 0.00 C ATOM 179 CH2 TRP A 14 6.104 -14.228 -0.196 1.00 0.00 C ATOM 0 HA TRP A 14 10.187 -12.059 -2.364 1.00 0.00 H new ATOM 0 HB2 TRP A 14 8.909 -9.408 -3.009 1.00 0.00 H new ATOM 0 HB3 TRP A 14 8.319 -10.846 -3.818 1.00 0.00 H new ATOM 0 HD1 TRP A 14 7.881 -8.927 -0.668 1.00 0.00 H new ATOM 0 HE1 TRP A 14 6.460 -10.236 1.051 1.00 0.00 H new ATOM 0 HE3 TRP A 14 7.988 -13.505 -2.937 1.00 0.00 H new ATOM 0 HZ2 TRP A 14 5.531 -12.874 1.356 1.00 0.00 H new ATOM 0 HZ3 TRP A 14 6.808 -15.382 -1.867 1.00 0.00 H new ATOM 0 HH2 TRP A 14 5.593 -15.068 0.251 1.00 0.00 H new ATOM 190 N ARG A 15 10.791 -12.579 -4.708 1.00 0.00 N ATOM 191 CA ARG A 15 11.269 -12.926 -6.041 1.00 0.00 C ATOM 192 C ARG A 15 10.130 -12.880 -7.056 1.00 0.00 C ATOM 193 O ARG A 15 8.974 -13.137 -6.720 1.00 0.00 O ATOM 194 CB ARG A 15 11.903 -14.318 -6.032 1.00 0.00 C ATOM 195 CG ARG A 15 13.114 -14.430 -5.122 1.00 0.00 C ATOM 196 CD ARG A 15 14.340 -13.780 -5.743 1.00 0.00 C ATOM 197 NE ARG A 15 15.272 -13.289 -4.731 1.00 0.00 N ATOM 198 CZ ARG A 15 16.213 -12.383 -4.976 1.00 0.00 C ATOM 199 NH1 ARG A 15 16.346 -11.873 -6.192 1.00 0.00 N ATOM 200 NH2 ARG A 15 17.022 -11.987 -4.002 1.00 0.00 N ATOM 0 H ARG A 15 10.497 -13.377 -4.145 1.00 0.00 H new ATOM 0 HA ARG A 15 12.022 -12.193 -6.332 1.00 0.00 H new ATOM 0 HB2 ARG A 15 11.155 -15.046 -5.719 1.00 0.00 H new ATOM 0 HB3 ARG A 15 12.197 -14.580 -7.048 1.00 0.00 H new ATOM 0 HG2 ARG A 15 12.896 -13.957 -4.165 1.00 0.00 H new ATOM 0 HG3 ARG A 15 13.322 -15.481 -4.919 1.00 0.00 H new ATOM 0 HD2 ARG A 15 14.847 -14.501 -6.383 1.00 0.00 H new ATOM 0 HD3 ARG A 15 14.028 -12.952 -6.380 1.00 0.00 H new ATOM 0 HE ARG A 15 15.196 -13.662 -3.785 1.00 0.00 H new ATOM 0 HH11 ARG A 15 15.725 -12.176 -6.943 1.00 0.00 H new ATOM 0 HH12 ARG A 15 17.069 -11.178 -6.377 1.00 0.00 H new ATOM 0 HH21 ARG A 15 16.922 -12.378 -3.065 1.00 0.00 H new ATOM 0 HH22 ARG A 15 17.744 -11.292 -4.190 1.00 0.00 H new ATOM 214 N LYS A 16 10.465 -12.551 -8.299 1.00 0.00 N ATOM 215 CA LYS A 16 9.472 -12.471 -9.364 1.00 0.00 C ATOM 216 C LYS A 16 8.717 -13.789 -9.502 1.00 0.00 C ATOM 217 O LYS A 16 7.554 -13.808 -9.904 1.00 0.00 O ATOM 218 CB LYS A 16 10.145 -12.115 -10.691 1.00 0.00 C ATOM 219 CG LYS A 16 10.882 -10.787 -10.662 1.00 0.00 C ATOM 220 CD LYS A 16 10.896 -10.127 -12.031 1.00 0.00 C ATOM 221 CE LYS A 16 11.955 -9.038 -12.113 1.00 0.00 C ATOM 222 NZ LYS A 16 11.994 -8.404 -13.460 1.00 0.00 N ATOM 0 H LYS A 16 11.417 -12.335 -8.594 1.00 0.00 H new ATOM 0 HA LYS A 16 8.759 -11.689 -9.105 1.00 0.00 H new ATOM 0 HB2 LYS A 16 10.848 -12.905 -10.956 1.00 0.00 H new ATOM 0 HB3 LYS A 16 9.389 -12.084 -11.476 1.00 0.00 H new ATOM 0 HG2 LYS A 16 10.407 -10.122 -9.941 1.00 0.00 H new ATOM 0 HG3 LYS A 16 11.906 -10.945 -10.323 1.00 0.00 H new ATOM 0 HD2 LYS A 16 11.086 -10.879 -12.797 1.00 0.00 H new ATOM 0 HD3 LYS A 16 9.915 -9.699 -12.240 1.00 0.00 H new ATOM 0 HE2 LYS A 16 11.753 -8.277 -11.359 1.00 0.00 H new ATOM 0 HE3 LYS A 16 12.932 -9.463 -11.883 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 12.728 -7.667 -13.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 12.212 -9.125 -14.177 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 11.069 -7.976 -13.669 1.00 0.00 H new ATOM 236 N GLU A 17 9.386 -14.888 -9.167 1.00 0.00 N ATOM 237 CA GLU A 17 8.776 -16.210 -9.254 1.00 0.00 C ATOM 238 C GLU A 17 7.693 -16.380 -8.193 1.00 0.00 C ATOM 239 O GLU A 17 6.598 -16.866 -8.480 1.00 0.00 O ATOM 240 CB GLU A 17 9.839 -17.298 -9.094 1.00 0.00 C ATOM 241 CG GLU A 17 11.084 -17.061 -9.932 1.00 0.00 C ATOM 242 CD GLU A 17 12.203 -18.028 -9.600 1.00 0.00 C ATOM 243 OE1 GLU A 17 12.788 -17.904 -8.503 1.00 0.00 O ATOM 244 OE2 GLU A 17 12.496 -18.909 -10.436 1.00 0.00 O ATOM 0 H GLU A 17 10.350 -14.889 -8.833 1.00 0.00 H new ATOM 0 HA GLU A 17 8.315 -16.306 -10.237 1.00 0.00 H new ATOM 0 HB2 GLU A 17 10.125 -17.363 -8.044 1.00 0.00 H new ATOM 0 HB3 GLU A 17 9.406 -18.260 -9.367 1.00 0.00 H new ATOM 0 HG2 GLU A 17 10.830 -17.154 -10.988 1.00 0.00 H new ATOM 0 HG3 GLU A 17 11.433 -16.040 -9.777 1.00 0.00 H new ATOM 251 N CYS A 18 8.007 -15.978 -6.966 1.00 0.00 N ATOM 252 CA CYS A 18 7.062 -16.088 -5.860 1.00 0.00 C ATOM 253 C CYS A 18 5.952 -15.050 -5.989 1.00 0.00 C ATOM 254 O CYS A 18 4.840 -15.251 -5.500 1.00 0.00 O ATOM 255 CB CYS A 18 7.787 -15.914 -4.524 1.00 0.00 C ATOM 256 SG CYS A 18 9.284 -16.914 -4.361 1.00 0.00 S ATOM 0 H CYS A 18 8.908 -15.573 -6.712 1.00 0.00 H new ATOM 0 HA CYS A 18 6.613 -17.080 -5.895 1.00 0.00 H new ATOM 0 HB2 CYS A 18 8.049 -14.863 -4.399 1.00 0.00 H new ATOM 0 HB3 CYS A 18 7.102 -16.170 -3.715 1.00 0.00 H new ATOM 0 HG CYS A 18 9.827 -16.697 -3.200 1.00 0.00 H new ATOM 262 N LEU A 19 6.261 -13.940 -6.649 1.00 0.00 N ATOM 263 CA LEU A 19 5.290 -12.868 -6.842 1.00 0.00 C ATOM 264 C LEU A 19 4.227 -13.273 -7.858 1.00 0.00 C ATOM 265 O LEU A 19 3.039 -13.016 -7.664 1.00 0.00 O ATOM 266 CB LEU A 19 5.994 -11.592 -7.304 1.00 0.00 C ATOM 267 CG LEU A 19 6.823 -10.862 -6.247 1.00 0.00 C ATOM 268 CD1 LEU A 19 7.318 -9.528 -6.784 1.00 0.00 C ATOM 269 CD2 LEU A 19 6.008 -10.658 -4.978 1.00 0.00 C ATOM 0 H LEU A 19 7.177 -13.758 -7.060 1.00 0.00 H new ATOM 0 HA LEU A 19 4.800 -12.679 -5.887 1.00 0.00 H new ATOM 0 HB2 LEU A 19 6.648 -11.844 -8.139 1.00 0.00 H new ATOM 0 HB3 LEU A 19 5.240 -10.903 -7.685 1.00 0.00 H new ATOM 0 HG LEU A 19 7.690 -11.477 -6.004 1.00 0.00 H new ATOM 0 HD11 LEU A 19 7.906 -9.023 -6.018 1.00 0.00 H new ATOM 0 HD12 LEU A 19 7.938 -9.698 -7.664 1.00 0.00 H new ATOM 0 HD13 LEU A 19 6.465 -8.906 -7.056 1.00 0.00 H new ATOM 0 HD21 LEU A 19 6.614 -10.137 -4.236 1.00 0.00 H new ATOM 0 HD22 LEU A 19 5.123 -10.064 -5.206 1.00 0.00 H new ATOM 0 HD23 LEU A 19 5.703 -11.627 -4.582 1.00 0.00 H new ATOM 281 N ALA A 20 4.662 -13.910 -8.940 1.00 0.00 N ATOM 282 CA ALA A 20 3.748 -14.354 -9.985 1.00 0.00 C ATOM 283 C ALA A 20 2.730 -15.348 -9.437 1.00 0.00 C ATOM 284 O ALA A 20 1.544 -15.281 -9.762 1.00 0.00 O ATOM 285 CB ALA A 20 4.524 -14.972 -11.138 1.00 0.00 C ATOM 0 H ALA A 20 5.642 -14.130 -9.116 1.00 0.00 H new ATOM 0 HA ALA A 20 3.205 -13.483 -10.353 1.00 0.00 H new ATOM 0 HB1 ALA A 20 3.828 -15.299 -11.911 1.00 0.00 H new ATOM 0 HB2 ALA A 20 5.208 -14.232 -11.554 1.00 0.00 H new ATOM 0 HB3 ALA A 20 5.093 -15.828 -10.776 1.00 0.00 H new ATOM 291 N VAL A 21 3.200 -16.271 -8.603 1.00 0.00 N ATOM 292 CA VAL A 21 2.330 -17.279 -8.009 1.00 0.00 C ATOM 293 C VAL A 21 1.357 -16.650 -7.017 1.00 0.00 C ATOM 294 O VAL A 21 0.179 -17.002 -6.981 1.00 0.00 O ATOM 295 CB VAL A 21 3.145 -18.371 -7.291 1.00 0.00 C ATOM 296 CG1 VAL A 21 2.225 -19.457 -6.754 1.00 0.00 C ATOM 297 CG2 VAL A 21 4.188 -18.960 -8.229 1.00 0.00 C ATOM 0 H VAL A 21 4.179 -16.341 -8.324 1.00 0.00 H new ATOM 0 HA VAL A 21 1.768 -17.733 -8.825 1.00 0.00 H new ATOM 0 HB VAL A 21 3.664 -17.917 -6.447 1.00 0.00 H new ATOM 0 HG11 VAL A 21 2.818 -20.220 -6.250 1.00 0.00 H new ATOM 0 HG12 VAL A 21 1.520 -19.020 -6.047 1.00 0.00 H new ATOM 0 HG13 VAL A 21 1.677 -19.911 -7.580 1.00 0.00 H new ATOM 0 HG21 VAL A 21 4.755 -19.730 -7.705 1.00 0.00 H new ATOM 0 HG22 VAL A 21 3.692 -19.400 -9.094 1.00 0.00 H new ATOM 0 HG23 VAL A 21 4.865 -18.173 -8.560 1.00 0.00 H new ATOM 307 N MET A 22 1.860 -15.719 -6.214 1.00 0.00 N ATOM 308 CA MET A 22 1.035 -15.039 -5.222 1.00 0.00 C ATOM 309 C MET A 22 -0.112 -14.288 -5.891 1.00 0.00 C ATOM 310 O MET A 22 -1.247 -14.319 -5.415 1.00 0.00 O ATOM 311 CB MET A 22 1.884 -14.069 -4.399 1.00 0.00 C ATOM 312 CG MET A 22 2.612 -14.730 -3.240 1.00 0.00 C ATOM 313 SD MET A 22 2.948 -13.587 -1.887 1.00 0.00 S ATOM 314 CE MET A 22 4.338 -12.674 -2.553 1.00 0.00 C ATOM 0 H MET A 22 2.834 -15.418 -6.230 1.00 0.00 H new ATOM 0 HA MET A 22 0.613 -15.794 -4.558 1.00 0.00 H new ATOM 0 HB2 MET A 22 2.615 -13.594 -5.053 1.00 0.00 H new ATOM 0 HB3 MET A 22 1.243 -13.278 -4.011 1.00 0.00 H new ATOM 0 HG2 MET A 22 2.014 -15.562 -2.868 1.00 0.00 H new ATOM 0 HG3 MET A 22 3.552 -15.149 -3.598 1.00 0.00 H new ATOM 0 HE1 MET A 22 4.839 -12.136 -1.748 1.00 0.00 H new ATOM 0 HE2 MET A 22 5.039 -13.367 -3.018 1.00 0.00 H new ATOM 0 HE3 MET A 22 3.983 -11.963 -3.299 1.00 0.00 H new ATOM 324 N GLU A 23 0.192 -13.615 -6.996 1.00 0.00 N ATOM 325 CA GLU A 23 -0.814 -12.855 -7.729 1.00 0.00 C ATOM 326 C GLU A 23 -1.898 -13.778 -8.280 1.00 0.00 C ATOM 327 O GLU A 23 -3.078 -13.429 -8.294 1.00 0.00 O ATOM 328 CB GLU A 23 -0.164 -12.074 -8.872 1.00 0.00 C ATOM 329 CG GLU A 23 0.338 -10.700 -8.462 1.00 0.00 C ATOM 330 CD GLU A 23 1.410 -10.169 -9.393 1.00 0.00 C ATOM 331 OE1 GLU A 23 1.087 -9.869 -10.562 1.00 0.00 O ATOM 332 OE2 GLU A 23 2.573 -10.053 -8.953 1.00 0.00 O ATOM 0 H GLU A 23 1.126 -13.580 -7.403 1.00 0.00 H new ATOM 0 HA GLU A 23 -1.277 -12.152 -7.037 1.00 0.00 H new ATOM 0 HB2 GLU A 23 0.670 -12.653 -9.268 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -0.886 -11.961 -9.681 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -0.499 -10.002 -8.443 1.00 0.00 H new ATOM 0 HG3 GLU A 23 0.735 -10.750 -7.448 1.00 0.00 H new ATOM 339 N SER A 24 -1.487 -14.958 -8.734 1.00 0.00 N ATOM 340 CA SER A 24 -2.420 -15.930 -9.291 1.00 0.00 C ATOM 341 C SER A 24 -3.479 -16.317 -8.263 1.00 0.00 C ATOM 342 O SER A 24 -4.678 -16.261 -8.539 1.00 0.00 O ATOM 343 CB SER A 24 -1.670 -17.178 -9.761 1.00 0.00 C ATOM 344 OG SER A 24 -2.439 -17.913 -10.697 1.00 0.00 O ATOM 0 H SER A 24 -0.514 -15.264 -8.727 1.00 0.00 H new ATOM 0 HA SER A 24 -2.918 -15.471 -10.145 1.00 0.00 H new ATOM 0 HB2 SER A 24 -0.722 -16.887 -10.213 1.00 0.00 H new ATOM 0 HB3 SER A 24 -1.434 -17.809 -8.904 1.00 0.00 H new ATOM 0 HG SER A 24 -1.937 -18.705 -10.983 1.00 0.00 H new ATOM 350 N TYR A 25 -3.028 -16.708 -7.076 1.00 0.00 N ATOM 351 CA TYR A 25 -3.935 -17.107 -6.007 1.00 0.00 C ATOM 352 C TYR A 25 -4.802 -15.933 -5.562 1.00 0.00 C ATOM 353 O TYR A 25 -5.967 -16.106 -5.203 1.00 0.00 O ATOM 354 CB TYR A 25 -3.145 -17.652 -4.816 1.00 0.00 C ATOM 355 CG TYR A 25 -2.741 -19.101 -4.970 1.00 0.00 C ATOM 356 CD1 TYR A 25 -1.803 -19.484 -5.921 1.00 0.00 C ATOM 357 CD2 TYR A 25 -3.297 -20.087 -4.165 1.00 0.00 C ATOM 358 CE1 TYR A 25 -1.432 -20.806 -6.066 1.00 0.00 C ATOM 359 CE2 TYR A 25 -2.931 -21.412 -4.302 1.00 0.00 C ATOM 360 CZ TYR A 25 -1.998 -21.767 -5.254 1.00 0.00 C ATOM 361 OH TYR A 25 -1.631 -23.085 -5.394 1.00 0.00 O ATOM 0 H TYR A 25 -2.039 -16.757 -6.830 1.00 0.00 H new ATOM 0 HA TYR A 25 -4.587 -17.892 -6.392 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -2.249 -17.047 -4.677 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -3.745 -17.545 -3.913 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -1.356 -18.735 -6.558 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -4.028 -19.813 -3.419 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -0.702 -21.086 -6.811 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -3.373 -22.166 -3.667 1.00 0.00 H new ATOM 0 HH TYR A 25 -2.122 -23.632 -4.745 1.00 0.00 H new ATOM 371 N PHE A 26 -4.224 -14.736 -5.589 1.00 0.00 N ATOM 372 CA PHE A 26 -4.942 -13.532 -5.188 1.00 0.00 C ATOM 373 C PHE A 26 -6.085 -13.233 -6.154 1.00 0.00 C ATOM 374 O PHE A 26 -7.135 -12.731 -5.754 1.00 0.00 O ATOM 375 CB PHE A 26 -3.986 -12.339 -5.127 1.00 0.00 C ATOM 376 CG PHE A 26 -4.583 -11.124 -4.475 1.00 0.00 C ATOM 377 CD1 PHE A 26 -5.301 -10.204 -5.221 1.00 0.00 C ATOM 378 CD2 PHE A 26 -4.425 -10.903 -3.117 1.00 0.00 C ATOM 379 CE1 PHE A 26 -5.853 -9.086 -4.625 1.00 0.00 C ATOM 380 CE2 PHE A 26 -4.974 -9.786 -2.514 1.00 0.00 C ATOM 381 CZ PHE A 26 -5.688 -8.876 -3.270 1.00 0.00 C ATOM 0 H PHE A 26 -3.261 -14.574 -5.884 1.00 0.00 H new ATOM 0 HA PHE A 26 -5.362 -13.703 -4.197 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -3.089 -12.630 -4.581 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -3.674 -12.082 -6.139 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -5.431 -10.362 -6.281 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -3.867 -11.611 -2.522 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -6.413 -8.378 -5.218 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -4.845 -9.625 -1.454 1.00 0.00 H new ATOM 0 HZ PHE A 26 -6.116 -8.002 -2.802 1.00 0.00 H new ATOM 391 N ASN A 27 -5.871 -13.544 -7.428 1.00 0.00 N ATOM 392 CA ASN A 27 -6.882 -13.308 -8.453 1.00 0.00 C ATOM 393 C ASN A 27 -8.099 -14.201 -8.232 1.00 0.00 C ATOM 394 O ASN A 27 -9.234 -13.790 -8.470 1.00 0.00 O ATOM 395 CB ASN A 27 -6.297 -13.560 -9.844 1.00 0.00 C ATOM 396 CG ASN A 27 -5.631 -12.326 -10.423 1.00 0.00 C ATOM 397 OD1 ASN A 27 -6.298 -11.446 -10.968 1.00 0.00 O ATOM 398 ND2 ASN A 27 -4.310 -12.257 -10.307 1.00 0.00 N ATOM 0 H ASN A 27 -5.007 -13.960 -7.776 1.00 0.00 H new ATOM 0 HA ASN A 27 -7.199 -12.267 -8.383 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -5.570 -14.370 -9.788 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -7.090 -13.890 -10.515 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -3.807 -11.451 -10.678 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -3.798 -13.010 -9.847 1.00 0.00 H new ATOM 405 N GLU A 28 -7.853 -15.425 -7.774 1.00 0.00 N ATOM 406 CA GLU A 28 -8.930 -16.375 -7.521 1.00 0.00 C ATOM 407 C GLU A 28 -9.542 -16.150 -6.142 1.00 0.00 C ATOM 408 O GLU A 28 -10.740 -16.347 -5.943 1.00 0.00 O ATOM 409 CB GLU A 28 -8.409 -17.810 -7.631 1.00 0.00 C ATOM 410 CG GLU A 28 -7.559 -18.242 -6.448 1.00 0.00 C ATOM 411 CD GLU A 28 -7.468 -19.749 -6.315 1.00 0.00 C ATOM 412 OE1 GLU A 28 -6.782 -20.379 -7.147 1.00 0.00 O ATOM 413 OE2 GLU A 28 -8.082 -20.300 -5.377 1.00 0.00 O ATOM 0 H GLU A 28 -6.919 -15.781 -7.571 1.00 0.00 H new ATOM 0 HA GLU A 28 -9.703 -16.217 -8.273 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -9.257 -18.489 -7.726 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -7.821 -17.905 -8.544 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -6.556 -17.829 -6.556 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -7.978 -17.825 -5.532 1.00 0.00 H new ATOM 420 N ASN A 29 -8.710 -15.735 -5.192 1.00 0.00 N ATOM 421 CA ASN A 29 -9.168 -15.484 -3.830 1.00 0.00 C ATOM 422 C ASN A 29 -8.269 -14.468 -3.133 1.00 0.00 C ATOM 423 O ASN A 29 -7.060 -14.667 -3.024 1.00 0.00 O ATOM 424 CB ASN A 29 -9.199 -16.788 -3.031 1.00 0.00 C ATOM 425 CG ASN A 29 -9.772 -16.600 -1.639 1.00 0.00 C ATOM 426 OD1 ASN A 29 -10.228 -15.512 -1.286 1.00 0.00 O ATOM 427 ND2 ASN A 29 -9.750 -17.661 -0.842 1.00 0.00 N ATOM 0 H ASN A 29 -7.715 -15.565 -5.340 1.00 0.00 H new ATOM 0 HA ASN A 29 -10.177 -15.075 -3.882 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -9.793 -17.526 -3.569 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -8.188 -17.188 -2.954 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -10.121 -17.595 0.106 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -9.362 -18.543 -1.177 1.00 0.00 H new ATOM 434 N GLN A 30 -8.870 -13.380 -2.661 1.00 0.00 N ATOM 435 CA GLN A 30 -8.123 -12.333 -1.974 1.00 0.00 C ATOM 436 C GLN A 30 -7.510 -12.860 -0.681 1.00 0.00 C ATOM 437 O GLN A 30 -6.341 -12.610 -0.389 1.00 0.00 O ATOM 438 CB GLN A 30 -9.034 -11.142 -1.672 1.00 0.00 C ATOM 439 CG GLN A 30 -9.691 -10.549 -2.908 1.00 0.00 C ATOM 440 CD GLN A 30 -8.702 -9.836 -3.810 1.00 0.00 C ATOM 441 OE1 GLN A 30 -7.994 -10.467 -4.595 1.00 0.00 O ATOM 442 NE2 GLN A 30 -8.649 -8.514 -3.702 1.00 0.00 N ATOM 0 H GLN A 30 -9.871 -13.201 -2.742 1.00 0.00 H new ATOM 0 HA GLN A 30 -7.316 -12.007 -2.630 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -9.810 -11.457 -0.974 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -8.452 -10.367 -1.173 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -10.182 -11.343 -3.470 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -10.468 -9.848 -2.601 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -9.255 -8.032 -3.038 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -8.003 -7.980 -4.283 1.00 0.00 H new ATOM 451 N TYR A 31 -8.308 -13.591 0.091 1.00 0.00 N ATOM 452 CA TYR A 31 -7.845 -14.151 1.355 1.00 0.00 C ATOM 453 C TYR A 31 -7.754 -15.672 1.275 1.00 0.00 C ATOM 454 O TYR A 31 -8.731 -16.391 1.485 1.00 0.00 O ATOM 455 CB TYR A 31 -8.784 -13.745 2.491 1.00 0.00 C ATOM 456 CG TYR A 31 -9.242 -12.306 2.413 1.00 0.00 C ATOM 457 CD1 TYR A 31 -10.198 -11.909 1.487 1.00 0.00 C ATOM 458 CD2 TYR A 31 -8.718 -11.343 3.267 1.00 0.00 C ATOM 459 CE1 TYR A 31 -10.618 -10.595 1.412 1.00 0.00 C ATOM 460 CE2 TYR A 31 -9.133 -10.027 3.200 1.00 0.00 C ATOM 461 CZ TYR A 31 -10.083 -9.658 2.271 1.00 0.00 C ATOM 462 OH TYR A 31 -10.500 -8.348 2.200 1.00 0.00 O ATOM 0 H TYR A 31 -9.278 -13.809 -0.137 1.00 0.00 H new ATOM 0 HA TYR A 31 -6.850 -13.755 1.556 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -9.658 -14.397 2.479 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -8.279 -13.906 3.444 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -10.620 -12.640 0.814 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -7.974 -11.628 3.996 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -11.361 -10.303 0.685 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -8.716 -9.291 3.872 1.00 0.00 H new ATOM 0 HH TYR A 31 -10.027 -7.817 2.874 1.00 0.00 H new ATOM 472 N PRO A 32 -6.550 -16.176 0.965 1.00 0.00 N ATOM 473 CA PRO A 32 -6.300 -17.616 0.851 1.00 0.00 C ATOM 474 C PRO A 32 -6.356 -18.323 2.201 1.00 0.00 C ATOM 475 O PRO A 32 -5.627 -17.970 3.128 1.00 0.00 O ATOM 476 CB PRO A 32 -4.885 -17.685 0.270 1.00 0.00 C ATOM 477 CG PRO A 32 -4.243 -16.407 0.683 1.00 0.00 C ATOM 478 CD PRO A 32 -5.340 -15.379 0.701 1.00 0.00 C ATOM 0 HA PRO A 32 -7.052 -18.113 0.239 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -4.339 -18.545 0.658 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -4.907 -17.784 -0.815 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -3.781 -16.502 1.666 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -3.454 -16.124 -0.014 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -5.176 -14.629 1.475 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -5.408 -14.847 -0.248 1.00 0.00 H new ATOM 486 N ASP A 33 -7.226 -19.321 2.305 1.00 0.00 N ATOM 487 CA ASP A 33 -7.376 -20.079 3.542 1.00 0.00 C ATOM 488 C ASP A 33 -6.028 -20.609 4.022 1.00 0.00 C ATOM 489 O ASP A 33 -5.010 -20.439 3.352 1.00 0.00 O ATOM 490 CB ASP A 33 -8.352 -21.239 3.339 1.00 0.00 C ATOM 491 CG ASP A 33 -8.284 -21.814 1.938 1.00 0.00 C ATOM 492 OD1 ASP A 33 -8.666 -21.103 0.985 1.00 0.00 O ATOM 493 OD2 ASP A 33 -7.848 -22.975 1.794 1.00 0.00 O ATOM 0 H ASP A 33 -7.838 -19.624 1.548 1.00 0.00 H new ATOM 0 HA ASP A 33 -7.774 -19.409 4.304 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -8.133 -22.025 4.062 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -9.367 -20.895 3.539 1.00 0.00 H new ATOM 498 N GLU A 34 -6.031 -21.251 5.186 1.00 0.00 N ATOM 499 CA GLU A 34 -4.808 -21.804 5.755 1.00 0.00 C ATOM 500 C GLU A 34 -4.133 -22.756 4.773 1.00 0.00 C ATOM 501 O GLU A 34 -2.948 -22.617 4.472 1.00 0.00 O ATOM 502 CB GLU A 34 -5.113 -22.535 7.064 1.00 0.00 C ATOM 503 CG GLU A 34 -6.521 -23.102 7.130 1.00 0.00 C ATOM 504 CD GLU A 34 -6.636 -24.269 8.092 1.00 0.00 C ATOM 505 OE1 GLU A 34 -6.438 -25.421 7.652 1.00 0.00 O ATOM 506 OE2 GLU A 34 -6.924 -24.031 9.283 1.00 0.00 O ATOM 0 H GLU A 34 -6.866 -21.401 5.753 1.00 0.00 H new ATOM 0 HA GLU A 34 -4.127 -20.978 5.959 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -4.397 -23.347 7.192 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -4.968 -21.847 7.897 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -7.211 -22.315 7.435 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -6.825 -23.425 6.135 1.00 0.00 H new ATOM 513 N ALA A 35 -4.896 -23.725 4.278 1.00 0.00 N ATOM 514 CA ALA A 35 -4.373 -24.700 3.329 1.00 0.00 C ATOM 515 C ALA A 35 -3.977 -24.032 2.016 1.00 0.00 C ATOM 516 O ALA A 35 -2.979 -24.399 1.396 1.00 0.00 O ATOM 517 CB ALA A 35 -5.400 -25.795 3.077 1.00 0.00 C ATOM 0 H ALA A 35 -5.879 -23.856 4.519 1.00 0.00 H new ATOM 0 HA ALA A 35 -3.479 -25.148 3.763 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -4.996 -26.516 2.366 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -5.631 -26.300 4.015 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -6.309 -25.354 2.669 1.00 0.00 H new ATOM 523 N LYS A 36 -4.766 -23.048 1.598 1.00 0.00 N ATOM 524 CA LYS A 36 -4.499 -22.327 0.359 1.00 0.00 C ATOM 525 C LYS A 36 -3.162 -21.596 0.432 1.00 0.00 C ATOM 526 O LYS A 36 -2.406 -21.567 -0.539 1.00 0.00 O ATOM 527 CB LYS A 36 -5.623 -21.328 0.073 1.00 0.00 C ATOM 528 CG LYS A 36 -5.538 -20.695 -1.305 1.00 0.00 C ATOM 529 CD LYS A 36 -5.864 -21.698 -2.400 1.00 0.00 C ATOM 530 CE LYS A 36 -7.357 -21.746 -2.685 1.00 0.00 C ATOM 531 NZ LYS A 36 -7.729 -22.939 -3.496 1.00 0.00 N ATOM 0 H LYS A 36 -5.596 -22.731 2.099 1.00 0.00 H new ATOM 0 HA LYS A 36 -4.452 -23.054 -0.452 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -6.583 -21.835 0.172 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -5.599 -20.541 0.827 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -6.229 -19.854 -1.363 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -4.536 -20.296 -1.462 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -5.327 -21.432 -3.310 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -5.517 -22.688 -2.103 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -7.906 -21.761 -1.744 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -7.655 -20.840 -3.213 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -8.755 -22.935 -3.669 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -7.225 -22.912 -4.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -7.468 -23.804 -2.981 1.00 0.00 H new ATOM 545 N ARG A 37 -2.876 -21.009 1.590 1.00 0.00 N ATOM 546 CA ARG A 37 -1.630 -20.279 1.789 1.00 0.00 C ATOM 547 C ARG A 37 -0.428 -21.209 1.652 1.00 0.00 C ATOM 548 O ARG A 37 0.590 -20.839 1.068 1.00 0.00 O ATOM 549 CB ARG A 37 -1.619 -19.614 3.167 1.00 0.00 C ATOM 550 CG ARG A 37 -2.380 -18.299 3.214 1.00 0.00 C ATOM 551 CD ARG A 37 -1.927 -17.434 4.380 1.00 0.00 C ATOM 552 NE ARG A 37 -2.705 -17.694 5.588 1.00 0.00 N ATOM 553 CZ ARG A 37 -3.914 -17.189 5.807 1.00 0.00 C ATOM 554 NH1 ARG A 37 -4.480 -16.402 4.903 1.00 0.00 N ATOM 555 NH2 ARG A 37 -4.559 -17.472 6.931 1.00 0.00 N ATOM 0 H ARG A 37 -3.490 -21.025 2.404 1.00 0.00 H new ATOM 0 HA ARG A 37 -1.562 -19.509 1.021 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -2.051 -20.300 3.896 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -0.586 -19.438 3.468 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -2.232 -17.758 2.279 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -3.448 -18.498 3.301 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -0.872 -17.620 4.581 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -2.019 -16.382 4.109 1.00 0.00 H new ATOM 0 HE ARG A 37 -2.298 -18.297 6.303 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -3.987 -16.183 4.037 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -5.408 -16.015 5.073 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -4.127 -18.078 7.628 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -5.487 -17.084 7.098 1.00 0.00 H new ATOM 569 N GLU A 38 -0.554 -22.416 2.195 1.00 0.00 N ATOM 570 CA GLU A 38 0.523 -23.397 2.134 1.00 0.00 C ATOM 571 C GLU A 38 0.717 -23.904 0.708 1.00 0.00 C ATOM 572 O GLU A 38 1.845 -24.090 0.253 1.00 0.00 O ATOM 573 CB GLU A 38 0.227 -24.571 3.069 1.00 0.00 C ATOM 574 CG GLU A 38 0.572 -24.294 4.522 1.00 0.00 C ATOM 575 CD GLU A 38 -0.086 -25.274 5.475 1.00 0.00 C ATOM 576 OE1 GLU A 38 0.009 -26.494 5.228 1.00 0.00 O ATOM 577 OE2 GLU A 38 -0.694 -24.820 6.466 1.00 0.00 O ATOM 0 H GLU A 38 -1.391 -22.738 2.682 1.00 0.00 H new ATOM 0 HA GLU A 38 1.443 -22.909 2.456 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -0.831 -24.824 2.997 1.00 0.00 H new ATOM 0 HB3 GLU A 38 0.787 -25.443 2.731 1.00 0.00 H new ATOM 0 HG2 GLU A 38 1.654 -24.339 4.650 1.00 0.00 H new ATOM 0 HG3 GLU A 38 0.263 -23.281 4.778 1.00 0.00 H new ATOM 584 N GLU A 39 -0.392 -24.125 0.009 1.00 0.00 N ATOM 585 CA GLU A 39 -0.344 -24.612 -1.365 1.00 0.00 C ATOM 586 C GLU A 39 0.363 -23.611 -2.273 1.00 0.00 C ATOM 587 O GLU A 39 1.215 -23.983 -3.080 1.00 0.00 O ATOM 588 CB GLU A 39 -1.759 -24.878 -1.885 1.00 0.00 C ATOM 589 CG GLU A 39 -1.805 -25.846 -3.055 1.00 0.00 C ATOM 590 CD GLU A 39 -1.485 -27.271 -2.647 1.00 0.00 C ATOM 591 OE1 GLU A 39 -1.727 -27.620 -1.473 1.00 0.00 O ATOM 592 OE2 GLU A 39 -0.993 -28.036 -3.503 1.00 0.00 O ATOM 0 H GLU A 39 -1.334 -23.975 0.371 1.00 0.00 H new ATOM 0 HA GLU A 39 0.220 -25.545 -1.373 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -2.367 -25.275 -1.072 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -2.209 -23.933 -2.188 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -2.796 -25.816 -3.508 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -1.096 -25.523 -3.817 1.00 0.00 H new ATOM 599 N ILE A 40 0.004 -22.339 -2.134 1.00 0.00 N ATOM 600 CA ILE A 40 0.605 -21.284 -2.941 1.00 0.00 C ATOM 601 C ILE A 40 2.047 -21.025 -2.521 1.00 0.00 C ATOM 602 O ILE A 40 2.918 -20.799 -3.361 1.00 0.00 O ATOM 603 CB ILE A 40 -0.193 -19.971 -2.835 1.00 0.00 C ATOM 604 CG1 ILE A 40 0.233 -18.999 -3.937 1.00 0.00 C ATOM 605 CG2 ILE A 40 0.001 -19.343 -1.463 1.00 0.00 C ATOM 606 CD1 ILE A 40 1.400 -18.118 -3.548 1.00 0.00 C ATOM 0 H ILE A 40 -0.699 -22.014 -1.471 1.00 0.00 H new ATOM 0 HA ILE A 40 0.587 -21.628 -3.975 1.00 0.00 H new ATOM 0 HB ILE A 40 -1.252 -20.195 -2.964 1.00 0.00 H new ATOM 0 HG12 ILE A 40 0.498 -19.567 -4.829 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -0.616 -18.368 -4.202 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -0.569 -18.416 -1.403 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -0.347 -20.033 -0.694 1.00 0.00 H new ATOM 0 HG23 ILE A 40 1.058 -19.129 -1.307 1.00 0.00 H new ATOM 0 HD11 ILE A 40 1.647 -17.455 -4.377 1.00 0.00 H new ATOM 0 HD12 ILE A 40 1.132 -17.523 -2.675 1.00 0.00 H new ATOM 0 HD13 ILE A 40 2.263 -18.741 -3.312 1.00 0.00 H new ATOM 618 N ALA A 41 2.293 -21.060 -1.216 1.00 0.00 N ATOM 619 CA ALA A 41 3.631 -20.833 -0.684 1.00 0.00 C ATOM 620 C ALA A 41 4.598 -21.917 -1.149 1.00 0.00 C ATOM 621 O ALA A 41 5.733 -21.628 -1.528 1.00 0.00 O ATOM 622 CB ALA A 41 3.593 -20.775 0.836 1.00 0.00 C ATOM 0 H ALA A 41 1.583 -21.243 -0.507 1.00 0.00 H new ATOM 0 HA ALA A 41 3.988 -19.876 -1.064 1.00 0.00 H new ATOM 0 HB1 ALA A 41 4.599 -20.605 1.219 1.00 0.00 H new ATOM 0 HB2 ALA A 41 2.942 -19.960 1.153 1.00 0.00 H new ATOM 0 HB3 ALA A 41 3.211 -21.718 1.227 1.00 0.00 H new ATOM 628 N ASN A 42 4.142 -23.164 -1.117 1.00 0.00 N ATOM 629 CA ASN A 42 4.968 -24.292 -1.534 1.00 0.00 C ATOM 630 C ASN A 42 5.433 -24.120 -2.977 1.00 0.00 C ATOM 631 O ASN A 42 6.584 -24.402 -3.306 1.00 0.00 O ATOM 632 CB ASN A 42 4.190 -25.601 -1.389 1.00 0.00 C ATOM 633 CG ASN A 42 4.328 -26.206 -0.005 1.00 0.00 C ATOM 634 OD1 ASN A 42 4.740 -27.356 0.144 1.00 0.00 O ATOM 635 ND2 ASN A 42 3.984 -25.430 1.016 1.00 0.00 N ATOM 0 H ASN A 42 3.205 -23.420 -0.807 1.00 0.00 H new ATOM 0 HA ASN A 42 5.846 -24.326 -0.889 1.00 0.00 H new ATOM 0 HB2 ASN A 42 3.136 -25.419 -1.600 1.00 0.00 H new ATOM 0 HB3 ASN A 42 4.545 -26.315 -2.132 1.00 0.00 H new ATOM 0 HD21 ASN A 42 4.056 -25.781 1.971 1.00 0.00 H new ATOM 0 HD22 ASN A 42 3.647 -24.482 0.846 1.00 0.00 H new ATOM 642 N ALA A 43 4.529 -23.656 -3.833 1.00 0.00 N ATOM 643 CA ALA A 43 4.846 -23.444 -5.240 1.00 0.00 C ATOM 644 C ALA A 43 5.944 -22.398 -5.404 1.00 0.00 C ATOM 645 O ALA A 43 6.820 -22.533 -6.259 1.00 0.00 O ATOM 646 CB ALA A 43 3.600 -23.027 -6.006 1.00 0.00 C ATOM 0 H ALA A 43 3.570 -23.420 -3.577 1.00 0.00 H new ATOM 0 HA ALA A 43 5.212 -24.386 -5.649 1.00 0.00 H new ATOM 0 HB1 ALA A 43 3.853 -22.872 -7.055 1.00 0.00 H new ATOM 0 HB2 ALA A 43 2.845 -23.809 -5.926 1.00 0.00 H new ATOM 0 HB3 ALA A 43 3.208 -22.100 -5.587 1.00 0.00 H new ATOM 652 N CYS A 44 5.890 -21.358 -4.580 1.00 0.00 N ATOM 653 CA CYS A 44 6.880 -20.287 -4.634 1.00 0.00 C ATOM 654 C CYS A 44 8.271 -20.816 -4.299 1.00 0.00 C ATOM 655 O CYS A 44 9.263 -20.407 -4.901 1.00 0.00 O ATOM 656 CB CYS A 44 6.501 -19.164 -3.668 1.00 0.00 C ATOM 657 SG CYS A 44 5.016 -18.250 -4.145 1.00 0.00 S ATOM 0 H CYS A 44 5.172 -21.233 -3.867 1.00 0.00 H new ATOM 0 HA CYS A 44 6.896 -19.891 -5.650 1.00 0.00 H new ATOM 0 HB2 CYS A 44 6.350 -19.589 -2.675 1.00 0.00 H new ATOM 0 HB3 CYS A 44 7.335 -18.467 -3.593 1.00 0.00 H new ATOM 0 HG CYS A 44 4.776 -17.323 -3.266 1.00 0.00 H new ATOM 663 N ASN A 45 8.336 -21.726 -3.333 1.00 0.00 N ATOM 664 CA ASN A 45 9.606 -22.308 -2.915 1.00 0.00 C ATOM 665 C ASN A 45 10.188 -23.190 -4.016 1.00 0.00 C ATOM 666 O ASN A 45 11.404 -23.264 -4.188 1.00 0.00 O ATOM 667 CB ASN A 45 9.419 -23.127 -1.637 1.00 0.00 C ATOM 668 CG ASN A 45 9.423 -22.263 -0.391 1.00 0.00 C ATOM 669 OD1 ASN A 45 10.439 -21.662 -0.041 1.00 0.00 O ATOM 670 ND2 ASN A 45 8.283 -22.196 0.287 1.00 0.00 N ATOM 0 H ASN A 45 7.524 -22.076 -2.825 1.00 0.00 H new ATOM 0 HA ASN A 45 10.303 -21.494 -2.718 1.00 0.00 H new ATOM 0 HB2 ASN A 45 8.478 -23.674 -1.694 1.00 0.00 H new ATOM 0 HB3 ASN A 45 10.215 -23.869 -1.564 1.00 0.00 H new ATOM 0 HD21 ASN A 45 8.226 -21.630 1.134 1.00 0.00 H new ATOM 0 HD22 ASN A 45 7.465 -22.710 -0.039 1.00 0.00 H new ATOM 677 N ALA A 46 9.310 -23.855 -4.760 1.00 0.00 N ATOM 678 CA ALA A 46 9.737 -24.729 -5.846 1.00 0.00 C ATOM 679 C ALA A 46 10.273 -23.920 -7.023 1.00 0.00 C ATOM 680 O ALA A 46 11.344 -24.215 -7.555 1.00 0.00 O ATOM 681 CB ALA A 46 8.584 -25.615 -6.295 1.00 0.00 C ATOM 0 H ALA A 46 8.299 -23.805 -4.631 1.00 0.00 H new ATOM 0 HA ALA A 46 10.544 -25.361 -5.475 1.00 0.00 H new ATOM 0 HB1 ALA A 46 8.917 -26.262 -7.106 1.00 0.00 H new ATOM 0 HB2 ALA A 46 8.248 -26.226 -5.458 1.00 0.00 H new ATOM 0 HB3 ALA A 46 7.760 -24.992 -6.643 1.00 0.00 H new ATOM 687 N VAL A 47 9.522 -22.900 -7.425 1.00 0.00 N ATOM 688 CA VAL A 47 9.923 -22.048 -8.539 1.00 0.00 C ATOM 689 C VAL A 47 11.282 -21.408 -8.280 1.00 0.00 C ATOM 690 O VAL A 47 11.959 -20.968 -9.209 1.00 0.00 O ATOM 691 CB VAL A 47 8.886 -20.940 -8.799 1.00 0.00 C ATOM 692 CG1 VAL A 47 7.619 -21.524 -9.405 1.00 0.00 C ATOM 693 CG2 VAL A 47 8.575 -20.189 -7.513 1.00 0.00 C ATOM 0 H VAL A 47 8.633 -22.643 -6.996 1.00 0.00 H new ATOM 0 HA VAL A 47 9.988 -22.687 -9.419 1.00 0.00 H new ATOM 0 HB VAL A 47 9.308 -20.233 -9.513 1.00 0.00 H new ATOM 0 HG11 VAL A 47 6.898 -20.725 -9.581 1.00 0.00 H new ATOM 0 HG12 VAL A 47 7.859 -22.012 -10.350 1.00 0.00 H new ATOM 0 HG13 VAL A 47 7.190 -22.254 -8.719 1.00 0.00 H new ATOM 0 HG21 VAL A 47 7.840 -19.410 -7.715 1.00 0.00 H new ATOM 0 HG22 VAL A 47 8.174 -20.883 -6.774 1.00 0.00 H new ATOM 0 HG23 VAL A 47 9.488 -19.736 -7.127 1.00 0.00 H new ATOM 703 N ILE A 48 11.675 -21.359 -7.012 1.00 0.00 N ATOM 704 CA ILE A 48 12.954 -20.773 -6.630 1.00 0.00 C ATOM 705 C ILE A 48 13.977 -21.855 -6.302 1.00 0.00 C ATOM 706 O ILE A 48 15.183 -21.636 -6.414 1.00 0.00 O ATOM 707 CB ILE A 48 12.805 -19.837 -5.417 1.00 0.00 C ATOM 708 CG1 ILE A 48 12.346 -20.627 -4.189 1.00 0.00 C ATOM 709 CG2 ILE A 48 11.824 -18.717 -5.729 1.00 0.00 C ATOM 710 CD1 ILE A 48 12.401 -19.831 -2.904 1.00 0.00 C ATOM 0 H ILE A 48 11.126 -21.718 -6.231 1.00 0.00 H new ATOM 0 HA ILE A 48 13.303 -20.193 -7.484 1.00 0.00 H new ATOM 0 HB ILE A 48 13.776 -19.393 -5.199 1.00 0.00 H new ATOM 0 HG12 ILE A 48 11.325 -20.972 -4.350 1.00 0.00 H new ATOM 0 HG13 ILE A 48 12.970 -21.515 -4.084 1.00 0.00 H new ATOM 0 HG21 ILE A 48 11.730 -18.064 -4.861 1.00 0.00 H new ATOM 0 HG22 ILE A 48 12.188 -18.141 -6.579 1.00 0.00 H new ATOM 0 HG23 ILE A 48 10.850 -19.143 -5.970 1.00 0.00 H new ATOM 0 HD11 ILE A 48 12.062 -20.453 -2.076 1.00 0.00 H new ATOM 0 HD12 ILE A 48 13.426 -19.508 -2.720 1.00 0.00 H new ATOM 0 HD13 ILE A 48 11.755 -18.957 -2.989 1.00 0.00 H new ATOM 722 N GLN A 49 13.487 -23.022 -5.897 1.00 0.00 N ATOM 723 CA GLN A 49 14.360 -24.139 -5.554 1.00 0.00 C ATOM 724 C GLN A 49 15.184 -24.577 -6.760 1.00 0.00 C ATOM 725 O GLN A 49 14.637 -24.975 -7.788 1.00 0.00 O ATOM 726 CB GLN A 49 13.535 -25.316 -5.030 1.00 0.00 C ATOM 727 CG GLN A 49 14.371 -26.390 -4.352 1.00 0.00 C ATOM 728 CD GLN A 49 15.753 -26.524 -4.959 1.00 0.00 C ATOM 729 OE1 GLN A 49 15.912 -27.052 -6.060 1.00 0.00 O ATOM 730 NE2 GLN A 49 16.764 -26.045 -4.243 1.00 0.00 N ATOM 0 H GLN A 49 12.491 -23.219 -5.798 1.00 0.00 H new ATOM 0 HA GLN A 49 15.043 -23.807 -4.772 1.00 0.00 H new ATOM 0 HB2 GLN A 49 12.794 -24.943 -4.323 1.00 0.00 H new ATOM 0 HB3 GLN A 49 12.987 -25.763 -5.860 1.00 0.00 H new ATOM 0 HG2 GLN A 49 14.465 -26.156 -3.292 1.00 0.00 H new ATOM 0 HG3 GLN A 49 13.853 -27.347 -4.423 1.00 0.00 H new ATOM 0 HE21 GLN A 49 16.587 -25.615 -3.335 1.00 0.00 H new ATOM 0 HE22 GLN A 49 17.717 -26.107 -4.601 1.00 0.00 H new ATOM 739 N LYS A 50 16.504 -24.500 -6.627 1.00 0.00 N ATOM 740 CA LYS A 50 17.406 -24.889 -7.705 1.00 0.00 C ATOM 741 C LYS A 50 18.083 -26.220 -7.394 1.00 0.00 C ATOM 742 O LYS A 50 18.284 -26.586 -6.236 1.00 0.00 O ATOM 743 CB LYS A 50 18.464 -23.806 -7.929 1.00 0.00 C ATOM 744 CG LYS A 50 17.886 -22.407 -8.049 1.00 0.00 C ATOM 745 CD LYS A 50 17.424 -22.114 -9.466 1.00 0.00 C ATOM 746 CE LYS A 50 17.373 -20.619 -9.738 1.00 0.00 C ATOM 747 NZ LYS A 50 16.275 -19.955 -8.981 1.00 0.00 N ATOM 0 H LYS A 50 16.973 -24.172 -5.783 1.00 0.00 H new ATOM 0 HA LYS A 50 16.816 -25.005 -8.614 1.00 0.00 H new ATOM 0 HB2 LYS A 50 19.174 -23.827 -7.102 1.00 0.00 H new ATOM 0 HB3 LYS A 50 19.023 -24.038 -8.835 1.00 0.00 H new ATOM 0 HG2 LYS A 50 17.047 -22.299 -7.362 1.00 0.00 H new ATOM 0 HG3 LYS A 50 18.637 -21.675 -7.752 1.00 0.00 H new ATOM 0 HD2 LYS A 50 18.100 -22.591 -10.176 1.00 0.00 H new ATOM 0 HD3 LYS A 50 16.437 -22.548 -9.625 1.00 0.00 H new ATOM 0 HE2 LYS A 50 18.327 -20.167 -9.465 1.00 0.00 H new ATOM 0 HE3 LYS A 50 17.233 -20.449 -10.805 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 16.627 -19.070 -8.563 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 15.487 -19.744 -9.626 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 15.943 -20.587 -8.224 1.00 0.00 H new ATOM 761 N PRO A 51 18.446 -26.962 -8.451 1.00 0.00 N ATOM 762 CA PRO A 51 19.108 -28.263 -8.316 1.00 0.00 C ATOM 763 C PRO A 51 20.535 -28.135 -7.792 1.00 0.00 C ATOM 764 O PRO A 51 21.325 -27.343 -8.303 1.00 0.00 O ATOM 765 CB PRO A 51 19.110 -28.810 -9.745 1.00 0.00 C ATOM 766 CG PRO A 51 19.053 -27.601 -10.614 1.00 0.00 C ATOM 767 CD PRO A 51 18.238 -26.587 -9.860 1.00 0.00 C ATOM 0 HA PRO A 51 18.599 -28.907 -7.599 1.00 0.00 H new ATOM 0 HB2 PRO A 51 20.007 -29.398 -9.943 1.00 0.00 H new ATOM 0 HB3 PRO A 51 18.255 -29.464 -9.920 1.00 0.00 H new ATOM 0 HG2 PRO A 51 20.054 -27.222 -10.821 1.00 0.00 H new ATOM 0 HG3 PRO A 51 18.595 -27.833 -11.576 1.00 0.00 H new ATOM 0 HD2 PRO A 51 18.577 -25.570 -10.060 1.00 0.00 H new ATOM 0 HD3 PRO A 51 17.185 -26.632 -10.137 1.00 0.00 H new ATOM 775 N GLY A 52 20.857 -28.921 -6.769 1.00 0.00 N ATOM 776 CA GLY A 52 22.189 -28.881 -6.194 1.00 0.00 C ATOM 777 C GLY A 52 22.400 -27.671 -5.306 1.00 0.00 C ATOM 778 O GLY A 52 23.531 -27.347 -4.943 1.00 0.00 O ATOM 0 H GLY A 52 20.220 -29.584 -6.328 1.00 0.00 H new ATOM 0 HA2 GLY A 52 22.358 -29.788 -5.614 1.00 0.00 H new ATOM 0 HA3 GLY A 52 22.928 -28.873 -6.996 1.00 0.00 H new ATOM 782 N LYS A 53 21.309 -26.998 -4.956 1.00 0.00 N ATOM 783 CA LYS A 53 21.379 -25.815 -4.106 1.00 0.00 C ATOM 784 C LYS A 53 20.468 -25.965 -2.892 1.00 0.00 C ATOM 785 O LYS A 53 19.546 -26.781 -2.890 1.00 0.00 O ATOM 786 CB LYS A 53 20.988 -24.567 -4.900 1.00 0.00 C ATOM 787 CG LYS A 53 22.102 -24.034 -5.784 1.00 0.00 C ATOM 788 CD LYS A 53 22.199 -24.809 -7.087 1.00 0.00 C ATOM 789 CE LYS A 53 23.445 -24.428 -7.871 1.00 0.00 C ATOM 790 NZ LYS A 53 23.309 -23.090 -8.512 1.00 0.00 N ATOM 0 H LYS A 53 20.365 -27.252 -5.248 1.00 0.00 H new ATOM 0 HA LYS A 53 22.406 -25.708 -3.757 1.00 0.00 H new ATOM 0 HB2 LYS A 53 20.122 -24.798 -5.521 1.00 0.00 H new ATOM 0 HB3 LYS A 53 20.682 -23.785 -4.205 1.00 0.00 H new ATOM 0 HG2 LYS A 53 21.925 -22.980 -5.999 1.00 0.00 H new ATOM 0 HG3 LYS A 53 23.051 -24.095 -5.252 1.00 0.00 H new ATOM 0 HD2 LYS A 53 22.214 -25.878 -6.875 1.00 0.00 H new ATOM 0 HD3 LYS A 53 21.314 -24.616 -7.693 1.00 0.00 H new ATOM 0 HE2 LYS A 53 24.307 -24.425 -7.204 1.00 0.00 H new ATOM 0 HE3 LYS A 53 23.637 -25.180 -8.637 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 24.179 -22.866 -9.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 22.502 -23.100 -9.168 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 23.152 -22.369 -7.780 1.00 0.00 H new ATOM 804 N LYS A 54 20.730 -25.170 -1.859 1.00 0.00 N ATOM 805 CA LYS A 54 19.933 -25.211 -0.639 1.00 0.00 C ATOM 806 C LYS A 54 19.166 -23.907 -0.447 1.00 0.00 C ATOM 807 O LYS A 54 19.750 -22.823 -0.459 1.00 0.00 O ATOM 808 CB LYS A 54 20.831 -25.471 0.573 1.00 0.00 C ATOM 809 CG LYS A 54 20.097 -25.397 1.900 1.00 0.00 C ATOM 810 CD LYS A 54 21.059 -25.458 3.074 1.00 0.00 C ATOM 811 CE LYS A 54 20.332 -25.753 4.377 1.00 0.00 C ATOM 812 NZ LYS A 54 21.280 -25.990 5.500 1.00 0.00 N ATOM 0 H LYS A 54 21.489 -24.489 -1.843 1.00 0.00 H new ATOM 0 HA LYS A 54 19.214 -26.025 -0.731 1.00 0.00 H new ATOM 0 HB2 LYS A 54 21.286 -26.457 0.473 1.00 0.00 H new ATOM 0 HB3 LYS A 54 21.643 -24.744 0.576 1.00 0.00 H new ATOM 0 HG2 LYS A 54 19.522 -24.472 1.948 1.00 0.00 H new ATOM 0 HG3 LYS A 54 19.385 -26.219 1.969 1.00 0.00 H new ATOM 0 HD2 LYS A 54 21.808 -26.228 2.892 1.00 0.00 H new ATOM 0 HD3 LYS A 54 21.591 -24.510 3.159 1.00 0.00 H new ATOM 0 HE2 LYS A 54 19.677 -24.917 4.625 1.00 0.00 H new ATOM 0 HE3 LYS A 54 19.696 -26.629 4.248 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 20.745 -26.187 6.370 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 21.888 -26.803 5.275 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 21.870 -25.145 5.641 1.00 0.00 H new ATOM 826 N LEU A 55 17.854 -24.019 -0.268 1.00 0.00 N ATOM 827 CA LEU A 55 17.006 -22.848 -0.071 1.00 0.00 C ATOM 828 C LEU A 55 17.225 -22.244 1.313 1.00 0.00 C ATOM 829 O LEU A 55 17.356 -22.965 2.302 1.00 0.00 O ATOM 830 CB LEU A 55 15.534 -23.224 -0.249 1.00 0.00 C ATOM 831 CG LEU A 55 15.024 -23.274 -1.689 1.00 0.00 C ATOM 832 CD1 LEU A 55 13.518 -23.487 -1.715 1.00 0.00 C ATOM 833 CD2 LEU A 55 15.397 -21.999 -2.432 1.00 0.00 C ATOM 0 H LEU A 55 17.355 -24.908 -0.255 1.00 0.00 H new ATOM 0 HA LEU A 55 17.277 -22.103 -0.819 1.00 0.00 H new ATOM 0 HB2 LEU A 55 15.371 -24.201 0.207 1.00 0.00 H new ATOM 0 HB3 LEU A 55 14.927 -22.508 0.306 1.00 0.00 H new ATOM 0 HG LEU A 55 15.498 -24.116 -2.193 1.00 0.00 H new ATOM 0 HD11 LEU A 55 13.173 -23.520 -2.748 1.00 0.00 H new ATOM 0 HD12 LEU A 55 13.275 -24.428 -1.221 1.00 0.00 H new ATOM 0 HD13 LEU A 55 13.025 -22.666 -1.194 1.00 0.00 H new ATOM 0 HD21 LEU A 55 15.026 -22.052 -3.455 1.00 0.00 H new ATOM 0 HD22 LEU A 55 14.951 -21.141 -1.929 1.00 0.00 H new ATOM 0 HD23 LEU A 55 16.481 -21.889 -2.445 1.00 0.00 H new ATOM 845 N SER A 56 17.261 -20.917 1.374 1.00 0.00 N ATOM 846 CA SER A 56 17.465 -20.215 2.636 1.00 0.00 C ATOM 847 C SER A 56 16.177 -19.541 3.098 1.00 0.00 C ATOM 848 O SER A 56 15.273 -19.292 2.300 1.00 0.00 O ATOM 849 CB SER A 56 18.576 -19.173 2.491 1.00 0.00 C ATOM 850 OG SER A 56 19.837 -19.721 2.835 1.00 0.00 O ATOM 0 H SER A 56 17.152 -20.306 0.564 1.00 0.00 H new ATOM 0 HA SER A 56 17.760 -20.948 3.387 1.00 0.00 H new ATOM 0 HB2 SER A 56 18.603 -18.806 1.465 1.00 0.00 H new ATOM 0 HB3 SER A 56 18.361 -18.317 3.130 1.00 0.00 H new ATOM 0 HG SER A 56 20.530 -19.036 2.732 1.00 0.00 H new ATOM 856 N ASP A 57 16.100 -19.248 4.391 1.00 0.00 N ATOM 857 CA ASP A 57 14.924 -18.602 4.961 1.00 0.00 C ATOM 858 C ASP A 57 14.651 -17.268 4.274 1.00 0.00 C ATOM 859 O ASP A 57 13.527 -16.764 4.297 1.00 0.00 O ATOM 860 CB ASP A 57 15.110 -18.388 6.464 1.00 0.00 C ATOM 861 CG ASP A 57 16.516 -17.940 6.814 1.00 0.00 C ATOM 862 OD1 ASP A 57 17.442 -18.773 6.725 1.00 0.00 O ATOM 863 OD2 ASP A 57 16.689 -16.758 7.179 1.00 0.00 O ATOM 0 H ASP A 57 16.839 -19.448 5.065 1.00 0.00 H new ATOM 0 HA ASP A 57 14.067 -19.256 4.799 1.00 0.00 H new ATOM 0 HB2 ASP A 57 14.396 -17.642 6.813 1.00 0.00 H new ATOM 0 HB3 ASP A 57 14.885 -19.315 6.991 1.00 0.00 H new ATOM 868 N LEU A 58 15.686 -16.699 3.665 1.00 0.00 N ATOM 869 CA LEU A 58 15.558 -15.422 2.972 1.00 0.00 C ATOM 870 C LEU A 58 14.756 -15.579 1.684 1.00 0.00 C ATOM 871 O LEU A 58 14.015 -14.678 1.290 1.00 0.00 O ATOM 872 CB LEU A 58 16.942 -14.850 2.657 1.00 0.00 C ATOM 873 CG LEU A 58 17.764 -14.383 3.859 1.00 0.00 C ATOM 874 CD1 LEU A 58 17.390 -12.959 4.240 1.00 0.00 C ATOM 875 CD2 LEU A 58 17.565 -15.323 5.039 1.00 0.00 C ATOM 0 H LEU A 58 16.623 -17.102 3.637 1.00 0.00 H new ATOM 0 HA LEU A 58 15.026 -14.733 3.628 1.00 0.00 H new ATOM 0 HB2 LEU A 58 17.514 -15.609 2.124 1.00 0.00 H new ATOM 0 HB3 LEU A 58 16.819 -14.007 1.977 1.00 0.00 H new ATOM 0 HG LEU A 58 18.818 -14.398 3.582 1.00 0.00 H new ATOM 0 HD11 LEU A 58 17.985 -12.644 5.097 1.00 0.00 H new ATOM 0 HD12 LEU A 58 17.585 -12.294 3.399 1.00 0.00 H new ATOM 0 HD13 LEU A 58 16.332 -12.917 4.498 1.00 0.00 H new ATOM 0 HD21 LEU A 58 18.157 -14.975 5.885 1.00 0.00 H new ATOM 0 HD22 LEU A 58 16.511 -15.340 5.317 1.00 0.00 H new ATOM 0 HD23 LEU A 58 17.884 -16.328 4.762 1.00 0.00 H new ATOM 887 N GLU A 59 14.907 -16.729 1.035 1.00 0.00 N ATOM 888 CA GLU A 59 14.194 -17.003 -0.207 1.00 0.00 C ATOM 889 C GLU A 59 13.038 -17.970 0.031 1.00 0.00 C ATOM 890 O GLU A 59 12.225 -18.214 -0.862 1.00 0.00 O ATOM 891 CB GLU A 59 15.150 -17.581 -1.253 1.00 0.00 C ATOM 892 CG GLU A 59 16.342 -16.687 -1.548 1.00 0.00 C ATOM 893 CD GLU A 59 16.000 -15.550 -2.491 1.00 0.00 C ATOM 894 OE1 GLU A 59 15.472 -14.523 -2.017 1.00 0.00 O ATOM 895 OE2 GLU A 59 16.259 -15.689 -3.705 1.00 0.00 O ATOM 0 H GLU A 59 15.516 -17.485 1.348 1.00 0.00 H new ATOM 0 HA GLU A 59 13.787 -16.062 -0.578 1.00 0.00 H new ATOM 0 HB2 GLU A 59 15.510 -18.550 -0.908 1.00 0.00 H new ATOM 0 HB3 GLU A 59 14.600 -17.756 -2.178 1.00 0.00 H new ATOM 0 HG2 GLU A 59 16.723 -16.276 -0.613 1.00 0.00 H new ATOM 0 HG3 GLU A 59 17.142 -17.286 -1.983 1.00 0.00 H new ATOM 902 N ARG A 60 12.971 -18.517 1.240 1.00 0.00 N ATOM 903 CA ARG A 60 11.917 -19.459 1.595 1.00 0.00 C ATOM 904 C ARG A 60 10.575 -18.745 1.733 1.00 0.00 C ATOM 905 O ARG A 60 10.483 -17.689 2.358 1.00 0.00 O ATOM 906 CB ARG A 60 12.262 -20.175 2.902 1.00 0.00 C ATOM 907 CG ARG A 60 11.664 -21.568 3.010 1.00 0.00 C ATOM 908 CD ARG A 60 12.464 -22.446 3.960 1.00 0.00 C ATOM 909 NE ARG A 60 12.363 -21.989 5.343 1.00 0.00 N ATOM 910 CZ ARG A 60 13.020 -22.550 6.352 1.00 0.00 C ATOM 911 NH1 ARG A 60 13.821 -23.583 6.133 1.00 0.00 N ATOM 912 NH2 ARG A 60 12.877 -22.077 7.584 1.00 0.00 N ATOM 0 H ARG A 60 13.634 -18.324 1.990 1.00 0.00 H new ATOM 0 HA ARG A 60 11.838 -20.196 0.795 1.00 0.00 H new ATOM 0 HB2 ARG A 60 13.346 -20.246 2.992 1.00 0.00 H new ATOM 0 HB3 ARG A 60 11.911 -19.572 3.740 1.00 0.00 H new ATOM 0 HG2 ARG A 60 10.634 -21.497 3.359 1.00 0.00 H new ATOM 0 HG3 ARG A 60 11.635 -22.030 2.023 1.00 0.00 H new ATOM 0 HD2 ARG A 60 12.107 -23.474 3.891 1.00 0.00 H new ATOM 0 HD3 ARG A 60 13.510 -22.450 3.655 1.00 0.00 H new ATOM 0 HE ARG A 60 11.755 -21.196 5.545 1.00 0.00 H new ATOM 0 HH11 ARG A 60 13.934 -23.949 5.188 1.00 0.00 H new ATOM 0 HH12 ARG A 60 14.324 -24.012 6.910 1.00 0.00 H new ATOM 0 HH21 ARG A 60 12.262 -21.282 7.757 1.00 0.00 H new ATOM 0 HH22 ARG A 60 13.382 -22.509 8.358 1.00 0.00 H new ATOM 926 N VAL A 61 9.536 -19.330 1.144 1.00 0.00 N ATOM 927 CA VAL A 61 8.199 -18.751 1.201 1.00 0.00 C ATOM 928 C VAL A 61 7.269 -19.601 2.058 1.00 0.00 C ATOM 929 O VAL A 61 6.759 -20.629 1.610 1.00 0.00 O ATOM 930 CB VAL A 61 7.591 -18.603 -0.206 1.00 0.00 C ATOM 931 CG1 VAL A 61 6.218 -17.954 -0.129 1.00 0.00 C ATOM 932 CG2 VAL A 61 8.520 -17.800 -1.106 1.00 0.00 C ATOM 0 H VAL A 61 9.595 -20.204 0.622 1.00 0.00 H new ATOM 0 HA VAL A 61 8.300 -17.763 1.650 1.00 0.00 H new ATOM 0 HB VAL A 61 7.473 -19.597 -0.638 1.00 0.00 H new ATOM 0 HG11 VAL A 61 5.804 -17.858 -1.133 1.00 0.00 H new ATOM 0 HG12 VAL A 61 5.557 -18.572 0.478 1.00 0.00 H new ATOM 0 HG13 VAL A 61 6.307 -16.966 0.323 1.00 0.00 H new ATOM 0 HG21 VAL A 61 8.075 -17.705 -2.096 1.00 0.00 H new ATOM 0 HG22 VAL A 61 8.672 -16.808 -0.680 1.00 0.00 H new ATOM 0 HG23 VAL A 61 9.479 -18.311 -1.187 1.00 0.00 H new ATOM 942 N THR A 62 7.049 -19.166 3.295 1.00 0.00 N ATOM 943 CA THR A 62 6.180 -19.887 4.216 1.00 0.00 C ATOM 944 C THR A 62 4.756 -19.344 4.167 1.00 0.00 C ATOM 945 O THR A 62 4.485 -18.344 3.503 1.00 0.00 O ATOM 946 CB THR A 62 6.700 -19.801 5.663 1.00 0.00 C ATOM 947 OG1 THR A 62 6.219 -18.604 6.287 1.00 0.00 O ATOM 948 CG2 THR A 62 8.221 -19.818 5.694 1.00 0.00 C ATOM 0 H THR A 62 7.461 -18.317 3.682 1.00 0.00 H new ATOM 0 HA THR A 62 6.180 -20.930 3.899 1.00 0.00 H new ATOM 0 HB THR A 62 6.331 -20.669 6.210 1.00 0.00 H new ATOM 0 HG1 THR A 62 6.553 -18.558 7.207 1.00 0.00 H new ATOM 0 HG21 THR A 62 8.565 -19.756 6.727 1.00 0.00 H new ATOM 0 HG22 THR A 62 8.584 -20.743 5.246 1.00 0.00 H new ATOM 0 HG23 THR A 62 8.606 -18.967 5.132 1.00 0.00 H new ATOM 956 N SER A 63 3.849 -20.010 4.875 1.00 0.00 N ATOM 957 CA SER A 63 2.451 -19.596 4.909 1.00 0.00 C ATOM 958 C SER A 63 2.317 -18.182 5.465 1.00 0.00 C ATOM 959 O SER A 63 1.484 -17.399 5.007 1.00 0.00 O ATOM 960 CB SER A 63 1.630 -20.570 5.757 1.00 0.00 C ATOM 961 OG SER A 63 1.847 -20.350 7.140 1.00 0.00 O ATOM 0 H SER A 63 4.057 -20.838 5.433 1.00 0.00 H new ATOM 0 HA SER A 63 2.070 -19.604 3.888 1.00 0.00 H new ATOM 0 HB2 SER A 63 0.571 -20.452 5.529 1.00 0.00 H new ATOM 0 HB3 SER A 63 1.899 -21.595 5.502 1.00 0.00 H new ATOM 0 HG SER A 63 1.310 -20.984 7.660 1.00 0.00 H new ATOM 967 N LEU A 64 3.143 -17.861 6.455 1.00 0.00 N ATOM 968 CA LEU A 64 3.118 -16.541 7.074 1.00 0.00 C ATOM 969 C LEU A 64 3.564 -15.467 6.087 1.00 0.00 C ATOM 970 O LEU A 64 2.967 -14.393 6.010 1.00 0.00 O ATOM 971 CB LEU A 64 4.019 -16.519 8.310 1.00 0.00 C ATOM 972 CG LEU A 64 4.080 -15.196 9.074 1.00 0.00 C ATOM 973 CD1 LEU A 64 2.679 -14.716 9.421 1.00 0.00 C ATOM 974 CD2 LEU A 64 4.922 -15.344 10.332 1.00 0.00 C ATOM 0 H LEU A 64 3.838 -18.497 6.846 1.00 0.00 H new ATOM 0 HA LEU A 64 2.092 -16.328 7.375 1.00 0.00 H new ATOM 0 HB2 LEU A 64 3.680 -17.296 8.995 1.00 0.00 H new ATOM 0 HB3 LEU A 64 5.030 -16.784 8.002 1.00 0.00 H new ATOM 0 HG LEU A 64 4.550 -14.450 8.433 1.00 0.00 H new ATOM 0 HD11 LEU A 64 2.742 -13.773 9.965 1.00 0.00 H new ATOM 0 HD12 LEU A 64 2.107 -14.569 8.505 1.00 0.00 H new ATOM 0 HD13 LEU A 64 2.183 -15.461 10.043 1.00 0.00 H new ATOM 0 HD21 LEU A 64 4.954 -14.392 10.863 1.00 0.00 H new ATOM 0 HD22 LEU A 64 4.482 -16.104 10.977 1.00 0.00 H new ATOM 0 HD23 LEU A 64 5.935 -15.641 10.059 1.00 0.00 H new ATOM 986 N LYS A 65 4.615 -15.766 5.331 1.00 0.00 N ATOM 987 CA LYS A 65 5.140 -14.828 4.345 1.00 0.00 C ATOM 988 C LYS A 65 4.090 -14.508 3.287 1.00 0.00 C ATOM 989 O LYS A 65 3.963 -13.364 2.851 1.00 0.00 O ATOM 990 CB LYS A 65 6.392 -15.405 3.680 1.00 0.00 C ATOM 991 CG LYS A 65 7.682 -15.046 4.397 1.00 0.00 C ATOM 992 CD LYS A 65 8.736 -16.127 4.222 1.00 0.00 C ATOM 993 CE LYS A 65 10.128 -15.604 4.540 1.00 0.00 C ATOM 994 NZ LYS A 65 11.019 -16.679 5.059 1.00 0.00 N ATOM 0 H LYS A 65 5.120 -16.651 5.382 1.00 0.00 H new ATOM 0 HA LYS A 65 5.403 -13.904 4.861 1.00 0.00 H new ATOM 0 HB2 LYS A 65 6.301 -16.490 3.634 1.00 0.00 H new ATOM 0 HB3 LYS A 65 6.445 -15.046 2.652 1.00 0.00 H new ATOM 0 HG2 LYS A 65 8.062 -14.100 4.012 1.00 0.00 H new ATOM 0 HG3 LYS A 65 7.481 -14.901 5.458 1.00 0.00 H new ATOM 0 HD2 LYS A 65 8.505 -16.970 4.873 1.00 0.00 H new ATOM 0 HD3 LYS A 65 8.711 -16.499 3.198 1.00 0.00 H new ATOM 0 HE2 LYS A 65 10.567 -15.170 3.642 1.00 0.00 H new ATOM 0 HE3 LYS A 65 10.056 -14.804 5.277 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 12.010 -16.371 4.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 10.783 -16.876 6.053 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 10.887 -17.542 4.494 1.00 0.00 H new ATOM 1008 N VAL A 66 3.339 -15.525 2.878 1.00 0.00 N ATOM 1009 CA VAL A 66 2.298 -15.351 1.872 1.00 0.00 C ATOM 1010 C VAL A 66 1.169 -14.471 2.396 1.00 0.00 C ATOM 1011 O VAL A 66 0.644 -13.621 1.676 1.00 0.00 O ATOM 1012 CB VAL A 66 1.714 -16.706 1.428 1.00 0.00 C ATOM 1013 CG1 VAL A 66 0.462 -16.499 0.590 1.00 0.00 C ATOM 1014 CG2 VAL A 66 2.754 -17.507 0.659 1.00 0.00 C ATOM 0 H VAL A 66 3.432 -16.479 3.228 1.00 0.00 H new ATOM 0 HA VAL A 66 2.765 -14.866 1.014 1.00 0.00 H new ATOM 0 HB VAL A 66 1.437 -17.272 2.317 1.00 0.00 H new ATOM 0 HG11 VAL A 66 0.064 -17.467 0.286 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -0.286 -15.968 1.178 1.00 0.00 H new ATOM 0 HG13 VAL A 66 0.710 -15.914 -0.296 1.00 0.00 H new ATOM 0 HG21 VAL A 66 2.325 -18.461 0.353 1.00 0.00 H new ATOM 0 HG22 VAL A 66 3.064 -16.948 -0.224 1.00 0.00 H new ATOM 0 HG23 VAL A 66 3.620 -17.686 1.297 1.00 0.00 H new ATOM 1024 N TYR A 67 0.799 -14.681 3.655 1.00 0.00 N ATOM 1025 CA TYR A 67 -0.270 -13.907 4.276 1.00 0.00 C ATOM 1026 C TYR A 67 0.128 -12.441 4.416 1.00 0.00 C ATOM 1027 O TYR A 67 -0.695 -11.544 4.245 1.00 0.00 O ATOM 1028 CB TYR A 67 -0.615 -14.487 5.649 1.00 0.00 C ATOM 1029 CG TYR A 67 -1.804 -13.822 6.305 1.00 0.00 C ATOM 1030 CD1 TYR A 67 -2.991 -13.630 5.608 1.00 0.00 C ATOM 1031 CD2 TYR A 67 -1.742 -13.387 7.623 1.00 0.00 C ATOM 1032 CE1 TYR A 67 -4.079 -13.023 6.203 1.00 0.00 C ATOM 1033 CE2 TYR A 67 -2.826 -12.780 8.227 1.00 0.00 C ATOM 1034 CZ TYR A 67 -3.992 -12.599 7.513 1.00 0.00 C ATOM 1035 OH TYR A 67 -5.074 -11.995 8.110 1.00 0.00 O ATOM 0 H TYR A 67 1.223 -15.380 4.265 1.00 0.00 H new ATOM 0 HA TYR A 67 -1.148 -13.966 3.632 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -0.818 -15.553 5.544 1.00 0.00 H new ATOM 0 HB3 TYR A 67 0.252 -14.391 6.303 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -3.064 -13.962 4.583 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -0.830 -13.526 8.185 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -4.993 -12.881 5.646 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -2.761 -12.449 9.253 1.00 0.00 H new ATOM 0 HH TYR A 67 -4.848 -11.758 9.034 1.00 0.00 H new ATOM 1045 N ASN A 68 1.399 -12.208 4.728 1.00 0.00 N ATOM 1046 CA ASN A 68 1.909 -10.851 4.891 1.00 0.00 C ATOM 1047 C ASN A 68 1.832 -10.079 3.577 1.00 0.00 C ATOM 1048 O ASN A 68 1.433 -8.915 3.552 1.00 0.00 O ATOM 1049 CB ASN A 68 3.354 -10.884 5.392 1.00 0.00 C ATOM 1050 CG ASN A 68 3.440 -10.938 6.905 1.00 0.00 C ATOM 1051 OD1 ASN A 68 2.729 -10.217 7.605 1.00 0.00 O ATOM 1052 ND2 ASN A 68 4.315 -11.796 7.418 1.00 0.00 N ATOM 0 H ASN A 68 2.094 -12.940 4.873 1.00 0.00 H new ATOM 0 HA ASN A 68 1.287 -10.342 5.628 1.00 0.00 H new ATOM 0 HB2 ASN A 68 3.862 -11.751 4.971 1.00 0.00 H new ATOM 0 HB3 ASN A 68 3.881 -10.000 5.032 1.00 0.00 H new ATOM 0 HD21 ASN A 68 4.418 -11.876 8.430 1.00 0.00 H new ATOM 0 HD22 ASN A 68 4.884 -12.375 6.800 1.00 0.00 H new ATOM 1059 N TRP A 69 2.215 -10.736 2.489 1.00 0.00 N ATOM 1060 CA TRP A 69 2.189 -10.112 1.171 1.00 0.00 C ATOM 1061 C TRP A 69 0.755 -9.898 0.698 1.00 0.00 C ATOM 1062 O TRP A 69 0.429 -8.860 0.123 1.00 0.00 O ATOM 1063 CB TRP A 69 2.949 -10.973 0.161 1.00 0.00 C ATOM 1064 CG TRP A 69 2.961 -10.396 -1.222 1.00 0.00 C ATOM 1065 CD1 TRP A 69 3.993 -9.735 -1.825 1.00 0.00 C ATOM 1066 CD2 TRP A 69 1.891 -10.426 -2.173 1.00 0.00 C ATOM 1067 NE1 TRP A 69 3.628 -9.352 -3.094 1.00 0.00 N ATOM 1068 CE2 TRP A 69 2.344 -9.765 -3.331 1.00 0.00 C ATOM 1069 CE3 TRP A 69 0.595 -10.949 -2.159 1.00 0.00 C ATOM 1070 CZ2 TRP A 69 1.546 -9.614 -4.462 1.00 0.00 C ATOM 1071 CZ3 TRP A 69 -0.196 -10.797 -3.282 1.00 0.00 C ATOM 1072 CH2 TRP A 69 0.281 -10.135 -4.421 1.00 0.00 C ATOM 0 H TRP A 69 2.547 -11.700 2.493 1.00 0.00 H new ATOM 0 HA TRP A 69 2.676 -9.140 1.247 1.00 0.00 H new ATOM 0 HB2 TRP A 69 3.976 -11.100 0.503 1.00 0.00 H new ATOM 0 HB3 TRP A 69 2.499 -11.965 0.129 1.00 0.00 H new ATOM 0 HD1 TRP A 69 4.954 -9.542 -1.372 1.00 0.00 H new ATOM 0 HE1 TRP A 69 4.218 -8.843 -3.752 1.00 0.00 H new ATOM 0 HE3 TRP A 69 0.219 -11.462 -1.287 1.00 0.00 H new ATOM 0 HZ2 TRP A 69 1.912 -9.104 -5.341 1.00 0.00 H new ATOM 0 HZ3 TRP A 69 -1.200 -11.196 -3.282 1.00 0.00 H new ATOM 0 HH2 TRP A 69 -0.362 -10.034 -5.283 1.00 0.00 H new ATOM 1083 N PHE A 70 -0.098 -10.887 0.944 1.00 0.00 N ATOM 1084 CA PHE A 70 -1.498 -10.807 0.542 1.00 0.00 C ATOM 1085 C PHE A 70 -2.231 -9.732 1.338 1.00 0.00 C ATOM 1086 O PHE A 70 -2.930 -8.893 0.771 1.00 0.00 O ATOM 1087 CB PHE A 70 -2.185 -12.160 0.738 1.00 0.00 C ATOM 1088 CG PHE A 70 -2.107 -13.052 -0.468 1.00 0.00 C ATOM 1089 CD1 PHE A 70 -0.885 -13.522 -0.921 1.00 0.00 C ATOM 1090 CD2 PHE A 70 -3.257 -13.419 -1.149 1.00 0.00 C ATOM 1091 CE1 PHE A 70 -0.811 -14.343 -2.031 1.00 0.00 C ATOM 1092 CE2 PHE A 70 -3.188 -14.240 -2.259 1.00 0.00 C ATOM 1093 CZ PHE A 70 -1.964 -14.702 -2.701 1.00 0.00 C ATOM 0 H PHE A 70 0.155 -11.753 1.420 1.00 0.00 H new ATOM 0 HA PHE A 70 -1.532 -10.540 -0.514 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -1.730 -12.670 1.587 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -3.232 -11.994 0.990 1.00 0.00 H new ATOM 0 HD1 PHE A 70 0.020 -13.244 -0.401 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -4.217 -13.060 -0.809 1.00 0.00 H new ATOM 0 HE1 PHE A 70 0.148 -14.703 -2.374 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -4.091 -14.520 -2.781 1.00 0.00 H new ATOM 0 HZ PHE A 70 -1.909 -15.343 -3.569 1.00 0.00 H new ATOM 1103 N ALA A 71 -2.067 -9.764 2.657 1.00 0.00 N ATOM 1104 CA ALA A 71 -2.711 -8.793 3.531 1.00 0.00 C ATOM 1105 C ALA A 71 -2.218 -7.380 3.240 1.00 0.00 C ATOM 1106 O ALA A 71 -2.958 -6.409 3.394 1.00 0.00 O ATOM 1107 CB ALA A 71 -2.465 -9.150 4.989 1.00 0.00 C ATOM 0 H ALA A 71 -1.493 -10.453 3.143 1.00 0.00 H new ATOM 0 HA ALA A 71 -3.783 -8.822 3.337 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -2.952 -8.416 5.631 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -2.873 -10.139 5.195 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -1.393 -9.151 5.188 1.00 0.00 H new ATOM 1113 N ASN A 72 -0.961 -7.272 2.819 1.00 0.00 N ATOM 1114 CA ASN A 72 -0.368 -5.976 2.508 1.00 0.00 C ATOM 1115 C ASN A 72 -0.895 -5.442 1.179 1.00 0.00 C ATOM 1116 O ASN A 72 -1.070 -4.236 1.009 1.00 0.00 O ATOM 1117 CB ASN A 72 1.157 -6.089 2.456 1.00 0.00 C ATOM 1118 CG ASN A 72 1.806 -5.760 3.787 1.00 0.00 C ATOM 1119 OD1 ASN A 72 1.191 -5.906 4.843 1.00 0.00 O ATOM 1120 ND2 ASN A 72 3.055 -5.312 3.740 1.00 0.00 N ATOM 0 H ASN A 72 -0.334 -8.066 2.686 1.00 0.00 H new ATOM 0 HA ASN A 72 -0.647 -5.278 3.297 1.00 0.00 H new ATOM 0 HB2 ASN A 72 1.434 -7.101 2.160 1.00 0.00 H new ATOM 0 HB3 ASN A 72 1.543 -5.416 1.690 1.00 0.00 H new ATOM 0 HD21 ASN A 72 3.544 -5.073 4.603 1.00 0.00 H new ATOM 0 HD22 ASN A 72 3.526 -5.207 2.841 1.00 0.00 H new ATOM 1127 N ARG A 73 -1.146 -6.349 0.241 1.00 0.00 N ATOM 1128 CA ARG A 73 -1.651 -5.970 -1.073 1.00 0.00 C ATOM 1129 C ARG A 73 -3.094 -5.481 -0.980 1.00 0.00 C ATOM 1130 O ARG A 73 -3.461 -4.480 -1.596 1.00 0.00 O ATOM 1131 CB ARG A 73 -1.565 -7.154 -2.038 1.00 0.00 C ATOM 1132 CG ARG A 73 -2.394 -6.974 -3.299 1.00 0.00 C ATOM 1133 CD ARG A 73 -1.747 -5.984 -4.255 1.00 0.00 C ATOM 1134 NE ARG A 73 -2.634 -5.633 -5.361 1.00 0.00 N ATOM 1135 CZ ARG A 73 -2.214 -5.067 -6.488 1.00 0.00 C ATOM 1136 NH1 ARG A 73 -0.928 -4.791 -6.656 1.00 0.00 N ATOM 1137 NH2 ARG A 73 -3.082 -4.777 -7.449 1.00 0.00 N ATOM 0 H ARG A 73 -1.008 -7.352 0.367 1.00 0.00 H new ATOM 0 HA ARG A 73 -1.032 -5.156 -1.451 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -0.523 -7.309 -2.318 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -1.894 -8.056 -1.523 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -2.515 -7.936 -3.797 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -3.392 -6.625 -3.033 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -1.472 -5.081 -3.710 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -0.826 -6.411 -4.651 1.00 0.00 H new ATOM 0 HE ARG A 73 -3.629 -5.833 -5.263 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -0.258 -5.013 -5.919 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -0.608 -4.357 -7.522 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -4.072 -4.988 -7.323 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -2.759 -4.343 -8.314 1.00 0.00 H new ATOM 1151 N ARG A 74 -3.906 -6.193 -0.206 1.00 0.00 N ATOM 1152 CA ARG A 74 -5.308 -5.833 -0.034 1.00 0.00 C ATOM 1153 C ARG A 74 -5.441 -4.434 0.561 1.00 0.00 C ATOM 1154 O ARG A 74 -6.266 -3.635 0.119 1.00 0.00 O ATOM 1155 CB ARG A 74 -6.011 -6.850 0.867 1.00 0.00 C ATOM 1156 CG ARG A 74 -6.058 -8.252 0.282 1.00 0.00 C ATOM 1157 CD ARG A 74 -7.112 -9.107 0.967 1.00 0.00 C ATOM 1158 NE ARG A 74 -6.710 -9.495 2.316 1.00 0.00 N ATOM 1159 CZ ARG A 74 -5.950 -10.552 2.580 1.00 0.00 C ATOM 1160 NH1 ARG A 74 -5.511 -11.321 1.593 1.00 0.00 N ATOM 1161 NH2 ARG A 74 -5.626 -10.841 3.834 1.00 0.00 N ATOM 0 H ARG A 74 -3.617 -7.023 0.312 1.00 0.00 H new ATOM 0 HA ARG A 74 -5.781 -5.839 -1.016 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -5.500 -6.884 1.829 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -7.029 -6.511 1.058 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -6.272 -8.195 -0.785 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -5.081 -8.724 0.387 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -8.052 -8.556 1.013 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -7.296 -10.002 0.372 1.00 0.00 H new ATOM 0 HE ARG A 74 -7.030 -8.924 3.098 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -5.757 -11.102 0.628 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -4.928 -12.132 1.799 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -5.961 -10.251 4.596 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -5.042 -11.653 4.036 1.00 0.00 H new ATOM 1175 N LYS A 75 -4.622 -4.144 1.566 1.00 0.00 N ATOM 1176 CA LYS A 75 -4.646 -2.842 2.222 1.00 0.00 C ATOM 1177 C LYS A 75 -4.087 -1.760 1.304 1.00 0.00 C ATOM 1178 O LYS A 75 -4.522 -0.610 1.350 1.00 0.00 O ATOM 1179 CB LYS A 75 -3.840 -2.888 3.522 1.00 0.00 C ATOM 1180 CG LYS A 75 -2.338 -2.808 3.310 1.00 0.00 C ATOM 1181 CD LYS A 75 -1.611 -2.463 4.599 1.00 0.00 C ATOM 1182 CE LYS A 75 -0.226 -3.091 4.643 1.00 0.00 C ATOM 1183 NZ LYS A 75 0.650 -2.432 5.651 1.00 0.00 N ATOM 0 H LYS A 75 -3.933 -4.794 1.944 1.00 0.00 H new ATOM 0 HA LYS A 75 -5.683 -2.599 2.453 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -4.152 -2.063 4.163 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -4.075 -3.811 4.053 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -1.972 -3.761 2.929 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -2.116 -2.056 2.553 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -1.524 -1.380 4.690 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -2.196 -2.809 5.451 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -0.315 -4.152 4.878 1.00 0.00 H new ATOM 0 HE3 LYS A 75 0.236 -3.020 3.658 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 1.584 -2.889 5.650 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 0.756 -1.425 5.413 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 0.222 -2.521 6.595 1.00 0.00 H new