USER MOD reduce.3.24.130724 H: found=0, std=0, add=745, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 748 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 68 MET CE :methyl -174:sc= 0 (180deg=-0.03) USER MOD Set 1.2: A 74 CYS SG : rot 78:sc= 0.167 USER MOD Set 2.1: A 47 LYS NZ :NH3+ 150:sc= 1.16 (180deg=0) USER MOD Set 2.2: A 62 THR OG1 : rot 170:sc= 0.985 USER MOD Single : A 16 THR OG1 : rot 98:sc= 1.28 USER MOD Single : A 25 LYS NZ :NH3+ -159:sc= 1.01 (180deg=0.479) USER MOD Single : A 30 MET CE :methyl -106:sc= -0.939 (180deg=-5.06!) USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 92:sc= 1.31 USER MOD Single : A 45 MET CE :methyl -168:sc= -0.199 (180deg=-0.387) USER MOD Single : A 49 LYS NZ :NH3+ -164:sc= 1.26 (180deg=1.14) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 134:sc= 1.26 (180deg=0.519) USER MOD Single : A 76 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00165) USER MOD Single : A 78 MET CE :methyl -170:sc= 0 (180deg=-0.0766) USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 156:sc= 1.28 (180deg=0.93) USER MOD Single : A 98 SER OG : rot 161:sc= 0.809 USER MOD Single : A 109 THR OG1 : rot -20:sc= 0.737 USER MOD Single : A 110 GLN : amide:sc= -0.354 X(o=-0.35,f=-0.35) USER MOD Single : A 118 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 217 N ILE A 14 -6.352 8.285 -4.356 1.00 0.00 N ATOM 218 CA ILE A 14 -5.980 8.068 -5.747 1.00 0.00 C ATOM 219 C ILE A 14 -7.054 7.186 -6.394 1.00 0.00 C ATOM 220 O ILE A 14 -7.661 7.581 -7.393 1.00 0.00 O ATOM 221 CB ILE A 14 -4.545 7.486 -5.809 1.00 0.00 C ATOM 222 CG1 ILE A 14 -3.521 8.579 -5.420 1.00 0.00 C ATOM 223 CG2 ILE A 14 -4.214 6.904 -7.196 1.00 0.00 C ATOM 224 CD1 ILE A 14 -2.129 8.046 -5.059 1.00 0.00 C ATOM 0 HA ILE A 14 -5.945 8.996 -6.318 1.00 0.00 H new ATOM 0 HB ILE A 14 -4.487 6.663 -5.097 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -3.424 9.280 -6.249 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -3.912 9.141 -4.572 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -3.199 6.508 -7.191 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -4.915 6.103 -7.431 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -4.294 7.689 -7.948 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -1.476 8.880 -4.800 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -2.208 7.369 -4.209 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -1.712 7.510 -5.912 1.00 0.00 H new ATOM 236 N GLU A 15 -7.325 6.024 -5.800 1.00 0.00 N ATOM 237 CA GLU A 15 -8.222 5.030 -6.364 1.00 0.00 C ATOM 238 C GLU A 15 -9.651 5.559 -6.537 1.00 0.00 C ATOM 239 O GLU A 15 -10.251 5.299 -7.579 1.00 0.00 O ATOM 240 CB GLU A 15 -8.177 3.775 -5.476 1.00 0.00 C ATOM 241 CG GLU A 15 -9.119 2.668 -5.964 1.00 0.00 C ATOM 242 CD GLU A 15 -8.923 1.366 -5.167 1.00 0.00 C ATOM 243 OE1 GLU A 15 -9.592 1.174 -4.127 1.00 0.00 O ATOM 244 OE2 GLU A 15 -8.115 0.506 -5.587 1.00 0.00 O ATOM 0 H GLU A 15 -6.921 5.749 -4.905 1.00 0.00 H new ATOM 0 HA GLU A 15 -7.886 4.779 -7.370 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -7.157 3.392 -5.448 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -8.443 4.048 -4.455 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -10.153 3.001 -5.870 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -8.941 2.478 -7.022 1.00 0.00 H new ATOM 251 N THR A 16 -10.197 6.296 -5.564 1.00 0.00 N ATOM 252 CA THR A 16 -11.618 6.647 -5.562 1.00 0.00 C ATOM 253 C THR A 16 -11.889 8.076 -6.054 1.00 0.00 C ATOM 254 O THR A 16 -13.036 8.385 -6.381 1.00 0.00 O ATOM 255 CB THR A 16 -12.242 6.359 -4.181 1.00 0.00 C ATOM 256 OG1 THR A 16 -11.644 7.116 -3.151 1.00 0.00 O ATOM 257 CG2 THR A 16 -12.119 4.872 -3.816 1.00 0.00 C ATOM 0 H THR A 16 -9.674 6.661 -4.768 1.00 0.00 H new ATOM 0 HA THR A 16 -12.114 6.006 -6.291 1.00 0.00 H new ATOM 0 HB THR A 16 -13.291 6.642 -4.264 1.00 0.00 H new ATOM 0 HG1 THR A 16 -12.190 7.909 -2.969 1.00 0.00 H new ATOM 0 HG21 THR A 16 -12.567 4.699 -2.838 1.00 0.00 H new ATOM 0 HG22 THR A 16 -12.636 4.270 -4.563 1.00 0.00 H new ATOM 0 HG23 THR A 16 -11.066 4.590 -3.788 1.00 0.00 H new ATOM 265 N GLU A 17 -10.864 8.932 -6.167 1.00 0.00 N ATOM 266 CA GLU A 17 -11.044 10.346 -6.504 1.00 0.00 C ATOM 267 C GLU A 17 -10.253 10.763 -7.753 1.00 0.00 C ATOM 268 O GLU A 17 -10.614 11.768 -8.365 1.00 0.00 O ATOM 269 CB GLU A 17 -10.680 11.270 -5.322 1.00 0.00 C ATOM 270 CG GLU A 17 -11.141 10.826 -3.921 1.00 0.00 C ATOM 271 CD GLU A 17 -12.643 10.518 -3.810 1.00 0.00 C ATOM 272 OE1 GLU A 17 -13.484 11.370 -4.182 1.00 0.00 O ATOM 273 OE2 GLU A 17 -12.986 9.434 -3.284 1.00 0.00 O ATOM 0 H GLU A 17 -9.890 8.662 -6.027 1.00 0.00 H new ATOM 0 HA GLU A 17 -12.105 10.462 -6.726 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -9.596 11.384 -5.302 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -11.100 12.256 -5.521 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -10.579 9.938 -3.632 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -10.890 11.609 -3.205 1.00 0.00 H new ATOM 280 N ILE A 18 -9.216 10.014 -8.164 1.00 0.00 N ATOM 281 CA ILE A 18 -8.289 10.460 -9.213 1.00 0.00 C ATOM 282 C ILE A 18 -8.373 9.529 -10.427 1.00 0.00 C ATOM 283 O ILE A 18 -8.546 10.020 -11.542 1.00 0.00 O ATOM 284 CB ILE A 18 -6.848 10.612 -8.654 1.00 0.00 C ATOM 285 CG1 ILE A 18 -6.847 11.502 -7.385 1.00 0.00 C ATOM 286 CG2 ILE A 18 -5.911 11.181 -9.733 1.00 0.00 C ATOM 287 CD1 ILE A 18 -5.468 11.900 -6.845 1.00 0.00 C ATOM 0 H ILE A 18 -9.000 9.093 -7.783 1.00 0.00 H new ATOM 0 HA ILE A 18 -8.584 11.452 -9.556 1.00 0.00 H new ATOM 0 HB ILE A 18 -6.478 9.627 -8.371 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -7.406 12.412 -7.603 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -7.386 10.977 -6.597 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -4.905 11.281 -9.325 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -5.890 10.507 -10.589 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -6.273 12.159 -10.050 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -5.590 12.521 -5.957 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -4.906 11.003 -6.586 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -4.926 12.460 -7.608 1.00 0.00 H new ATOM 299 N ILE A 19 -8.323 8.206 -10.236 1.00 0.00 N ATOM 300 CA ILE A 19 -8.330 7.234 -11.338 1.00 0.00 C ATOM 301 C ILE A 19 -9.581 6.342 -11.326 1.00 0.00 C ATOM 302 O ILE A 19 -9.649 5.364 -12.068 1.00 0.00 O ATOM 303 CB ILE A 19 -7.003 6.464 -11.393 1.00 0.00 C ATOM 304 CG1 ILE A 19 -6.765 5.687 -10.088 1.00 0.00 C ATOM 305 CG2 ILE A 19 -5.851 7.431 -11.740 1.00 0.00 C ATOM 306 CD1 ILE A 19 -5.548 4.789 -10.203 1.00 0.00 C ATOM 0 H ILE A 19 -8.276 7.777 -9.312 1.00 0.00 H new ATOM 0 HA ILE A 19 -8.402 7.782 -12.278 1.00 0.00 H new ATOM 0 HB ILE A 19 -7.047 5.717 -12.185 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.628 6.387 -9.264 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -7.644 5.086 -9.853 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -4.912 6.879 -11.778 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -6.041 7.890 -12.710 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -5.785 8.207 -10.978 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -5.403 4.251 -9.266 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -5.698 4.074 -11.012 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -4.667 5.395 -10.414 1.00 0.00 H new ATOM 318 N VAL A 20 -10.589 6.687 -10.521 1.00 0.00 N ATOM 319 CA VAL A 20 -11.848 5.948 -10.410 1.00 0.00 C ATOM 320 C VAL A 20 -12.535 5.741 -11.772 1.00 0.00 C ATOM 321 O VAL A 20 -13.131 4.689 -12.011 1.00 0.00 O ATOM 322 CB VAL A 20 -12.741 6.665 -9.374 1.00 0.00 C ATOM 323 CG1 VAL A 20 -13.258 8.040 -9.833 1.00 0.00 C ATOM 324 CG2 VAL A 20 -13.910 5.790 -8.905 1.00 0.00 C ATOM 0 H VAL A 20 -10.551 7.506 -9.915 1.00 0.00 H new ATOM 0 HA VAL A 20 -11.648 4.936 -10.059 1.00 0.00 H new ATOM 0 HB VAL A 20 -12.078 6.845 -8.528 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -13.877 8.476 -9.049 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -12.413 8.697 -10.036 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -13.851 7.921 -10.740 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -14.507 6.340 -8.178 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -14.532 5.526 -9.760 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -13.522 4.882 -8.444 1.00 0.00 H new ATOM 334 N ASP A 21 -12.431 6.722 -12.677 1.00 0.00 N ATOM 335 CA ASP A 21 -13.078 6.699 -13.993 1.00 0.00 C ATOM 336 C ASP A 21 -12.168 6.091 -15.072 1.00 0.00 C ATOM 337 O ASP A 21 -12.604 5.868 -16.204 1.00 0.00 O ATOM 338 CB ASP A 21 -13.475 8.135 -14.366 1.00 0.00 C ATOM 339 CG ASP A 21 -14.270 8.207 -15.682 1.00 0.00 C ATOM 340 OD1 ASP A 21 -15.391 7.653 -15.751 1.00 0.00 O ATOM 341 OD2 ASP A 21 -13.811 8.875 -16.636 1.00 0.00 O ATOM 0 H ASP A 21 -11.886 7.568 -12.512 1.00 0.00 H new ATOM 0 HA ASP A 21 -13.963 6.065 -13.939 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -14.072 8.563 -13.561 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -12.576 8.745 -14.455 1.00 0.00 H new ATOM 346 N ALA A 22 -10.898 5.833 -14.742 1.00 0.00 N ATOM 347 CA ALA A 22 -9.902 5.338 -15.683 1.00 0.00 C ATOM 348 C ALA A 22 -10.049 3.825 -15.922 1.00 0.00 C ATOM 349 O ALA A 22 -10.871 3.156 -15.289 1.00 0.00 O ATOM 350 CB ALA A 22 -8.503 5.686 -15.164 1.00 0.00 C ATOM 0 H ALA A 22 -10.533 5.966 -13.799 1.00 0.00 H new ATOM 0 HA ALA A 22 -10.058 5.822 -16.647 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -7.753 5.318 -15.864 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -8.409 6.768 -15.067 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -8.350 5.220 -14.190 1.00 0.00 H new ATOM 356 N GLU A 23 -9.221 3.279 -16.821 1.00 0.00 N ATOM 357 CA GLU A 23 -9.237 1.865 -17.192 1.00 0.00 C ATOM 358 C GLU A 23 -7.818 1.364 -17.482 1.00 0.00 C ATOM 359 O GLU A 23 -7.423 0.322 -16.960 1.00 0.00 O ATOM 360 CB GLU A 23 -10.164 1.680 -18.407 1.00 0.00 C ATOM 361 CG GLU A 23 -10.343 0.204 -18.791 1.00 0.00 C ATOM 362 CD GLU A 23 -11.352 0.038 -19.942 1.00 0.00 C ATOM 363 OE1 GLU A 23 -12.565 -0.125 -19.679 1.00 0.00 O ATOM 364 OE2 GLU A 23 -10.942 0.046 -21.126 1.00 0.00 O ATOM 0 H GLU A 23 -8.511 3.818 -17.317 1.00 0.00 H new ATOM 0 HA GLU A 23 -9.620 1.270 -16.363 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -11.139 2.115 -18.186 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -9.756 2.226 -19.257 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -9.381 -0.215 -19.086 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -10.684 -0.360 -17.923 1.00 0.00 H new ATOM 371 N ASP A 24 -7.009 2.126 -18.226 1.00 0.00 N ATOM 372 CA ASP A 24 -5.644 1.755 -18.621 1.00 0.00 C ATOM 373 C ASP A 24 -4.744 2.985 -18.522 1.00 0.00 C ATOM 374 O ASP A 24 -5.245 4.085 -18.296 1.00 0.00 O ATOM 375 CB ASP A 24 -5.640 1.177 -20.045 1.00 0.00 C ATOM 376 CG ASP A 24 -4.349 0.426 -20.407 1.00 0.00 C ATOM 377 OD1 ASP A 24 -3.508 0.165 -19.521 1.00 0.00 O ATOM 378 OD2 ASP A 24 -4.135 0.128 -21.602 1.00 0.00 O ATOM 0 H ASP A 24 -7.291 3.040 -18.579 1.00 0.00 H new ATOM 0 HA ASP A 24 -5.263 0.984 -17.951 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -6.486 0.499 -20.154 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -5.789 1.989 -20.757 1.00 0.00 H new ATOM 383 N LYS A 25 -3.431 2.826 -18.697 1.00 0.00 N ATOM 384 CA LYS A 25 -2.426 3.856 -18.412 1.00 0.00 C ATOM 385 C LYS A 25 -2.725 5.232 -19.011 1.00 0.00 C ATOM 386 O LYS A 25 -2.475 6.237 -18.349 1.00 0.00 O ATOM 387 CB LYS A 25 -0.996 3.371 -18.739 1.00 0.00 C ATOM 388 CG LYS A 25 -0.549 3.374 -20.216 1.00 0.00 C ATOM 389 CD LYS A 25 -1.178 2.314 -21.133 1.00 0.00 C ATOM 390 CE LYS A 25 -0.723 0.895 -20.758 1.00 0.00 C ATOM 391 NZ LYS A 25 -1.329 -0.134 -21.636 1.00 0.00 N ATOM 0 H LYS A 25 -3.026 1.958 -19.049 1.00 0.00 H new ATOM 0 HA LYS A 25 -2.487 4.014 -17.335 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -0.297 3.991 -18.177 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -0.894 2.354 -18.362 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -0.766 4.357 -20.634 1.00 0.00 H new ATOM 0 HG3 LYS A 25 0.533 3.248 -20.243 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -2.264 2.376 -21.069 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -0.907 2.521 -22.168 1.00 0.00 H new ATOM 0 HE2 LYS A 25 0.363 0.834 -20.824 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -0.991 0.691 -19.722 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -1.299 -1.058 -21.160 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -2.317 0.120 -21.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -0.797 -0.186 -22.528 1.00 0.00 H new ATOM 405 N GLU A 26 -3.280 5.291 -20.222 1.00 0.00 N ATOM 406 CA GLU A 26 -3.575 6.561 -20.883 1.00 0.00 C ATOM 407 C GLU A 26 -4.729 7.255 -20.151 1.00 0.00 C ATOM 408 O GLU A 26 -4.676 8.453 -19.876 1.00 0.00 O ATOM 409 CB GLU A 26 -3.935 6.315 -22.358 1.00 0.00 C ATOM 410 CG GLU A 26 -2.758 5.745 -23.167 1.00 0.00 C ATOM 411 CD GLU A 26 -3.158 5.458 -24.627 1.00 0.00 C ATOM 412 OE1 GLU A 26 -3.724 4.377 -24.905 1.00 0.00 O ATOM 413 OE2 GLU A 26 -2.889 6.296 -25.518 1.00 0.00 O ATOM 0 H GLU A 26 -3.535 4.468 -20.767 1.00 0.00 H new ATOM 0 HA GLU A 26 -2.696 7.205 -20.850 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -4.777 5.624 -22.412 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -4.262 7.252 -22.810 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -1.928 6.451 -23.149 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -2.405 4.826 -22.699 1.00 0.00 H new ATOM 420 N GLU A 27 -5.756 6.489 -19.778 1.00 0.00 N ATOM 421 CA GLU A 27 -6.910 6.997 -19.049 1.00 0.00 C ATOM 422 C GLU A 27 -6.509 7.361 -17.618 1.00 0.00 C ATOM 423 O GLU A 27 -7.003 8.341 -17.069 1.00 0.00 O ATOM 424 CB GLU A 27 -8.035 5.948 -19.039 1.00 0.00 C ATOM 425 CG GLU A 27 -8.448 5.442 -20.431 1.00 0.00 C ATOM 426 CD GLU A 27 -8.897 6.571 -21.379 1.00 0.00 C ATOM 427 OE1 GLU A 27 -9.844 7.317 -21.043 1.00 0.00 O ATOM 428 OE2 GLU A 27 -8.329 6.701 -22.486 1.00 0.00 O ATOM 0 H GLU A 27 -5.806 5.490 -19.977 1.00 0.00 H new ATOM 0 HA GLU A 27 -7.276 7.894 -19.548 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -7.716 5.097 -18.437 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -8.909 6.376 -18.548 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -7.609 4.911 -20.881 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -9.260 4.723 -20.323 1.00 0.00 H new ATOM 435 N ARG A 28 -5.597 6.598 -17.006 1.00 0.00 N ATOM 436 CA ARG A 28 -5.131 6.863 -15.644 1.00 0.00 C ATOM 437 C ARG A 28 -4.321 8.156 -15.630 1.00 0.00 C ATOM 438 O ARG A 28 -4.526 8.982 -14.742 1.00 0.00 O ATOM 439 CB ARG A 28 -4.328 5.665 -15.105 1.00 0.00 C ATOM 440 CG ARG A 28 -5.177 4.384 -14.977 1.00 0.00 C ATOM 441 CD ARG A 28 -4.319 3.142 -14.711 1.00 0.00 C ATOM 442 NE ARG A 28 -5.014 1.895 -15.079 1.00 0.00 N ATOM 443 CZ ARG A 28 -4.508 0.662 -14.947 1.00 0.00 C ATOM 444 NH1 ARG A 28 -3.321 0.476 -14.373 1.00 0.00 N ATOM 445 NH2 ARG A 28 -5.193 -0.381 -15.401 1.00 0.00 N ATOM 0 H ARG A 28 -5.164 5.783 -17.440 1.00 0.00 H new ATOM 0 HA ARG A 28 -5.985 6.993 -14.979 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -3.485 5.471 -15.768 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -3.915 5.920 -14.129 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -5.896 4.507 -14.167 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -5.750 4.238 -15.892 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -3.389 3.217 -15.275 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -4.050 3.108 -13.655 1.00 0.00 H new ATOM 0 HE ARG A 28 -5.955 1.978 -15.465 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -2.790 1.276 -14.030 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -2.943 -0.467 -14.277 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -6.099 -0.241 -15.847 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -4.813 -1.322 -15.303 1.00 0.00 H new ATOM 459 N ALA A 29 -3.467 8.375 -16.634 1.00 0.00 N ATOM 460 CA ALA A 29 -2.759 9.634 -16.805 1.00 0.00 C ATOM 461 C ALA A 29 -3.750 10.789 -16.972 1.00 0.00 C ATOM 462 O ALA A 29 -3.557 11.839 -16.362 1.00 0.00 O ATOM 463 CB ALA A 29 -1.815 9.543 -18.006 1.00 0.00 C ATOM 0 H ALA A 29 -3.251 7.680 -17.348 1.00 0.00 H new ATOM 0 HA ALA A 29 -2.165 9.830 -15.913 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -1.288 10.490 -18.127 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -1.092 8.744 -17.841 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -2.391 9.330 -18.906 1.00 0.00 H new ATOM 469 N MET A 30 -4.829 10.605 -17.741 1.00 0.00 N ATOM 470 CA MET A 30 -5.877 11.618 -17.847 1.00 0.00 C ATOM 471 C MET A 30 -6.572 11.856 -16.506 1.00 0.00 C ATOM 472 O MET A 30 -6.811 13.009 -16.164 1.00 0.00 O ATOM 473 CB MET A 30 -6.882 11.281 -18.954 1.00 0.00 C ATOM 474 CG MET A 30 -6.295 11.427 -20.365 1.00 0.00 C ATOM 475 SD MET A 30 -5.793 13.102 -20.872 1.00 0.00 S ATOM 476 CE MET A 30 -4.079 13.180 -20.273 1.00 0.00 C ATOM 0 H MET A 30 -4.996 9.766 -18.296 1.00 0.00 H new ATOM 0 HA MET A 30 -5.392 12.553 -18.128 1.00 0.00 H new ATOM 0 HB2 MET A 30 -7.234 10.259 -18.818 1.00 0.00 H new ATOM 0 HB3 MET A 30 -7.750 11.933 -18.859 1.00 0.00 H new ATOM 0 HG2 MET A 30 -5.426 10.774 -20.441 1.00 0.00 H new ATOM 0 HG3 MET A 30 -7.032 11.062 -21.080 1.00 0.00 H new ATOM 0 HE1 MET A 30 -4.031 13.816 -19.389 1.00 0.00 H new ATOM 0 HE2 MET A 30 -3.737 12.177 -20.017 1.00 0.00 H new ATOM 0 HE3 MET A 30 -3.439 13.593 -21.053 1.00 0.00 H new ATOM 486 N GLY A 31 -6.836 10.813 -15.715 1.00 0.00 N ATOM 487 CA GLY A 31 -7.405 10.949 -14.380 1.00 0.00 C ATOM 488 C GLY A 31 -6.535 11.847 -13.499 1.00 0.00 C ATOM 489 O GLY A 31 -7.025 12.833 -12.940 1.00 0.00 O ATOM 0 H GLY A 31 -6.658 9.846 -15.988 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -8.409 11.367 -14.450 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -7.500 9.965 -13.920 1.00 0.00 H new ATOM 493 N TRP A 32 -5.228 11.563 -13.445 1.00 0.00 N ATOM 494 CA TRP A 32 -4.262 12.402 -12.746 1.00 0.00 C ATOM 495 C TRP A 32 -4.279 13.832 -13.287 1.00 0.00 C ATOM 496 O TRP A 32 -4.365 14.778 -12.505 1.00 0.00 O ATOM 497 CB TRP A 32 -2.854 11.801 -12.860 1.00 0.00 C ATOM 498 CG TRP A 32 -2.542 10.697 -11.898 1.00 0.00 C ATOM 499 CD1 TRP A 32 -2.457 9.377 -12.179 1.00 0.00 C ATOM 500 CD2 TRP A 32 -2.208 10.820 -10.483 1.00 0.00 C ATOM 501 NE1 TRP A 32 -2.100 8.676 -11.045 1.00 0.00 N ATOM 502 CE2 TRP A 32 -1.923 9.519 -9.968 1.00 0.00 C ATOM 503 CE3 TRP A 32 -2.102 11.908 -9.590 1.00 0.00 C ATOM 504 CZ2 TRP A 32 -1.538 9.315 -8.636 1.00 0.00 C ATOM 505 CZ3 TRP A 32 -1.712 11.712 -8.252 1.00 0.00 C ATOM 506 CH2 TRP A 32 -1.418 10.421 -7.781 1.00 0.00 C ATOM 0 H TRP A 32 -4.815 10.742 -13.888 1.00 0.00 H new ATOM 0 HA TRP A 32 -4.544 12.439 -11.694 1.00 0.00 H new ATOM 0 HB2 TRP A 32 -2.720 11.424 -13.874 1.00 0.00 H new ATOM 0 HB3 TRP A 32 -2.125 12.599 -12.718 1.00 0.00 H new ATOM 0 HD1 TRP A 32 -2.641 8.936 -13.148 1.00 0.00 H new ATOM 0 HE1 TRP A 32 -1.982 7.664 -11.008 1.00 0.00 H new ATOM 0 HE3 TRP A 32 -2.324 12.906 -9.939 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 -1.336 8.318 -8.272 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 -1.638 12.558 -7.584 1.00 0.00 H new ATOM 0 HH2 TRP A 32 -1.099 10.280 -6.759 1.00 0.00 H new ATOM 517 N TYR A 33 -4.216 13.997 -14.611 1.00 0.00 N ATOM 518 CA TYR A 33 -4.128 15.295 -15.257 1.00 0.00 C ATOM 519 C TYR A 33 -5.352 16.144 -14.923 1.00 0.00 C ATOM 520 O TYR A 33 -5.188 17.296 -14.525 1.00 0.00 O ATOM 521 CB TYR A 33 -3.975 15.087 -16.771 1.00 0.00 C ATOM 522 CG TYR A 33 -4.248 16.308 -17.629 1.00 0.00 C ATOM 523 CD1 TYR A 33 -3.501 17.487 -17.460 1.00 0.00 C ATOM 524 CD2 TYR A 33 -5.282 16.270 -18.582 1.00 0.00 C ATOM 525 CE1 TYR A 33 -3.786 18.624 -18.235 1.00 0.00 C ATOM 526 CE2 TYR A 33 -5.591 17.411 -19.341 1.00 0.00 C ATOM 527 CZ TYR A 33 -4.835 18.594 -19.182 1.00 0.00 C ATOM 528 OH TYR A 33 -5.127 19.689 -19.938 1.00 0.00 O ATOM 0 H TYR A 33 -4.225 13.217 -15.268 1.00 0.00 H new ATOM 0 HA TYR A 33 -3.256 15.836 -14.889 1.00 0.00 H new ATOM 0 HB2 TYR A 33 -2.961 14.743 -16.972 1.00 0.00 H new ATOM 0 HB3 TYR A 33 -4.650 14.289 -17.080 1.00 0.00 H new ATOM 0 HD1 TYR A 33 -2.705 17.519 -16.731 1.00 0.00 H new ATOM 0 HD2 TYR A 33 -5.842 15.358 -18.731 1.00 0.00 H new ATOM 0 HE1 TYR A 33 -3.202 19.523 -18.107 1.00 0.00 H new ATOM 0 HE2 TYR A 33 -6.408 17.384 -20.047 1.00 0.00 H new ATOM 0 HH TYR A 33 -5.877 19.484 -20.535 1.00 0.00 H new ATOM 538 N TYR A 34 -6.563 15.590 -15.031 1.00 0.00 N ATOM 539 CA TYR A 34 -7.791 16.329 -14.781 1.00 0.00 C ATOM 540 C TYR A 34 -7.872 16.743 -13.313 1.00 0.00 C ATOM 541 O TYR A 34 -8.229 17.883 -13.022 1.00 0.00 O ATOM 542 CB TYR A 34 -9.014 15.470 -15.145 1.00 0.00 C ATOM 543 CG TYR A 34 -9.162 14.994 -16.586 1.00 0.00 C ATOM 544 CD1 TYR A 34 -8.474 15.602 -17.659 1.00 0.00 C ATOM 545 CD2 TYR A 34 -10.035 13.920 -16.848 1.00 0.00 C ATOM 546 CE1 TYR A 34 -8.672 15.150 -18.977 1.00 0.00 C ATOM 547 CE2 TYR A 34 -10.233 13.459 -18.161 1.00 0.00 C ATOM 548 CZ TYR A 34 -9.555 14.076 -19.235 1.00 0.00 C ATOM 549 OH TYR A 34 -9.757 13.625 -20.505 1.00 0.00 O ATOM 0 H TYR A 34 -6.713 14.616 -15.295 1.00 0.00 H new ATOM 0 HA TYR A 34 -7.786 17.224 -15.403 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -9.004 14.589 -14.504 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -9.908 16.040 -14.890 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -7.793 16.418 -17.467 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -10.558 13.445 -16.031 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -8.148 15.625 -19.794 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -10.903 12.633 -18.348 1.00 0.00 H new ATOM 0 HH TYR A 34 -10.395 12.881 -20.490 1.00 0.00 H new ATOM 559 N TYR A 35 -7.533 15.840 -12.386 1.00 0.00 N ATOM 560 CA TYR A 35 -7.614 16.127 -10.961 1.00 0.00 C ATOM 561 C TYR A 35 -6.636 17.243 -10.586 1.00 0.00 C ATOM 562 O TYR A 35 -7.009 18.192 -9.895 1.00 0.00 O ATOM 563 CB TYR A 35 -7.337 14.843 -10.170 1.00 0.00 C ATOM 564 CG TYR A 35 -7.651 14.954 -8.691 1.00 0.00 C ATOM 565 CD1 TYR A 35 -8.966 14.736 -8.237 1.00 0.00 C ATOM 566 CD2 TYR A 35 -6.633 15.255 -7.766 1.00 0.00 C ATOM 567 CE1 TYR A 35 -9.264 14.809 -6.866 1.00 0.00 C ATOM 568 CE2 TYR A 35 -6.923 15.335 -6.392 1.00 0.00 C ATOM 569 CZ TYR A 35 -8.243 15.109 -5.935 1.00 0.00 C ATOM 570 OH TYR A 35 -8.545 15.174 -4.607 1.00 0.00 O ATOM 0 H TYR A 35 -7.199 14.901 -12.605 1.00 0.00 H new ATOM 0 HA TYR A 35 -8.616 16.477 -10.712 1.00 0.00 H new ATOM 0 HB2 TYR A 35 -7.926 14.031 -10.597 1.00 0.00 H new ATOM 0 HB3 TYR A 35 -6.288 14.573 -10.290 1.00 0.00 H new ATOM 0 HD1 TYR A 35 -9.749 14.512 -8.946 1.00 0.00 H new ATOM 0 HD2 TYR A 35 -5.625 15.425 -8.113 1.00 0.00 H new ATOM 0 HE1 TYR A 35 -10.273 14.636 -6.523 1.00 0.00 H new ATOM 0 HE2 TYR A 35 -6.139 15.569 -5.687 1.00 0.00 H new ATOM 0 HH TYR A 35 -7.736 15.389 -4.098 1.00 0.00 H new ATOM 580 N LEU A 36 -5.394 17.166 -11.071 1.00 0.00 N ATOM 581 CA LEU A 36 -4.371 18.166 -10.793 1.00 0.00 C ATOM 582 C LEU A 36 -4.754 19.491 -11.444 1.00 0.00 C ATOM 583 O LEU A 36 -4.685 20.520 -10.780 1.00 0.00 O ATOM 584 CB LEU A 36 -2.998 17.671 -11.281 1.00 0.00 C ATOM 585 CG LEU A 36 -2.166 16.922 -10.215 1.00 0.00 C ATOM 586 CD1 LEU A 36 -2.942 15.886 -9.392 1.00 0.00 C ATOM 587 CD2 LEU A 36 -1.008 16.206 -10.917 1.00 0.00 C ATOM 0 H LEU A 36 -5.073 16.404 -11.669 1.00 0.00 H new ATOM 0 HA LEU A 36 -4.301 18.326 -9.717 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -3.147 17.011 -12.135 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -2.423 18.527 -11.636 1.00 0.00 H new ATOM 0 HG LEU A 36 -1.833 17.683 -9.509 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -2.271 15.416 -8.673 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -3.756 16.379 -8.860 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -3.351 15.126 -10.057 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -0.410 15.672 -10.179 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -1.405 15.497 -11.644 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -0.384 16.939 -11.428 1.00 0.00 H new ATOM 599 N ASP A 37 -5.218 19.484 -12.695 1.00 0.00 N ATOM 600 CA ASP A 37 -5.669 20.693 -13.381 1.00 0.00 C ATOM 601 C ASP A 37 -6.825 21.372 -12.641 1.00 0.00 C ATOM 602 O ASP A 37 -6.895 22.600 -12.605 1.00 0.00 O ATOM 603 CB ASP A 37 -6.083 20.357 -14.817 1.00 0.00 C ATOM 604 CG ASP A 37 -6.643 21.590 -15.544 1.00 0.00 C ATOM 605 OD1 ASP A 37 -5.843 22.433 -16.002 1.00 0.00 O ATOM 606 OD2 ASP A 37 -7.881 21.694 -15.700 1.00 0.00 O ATOM 0 H ASP A 37 -5.291 18.638 -13.260 1.00 0.00 H new ATOM 0 HA ASP A 37 -4.835 21.395 -13.399 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -5.223 19.970 -15.364 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -6.835 19.568 -14.805 1.00 0.00 H new ATOM 611 N ASP A 38 -7.704 20.590 -12.007 1.00 0.00 N ATOM 612 CA ASP A 38 -8.816 21.115 -11.213 1.00 0.00 C ATOM 613 C ASP A 38 -8.368 21.621 -9.834 1.00 0.00 C ATOM 614 O ASP A 38 -9.043 22.464 -9.241 1.00 0.00 O ATOM 615 CB ASP A 38 -9.887 20.030 -11.044 1.00 0.00 C ATOM 616 CG ASP A 38 -11.097 20.542 -10.245 1.00 0.00 C ATOM 617 OD1 ASP A 38 -11.853 21.394 -10.764 1.00 0.00 O ATOM 618 OD2 ASP A 38 -11.333 20.059 -9.114 1.00 0.00 O ATOM 0 H ASP A 38 -7.663 19.571 -12.031 1.00 0.00 H new ATOM 0 HA ASP A 38 -9.225 21.969 -11.753 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -10.217 19.689 -12.025 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -9.454 19.168 -10.536 1.00 0.00 H new ATOM 623 N THR A 39 -7.231 21.140 -9.324 1.00 0.00 N ATOM 624 CA THR A 39 -6.813 21.379 -7.943 1.00 0.00 C ATOM 625 C THR A 39 -5.768 22.496 -7.840 1.00 0.00 C ATOM 626 O THR A 39 -5.857 23.343 -6.950 1.00 0.00 O ATOM 627 CB THR A 39 -6.268 20.062 -7.362 1.00 0.00 C ATOM 628 OG1 THR A 39 -7.273 19.069 -7.374 1.00 0.00 O ATOM 629 CG2 THR A 39 -5.758 20.237 -5.931 1.00 0.00 C ATOM 0 H THR A 39 -6.574 20.573 -9.860 1.00 0.00 H new ATOM 0 HA THR A 39 -7.676 21.713 -7.368 1.00 0.00 H new ATOM 0 HB THR A 39 -5.431 19.757 -7.990 1.00 0.00 H new ATOM 0 HG1 THR A 39 -7.219 18.559 -8.209 1.00 0.00 H new ATOM 0 HG21 THR A 39 -5.382 19.284 -5.559 1.00 0.00 H new ATOM 0 HG22 THR A 39 -4.954 20.973 -5.919 1.00 0.00 H new ATOM 0 HG23 THR A 39 -6.573 20.579 -5.293 1.00 0.00 H new ATOM 637 N LEU A 40 -4.761 22.476 -8.713 1.00 0.00 N ATOM 638 CA LEU A 40 -3.593 23.342 -8.625 1.00 0.00 C ATOM 639 C LEU A 40 -4.030 24.785 -8.896 1.00 0.00 C ATOM 640 O LEU A 40 -4.620 25.070 -9.939 1.00 0.00 O ATOM 641 CB LEU A 40 -2.537 22.891 -9.651 1.00 0.00 C ATOM 642 CG LEU A 40 -1.929 21.487 -9.425 1.00 0.00 C ATOM 643 CD1 LEU A 40 -1.227 21.030 -10.707 1.00 0.00 C ATOM 644 CD2 LEU A 40 -0.919 21.403 -8.284 1.00 0.00 C ATOM 0 H LEU A 40 -4.737 21.845 -9.514 1.00 0.00 H new ATOM 0 HA LEU A 40 -3.151 23.282 -7.630 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -2.989 22.914 -10.642 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -1.727 23.620 -9.653 1.00 0.00 H new ATOM 0 HG LEU A 40 -2.768 20.847 -9.153 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -0.796 20.041 -10.553 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.949 20.989 -11.522 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -0.435 21.735 -10.959 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -0.547 20.382 -8.201 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -0.086 22.077 -8.485 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -1.401 21.690 -7.350 1.00 0.00 H new ATOM 656 N GLU A 41 -3.717 25.706 -7.986 1.00 0.00 N ATOM 657 CA GLU A 41 -4.094 27.118 -8.051 1.00 0.00 C ATOM 658 C GLU A 41 -3.099 27.895 -8.934 1.00 0.00 C ATOM 659 O GLU A 41 -2.570 28.935 -8.536 1.00 0.00 O ATOM 660 CB GLU A 41 -4.198 27.698 -6.622 1.00 0.00 C ATOM 661 CG GLU A 41 -5.342 27.102 -5.784 1.00 0.00 C ATOM 662 CD GLU A 41 -6.725 27.579 -6.265 1.00 0.00 C ATOM 663 OE1 GLU A 41 -7.216 28.620 -5.771 1.00 0.00 O ATOM 664 OE2 GLU A 41 -7.348 26.921 -7.129 1.00 0.00 O ATOM 0 H GLU A 41 -3.174 25.482 -7.152 1.00 0.00 H new ATOM 0 HA GLU A 41 -5.075 27.218 -8.515 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -3.255 27.528 -6.103 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -4.335 28.777 -6.689 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -5.297 26.014 -5.833 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -5.207 27.380 -4.739 1.00 0.00 H new ATOM 671 N PHE A 42 -2.780 27.363 -10.118 1.00 0.00 N ATOM 672 CA PHE A 42 -1.931 28.049 -11.088 1.00 0.00 C ATOM 673 C PHE A 42 -2.616 29.339 -11.596 1.00 0.00 C ATOM 674 O PHE A 42 -3.849 29.428 -11.539 1.00 0.00 O ATOM 675 CB PHE A 42 -1.562 27.088 -12.228 1.00 0.00 C ATOM 676 CG PHE A 42 -2.722 26.572 -13.060 1.00 0.00 C ATOM 677 CD1 PHE A 42 -3.294 27.381 -14.062 1.00 0.00 C ATOM 678 CD2 PHE A 42 -3.173 25.250 -12.892 1.00 0.00 C ATOM 679 CE1 PHE A 42 -4.330 26.880 -14.869 1.00 0.00 C ATOM 680 CE2 PHE A 42 -4.210 24.750 -13.698 1.00 0.00 C ATOM 681 CZ PHE A 42 -4.792 25.566 -14.684 1.00 0.00 C ATOM 0 H PHE A 42 -3.104 26.447 -10.427 1.00 0.00 H new ATOM 0 HA PHE A 42 -1.003 28.358 -10.607 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -0.861 27.594 -12.891 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -1.037 26.233 -11.801 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -2.935 28.389 -14.210 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -2.721 24.618 -12.142 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -4.771 27.505 -15.631 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -4.560 23.738 -13.560 1.00 0.00 H new ATOM 0 HZ PHE A 42 -5.593 25.183 -15.299 1.00 0.00 H new ATOM 691 N PRO A 43 -1.872 30.321 -12.146 1.00 0.00 N ATOM 692 CA PRO A 43 -0.413 30.395 -12.176 1.00 0.00 C ATOM 693 C PRO A 43 0.152 30.548 -10.758 1.00 0.00 C ATOM 694 O PRO A 43 -0.465 31.201 -9.912 1.00 0.00 O ATOM 695 CB PRO A 43 -0.087 31.611 -13.051 1.00 0.00 C ATOM 696 CG PRO A 43 -1.299 32.522 -12.878 1.00 0.00 C ATOM 697 CD PRO A 43 -2.449 31.529 -12.721 1.00 0.00 C ATOM 0 HA PRO A 43 0.037 29.488 -12.579 1.00 0.00 H new ATOM 0 HB2 PRO A 43 0.831 32.102 -12.728 1.00 0.00 H new ATOM 0 HB3 PRO A 43 0.054 31.327 -14.094 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -1.199 33.167 -12.005 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -1.442 33.173 -13.740 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -3.227 31.934 -12.074 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -2.914 31.317 -13.684 1.00 0.00 H new ATOM 705 N PHE A 44 1.313 29.945 -10.491 1.00 0.00 N ATOM 706 CA PHE A 44 1.974 30.032 -9.188 1.00 0.00 C ATOM 707 C PHE A 44 3.488 30.027 -9.388 1.00 0.00 C ATOM 708 O PHE A 44 3.965 29.669 -10.461 1.00 0.00 O ATOM 709 CB PHE A 44 1.496 28.910 -8.241 1.00 0.00 C ATOM 710 CG PHE A 44 1.818 27.468 -8.620 1.00 0.00 C ATOM 711 CD1 PHE A 44 3.134 26.987 -8.506 1.00 0.00 C ATOM 712 CD2 PHE A 44 0.799 26.572 -8.996 1.00 0.00 C ATOM 713 CE1 PHE A 44 3.446 25.649 -8.790 1.00 0.00 C ATOM 714 CE2 PHE A 44 1.105 25.228 -9.283 1.00 0.00 C ATOM 715 CZ PHE A 44 2.428 24.764 -9.182 1.00 0.00 C ATOM 0 H PHE A 44 1.821 29.382 -11.173 1.00 0.00 H new ATOM 0 HA PHE A 44 1.701 30.969 -8.704 1.00 0.00 H new ATOM 0 HB2 PHE A 44 1.923 29.100 -7.256 1.00 0.00 H new ATOM 0 HB3 PHE A 44 0.414 28.995 -8.141 1.00 0.00 H new ATOM 0 HD1 PHE A 44 3.919 27.660 -8.194 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -0.222 26.917 -9.065 1.00 0.00 H new ATOM 0 HE1 PHE A 44 4.465 25.301 -8.708 1.00 0.00 H new ATOM 0 HE2 PHE A 44 0.319 24.550 -9.582 1.00 0.00 H new ATOM 0 HZ PHE A 44 2.660 23.733 -9.404 1.00 0.00 H new ATOM 725 N MET A 45 4.263 30.412 -8.377 1.00 0.00 N ATOM 726 CA MET A 45 5.721 30.429 -8.470 1.00 0.00 C ATOM 727 C MET A 45 6.270 29.102 -7.949 1.00 0.00 C ATOM 728 O MET A 45 5.736 28.553 -6.984 1.00 0.00 O ATOM 729 CB MET A 45 6.237 31.608 -7.631 1.00 0.00 C ATOM 730 CG MET A 45 7.758 31.759 -7.686 1.00 0.00 C ATOM 731 SD MET A 45 8.392 33.054 -6.592 1.00 0.00 S ATOM 732 CE MET A 45 10.154 32.797 -6.901 1.00 0.00 C ATOM 0 H MET A 45 3.901 30.720 -7.474 1.00 0.00 H new ATOM 0 HA MET A 45 6.050 30.551 -9.502 1.00 0.00 H new ATOM 0 HB2 MET A 45 5.773 32.529 -7.984 1.00 0.00 H new ATOM 0 HB3 MET A 45 5.928 31.472 -6.595 1.00 0.00 H new ATOM 0 HG2 MET A 45 8.220 30.809 -7.418 1.00 0.00 H new ATOM 0 HG3 MET A 45 8.057 31.981 -8.711 1.00 0.00 H new ATOM 0 HE1 MET A 45 10.737 33.351 -6.165 1.00 0.00 H new ATOM 0 HE2 MET A 45 10.386 31.735 -6.823 1.00 0.00 H new ATOM 0 HE3 MET A 45 10.403 33.150 -7.902 1.00 0.00 H new ATOM 742 N GLY A 46 7.362 28.596 -8.521 1.00 0.00 N ATOM 743 CA GLY A 46 8.016 27.403 -8.017 1.00 0.00 C ATOM 744 C GLY A 46 9.487 27.363 -8.390 1.00 0.00 C ATOM 745 O GLY A 46 9.982 28.179 -9.168 1.00 0.00 O ATOM 0 H GLY A 46 7.811 29.003 -9.341 1.00 0.00 H new ATOM 0 HA2 GLY A 46 7.915 27.365 -6.932 1.00 0.00 H new ATOM 0 HA3 GLY A 46 7.516 26.520 -8.415 1.00 0.00 H new ATOM 749 N LYS A 47 10.196 26.402 -7.810 1.00 0.00 N ATOM 750 CA LYS A 47 11.554 26.074 -8.215 1.00 0.00 C ATOM 751 C LYS A 47 11.447 24.847 -9.114 1.00 0.00 C ATOM 752 O LYS A 47 10.866 23.839 -8.707 1.00 0.00 O ATOM 753 CB LYS A 47 12.431 25.787 -6.979 1.00 0.00 C ATOM 754 CG LYS A 47 13.933 25.929 -7.280 1.00 0.00 C ATOM 755 CD LYS A 47 14.406 27.394 -7.358 1.00 0.00 C ATOM 756 CE LYS A 47 14.478 28.065 -5.978 1.00 0.00 C ATOM 757 NZ LYS A 47 15.184 29.370 -6.034 1.00 0.00 N ATOM 0 H LYS A 47 9.843 25.828 -7.044 1.00 0.00 H new ATOM 0 HA LYS A 47 12.025 26.902 -8.745 1.00 0.00 H new ATOM 0 HB2 LYS A 47 12.158 26.472 -6.176 1.00 0.00 H new ATOM 0 HB3 LYS A 47 12.229 24.778 -6.620 1.00 0.00 H new ATOM 0 HG2 LYS A 47 14.501 25.412 -6.507 1.00 0.00 H new ATOM 0 HG3 LYS A 47 14.155 25.432 -8.225 1.00 0.00 H new ATOM 0 HD2 LYS A 47 15.389 27.430 -7.827 1.00 0.00 H new ATOM 0 HD3 LYS A 47 13.727 27.958 -7.997 1.00 0.00 H new ATOM 0 HE2 LYS A 47 13.469 28.214 -5.594 1.00 0.00 H new ATOM 0 HE3 LYS A 47 14.991 27.404 -5.279 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 14.804 30.002 -5.300 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 16.200 29.222 -5.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 15.042 29.801 -6.970 1.00 0.00 H new ATOM 771 N TRP A 48 11.965 24.927 -10.334 1.00 0.00 N ATOM 772 CA TRP A 48 12.129 23.771 -11.193 1.00 0.00 C ATOM 773 C TRP A 48 13.472 23.183 -10.778 1.00 0.00 C ATOM 774 O TRP A 48 14.525 23.764 -11.054 1.00 0.00 O ATOM 775 CB TRP A 48 12.084 24.180 -12.673 1.00 0.00 C ATOM 776 CG TRP A 48 12.226 23.087 -13.695 1.00 0.00 C ATOM 777 CD1 TRP A 48 12.288 21.757 -13.452 1.00 0.00 C ATOM 778 CD2 TRP A 48 12.312 23.215 -15.149 1.00 0.00 C ATOM 779 NE1 TRP A 48 12.391 21.060 -14.636 1.00 0.00 N ATOM 780 CE2 TRP A 48 12.409 21.910 -15.721 1.00 0.00 C ATOM 781 CE3 TRP A 48 12.295 24.305 -16.046 1.00 0.00 C ATOM 782 CZ2 TRP A 48 12.479 21.700 -17.106 1.00 0.00 C ATOM 783 CZ3 TRP A 48 12.363 24.108 -17.439 1.00 0.00 C ATOM 784 CH2 TRP A 48 12.451 22.808 -17.969 1.00 0.00 C ATOM 0 H TRP A 48 12.283 25.801 -10.753 1.00 0.00 H new ATOM 0 HA TRP A 48 11.330 23.038 -11.086 1.00 0.00 H new ATOM 0 HB2 TRP A 48 11.138 24.690 -12.853 1.00 0.00 H new ATOM 0 HB3 TRP A 48 12.876 24.908 -12.846 1.00 0.00 H new ATOM 0 HD1 TRP A 48 12.261 21.307 -12.471 1.00 0.00 H new ATOM 0 HE1 TRP A 48 12.447 20.044 -14.701 1.00 0.00 H new ATOM 0 HE3 TRP A 48 12.229 25.310 -15.656 1.00 0.00 H new ATOM 0 HZ2 TRP A 48 12.554 20.699 -17.504 1.00 0.00 H new ATOM 0 HZ3 TRP A 48 12.347 24.959 -18.103 1.00 0.00 H new ATOM 0 HH2 TRP A 48 12.497 22.662 -19.038 1.00 0.00 H new ATOM 795 N LYS A 49 13.441 22.061 -10.062 1.00 0.00 N ATOM 796 CA LYS A 49 14.635 21.331 -9.646 1.00 0.00 C ATOM 797 C LYS A 49 15.055 20.423 -10.803 1.00 0.00 C ATOM 798 O LYS A 49 14.955 19.198 -10.723 1.00 0.00 O ATOM 799 CB LYS A 49 14.354 20.575 -8.336 1.00 0.00 C ATOM 800 CG LYS A 49 13.983 21.549 -7.202 1.00 0.00 C ATOM 801 CD LYS A 49 14.166 20.982 -5.787 1.00 0.00 C ATOM 802 CE LYS A 49 13.596 19.566 -5.632 1.00 0.00 C ATOM 803 NZ LYS A 49 13.436 19.185 -4.208 1.00 0.00 N ATOM 0 H LYS A 49 12.572 21.627 -9.750 1.00 0.00 H new ATOM 0 HA LYS A 49 15.467 22.001 -9.429 1.00 0.00 H new ATOM 0 HB2 LYS A 49 13.542 19.865 -8.490 1.00 0.00 H new ATOM 0 HB3 LYS A 49 15.233 19.997 -8.050 1.00 0.00 H new ATOM 0 HG2 LYS A 49 14.591 22.449 -7.300 1.00 0.00 H new ATOM 0 HG3 LYS A 49 12.943 21.852 -7.326 1.00 0.00 H new ATOM 0 HD2 LYS A 49 15.228 20.970 -5.541 1.00 0.00 H new ATOM 0 HD3 LYS A 49 13.680 21.644 -5.070 1.00 0.00 H new ATOM 0 HE2 LYS A 49 12.630 19.507 -6.134 1.00 0.00 H new ATOM 0 HE3 LYS A 49 14.256 18.853 -6.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 13.313 18.155 -4.136 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 14.282 19.471 -3.675 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 12.601 19.662 -3.813 1.00 0.00 H new ATOM 817 N LYS A 50 15.425 21.033 -11.928 1.00 0.00 N ATOM 818 CA LYS A 50 15.727 20.329 -13.169 1.00 0.00 C ATOM 819 C LYS A 50 16.979 19.481 -12.953 1.00 0.00 C ATOM 820 O LYS A 50 17.955 19.972 -12.393 1.00 0.00 O ATOM 821 CB LYS A 50 15.924 21.371 -14.284 1.00 0.00 C ATOM 822 CG LYS A 50 15.960 20.727 -15.677 1.00 0.00 C ATOM 823 CD LYS A 50 16.108 21.793 -16.771 1.00 0.00 C ATOM 824 CE LYS A 50 16.123 21.124 -18.153 1.00 0.00 C ATOM 825 NZ LYS A 50 16.303 22.104 -19.254 1.00 0.00 N ATOM 0 H LYS A 50 15.524 22.045 -12.002 1.00 0.00 H new ATOM 0 HA LYS A 50 14.914 19.665 -13.463 1.00 0.00 H new ATOM 0 HB2 LYS A 50 15.116 22.101 -14.244 1.00 0.00 H new ATOM 0 HB3 LYS A 50 16.853 21.914 -14.112 1.00 0.00 H new ATOM 0 HG2 LYS A 50 16.790 20.023 -15.735 1.00 0.00 H new ATOM 0 HG3 LYS A 50 15.046 20.156 -15.842 1.00 0.00 H new ATOM 0 HD2 LYS A 50 15.285 22.505 -16.711 1.00 0.00 H new ATOM 0 HD3 LYS A 50 17.029 22.356 -16.620 1.00 0.00 H new ATOM 0 HE2 LYS A 50 16.927 20.389 -18.189 1.00 0.00 H new ATOM 0 HE3 LYS A 50 15.189 20.582 -18.302 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 16.306 21.605 -20.166 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 15.522 22.791 -19.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 17.206 22.604 -19.130 1.00 0.00 H new ATOM 957 N ILE A 58 20.557 17.690 -9.614 1.00 0.00 N ATOM 958 CA ILE A 58 19.541 18.731 -9.530 1.00 0.00 C ATOM 959 C ILE A 58 20.235 20.091 -9.635 1.00 0.00 C ATOM 960 O ILE A 58 21.306 20.330 -9.071 1.00 0.00 O ATOM 961 CB ILE A 58 18.661 18.538 -8.263 1.00 0.00 C ATOM 962 CG1 ILE A 58 17.498 17.550 -8.521 1.00 0.00 C ATOM 963 CG2 ILE A 58 18.017 19.836 -7.734 1.00 0.00 C ATOM 964 CD1 ILE A 58 17.881 16.219 -9.177 1.00 0.00 C ATOM 0 HA ILE A 58 18.837 18.671 -10.360 1.00 0.00 H new ATOM 0 HB ILE A 58 19.362 18.157 -7.520 1.00 0.00 H new ATOM 0 HG12 ILE A 58 17.011 17.337 -7.570 1.00 0.00 H new ATOM 0 HG13 ILE A 58 16.760 18.045 -9.153 1.00 0.00 H new ATOM 0 HG21 ILE A 58 17.421 19.612 -6.850 1.00 0.00 H new ATOM 0 HG22 ILE A 58 18.798 20.550 -7.474 1.00 0.00 H new ATOM 0 HG23 ILE A 58 17.376 20.265 -8.505 1.00 0.00 H new ATOM 0 HD11 ILE A 58 16.988 15.608 -9.309 1.00 0.00 H new ATOM 0 HD12 ILE A 58 18.337 16.410 -10.149 1.00 0.00 H new ATOM 0 HD13 ILE A 58 18.591 15.691 -8.541 1.00 0.00 H new ATOM 976 N GLU A 59 19.562 20.975 -10.352 1.00 0.00 N ATOM 977 CA GLU A 59 19.890 22.360 -10.596 1.00 0.00 C ATOM 978 C GLU A 59 18.583 23.111 -10.338 1.00 0.00 C ATOM 979 O GLU A 59 17.500 22.615 -10.661 1.00 0.00 O ATOM 980 CB GLU A 59 20.392 22.473 -12.039 1.00 0.00 C ATOM 981 CG GLU A 59 20.769 23.897 -12.448 1.00 0.00 C ATOM 982 CD GLU A 59 21.544 23.885 -13.773 1.00 0.00 C ATOM 983 OE1 GLU A 59 20.980 23.469 -14.812 1.00 0.00 O ATOM 984 OE2 GLU A 59 22.729 24.293 -13.758 1.00 0.00 O ATOM 0 H GLU A 59 18.694 20.712 -10.818 1.00 0.00 H new ATOM 0 HA GLU A 59 20.678 22.772 -9.965 1.00 0.00 H new ATOM 0 HB2 GLU A 59 21.261 21.826 -12.164 1.00 0.00 H new ATOM 0 HB3 GLU A 59 19.620 22.103 -12.713 1.00 0.00 H new ATOM 0 HG2 GLU A 59 19.869 24.503 -12.551 1.00 0.00 H new ATOM 0 HG3 GLU A 59 21.376 24.358 -11.668 1.00 0.00 H new ATOM 991 N GLU A 60 18.664 24.290 -9.728 1.00 0.00 N ATOM 992 CA GLU A 60 17.497 24.994 -9.215 1.00 0.00 C ATOM 993 C GLU A 60 17.244 26.241 -10.054 1.00 0.00 C ATOM 994 O GLU A 60 17.903 27.270 -9.883 1.00 0.00 O ATOM 995 CB GLU A 60 17.716 25.285 -7.722 1.00 0.00 C ATOM 996 CG GLU A 60 17.540 24.003 -6.901 1.00 0.00 C ATOM 997 CD GLU A 60 17.792 24.250 -5.403 1.00 0.00 C ATOM 998 OE1 GLU A 60 16.846 24.618 -4.672 1.00 0.00 O ATOM 999 OE2 GLU A 60 18.940 24.066 -4.937 1.00 0.00 O ATOM 0 H GLU A 60 19.544 24.784 -9.576 1.00 0.00 H new ATOM 0 HA GLU A 60 16.595 24.387 -9.295 1.00 0.00 H new ATOM 0 HB2 GLU A 60 18.716 25.691 -7.566 1.00 0.00 H new ATOM 0 HB3 GLU A 60 17.008 26.042 -7.384 1.00 0.00 H new ATOM 0 HG2 GLU A 60 16.531 23.616 -7.042 1.00 0.00 H new ATOM 0 HG3 GLU A 60 18.228 23.240 -7.265 1.00 0.00 H new ATOM 1006 N LYS A 61 16.287 26.131 -10.978 1.00 0.00 N ATOM 1007 CA LYS A 61 15.792 27.261 -11.762 1.00 0.00 C ATOM 1008 C LYS A 61 14.588 27.819 -11.020 1.00 0.00 C ATOM 1009 O LYS A 61 13.757 27.046 -10.546 1.00 0.00 O ATOM 1010 CB LYS A 61 15.380 26.782 -13.163 1.00 0.00 C ATOM 1011 CG LYS A 61 16.589 26.421 -14.039 1.00 0.00 C ATOM 1012 CD LYS A 61 16.187 25.629 -15.294 1.00 0.00 C ATOM 1013 CE LYS A 61 15.238 26.350 -16.267 1.00 0.00 C ATOM 1014 NZ LYS A 61 15.814 27.592 -16.839 1.00 0.00 N ATOM 0 H LYS A 61 15.831 25.247 -11.204 1.00 0.00 H new ATOM 0 HA LYS A 61 16.560 28.025 -11.882 1.00 0.00 H new ATOM 0 HB2 LYS A 61 14.730 25.912 -13.070 1.00 0.00 H new ATOM 0 HB3 LYS A 61 14.799 27.563 -13.654 1.00 0.00 H new ATOM 0 HG2 LYS A 61 17.103 27.334 -14.338 1.00 0.00 H new ATOM 0 HG3 LYS A 61 17.296 25.834 -13.453 1.00 0.00 H new ATOM 0 HD2 LYS A 61 17.094 25.358 -15.835 1.00 0.00 H new ATOM 0 HD3 LYS A 61 15.714 24.699 -14.978 1.00 0.00 H new ATOM 0 HE2 LYS A 61 14.978 25.671 -17.079 1.00 0.00 H new ATOM 0 HE3 LYS A 61 14.312 26.594 -15.746 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 15.645 27.613 -17.865 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 15.364 28.419 -16.397 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 16.838 27.616 -16.656 1.00 0.00 H new ATOM 1028 N THR A 62 14.459 29.135 -10.930 1.00 0.00 N ATOM 1029 CA THR A 62 13.303 29.765 -10.298 1.00 0.00 C ATOM 1030 C THR A 62 12.347 30.146 -11.421 1.00 0.00 C ATOM 1031 O THR A 62 12.761 30.827 -12.364 1.00 0.00 O ATOM 1032 CB THR A 62 13.770 30.954 -9.447 1.00 0.00 C ATOM 1033 OG1 THR A 62 14.827 30.546 -8.595 1.00 0.00 O ATOM 1034 CG2 THR A 62 12.653 31.465 -8.545 1.00 0.00 C ATOM 0 H THR A 62 15.148 29.795 -11.290 1.00 0.00 H new ATOM 0 HA THR A 62 12.779 29.102 -9.610 1.00 0.00 H new ATOM 0 HB THR A 62 14.084 31.738 -10.136 1.00 0.00 H new ATOM 0 HG1 THR A 62 15.230 31.334 -8.173 1.00 0.00 H new ATOM 0 HG21 THR A 62 13.017 32.307 -7.956 1.00 0.00 H new ATOM 0 HG22 THR A 62 11.810 31.788 -9.157 1.00 0.00 H new ATOM 0 HG23 THR A 62 12.331 30.667 -7.876 1.00 0.00 H new ATOM 1042 N VAL A 63 11.091 29.698 -11.354 1.00 0.00 N ATOM 1043 CA VAL A 63 10.156 29.804 -12.464 1.00 0.00 C ATOM 1044 C VAL A 63 8.765 30.194 -11.961 1.00 0.00 C ATOM 1045 O VAL A 63 8.403 29.984 -10.803 1.00 0.00 O ATOM 1046 CB VAL A 63 10.115 28.477 -13.272 1.00 0.00 C ATOM 1047 CG1 VAL A 63 11.503 27.977 -13.716 1.00 0.00 C ATOM 1048 CG2 VAL A 63 9.448 27.313 -12.519 1.00 0.00 C ATOM 0 H VAL A 63 10.698 29.252 -10.525 1.00 0.00 H new ATOM 0 HA VAL A 63 10.500 30.592 -13.134 1.00 0.00 H new ATOM 0 HB VAL A 63 9.519 28.751 -14.142 1.00 0.00 H new ATOM 0 HG11 VAL A 63 11.393 27.047 -14.274 1.00 0.00 H new ATOM 0 HG12 VAL A 63 11.974 28.728 -14.350 1.00 0.00 H new ATOM 0 HG13 VAL A 63 12.125 27.802 -12.838 1.00 0.00 H new ATOM 0 HG21 VAL A 63 9.457 26.421 -13.146 1.00 0.00 H new ATOM 0 HG22 VAL A 63 9.996 27.114 -11.598 1.00 0.00 H new ATOM 0 HG23 VAL A 63 8.418 27.578 -12.279 1.00 0.00 H new ATOM 1058 N GLU A 64 7.970 30.759 -12.855 1.00 0.00 N ATOM 1059 CA GLU A 64 6.548 30.997 -12.672 1.00 0.00 C ATOM 1060 C GLU A 64 5.868 29.942 -13.539 1.00 0.00 C ATOM 1061 O GLU A 64 6.157 29.862 -14.733 1.00 0.00 O ATOM 1062 CB GLU A 64 6.186 32.429 -13.098 1.00 0.00 C ATOM 1063 CG GLU A 64 4.690 32.712 -12.900 1.00 0.00 C ATOM 1064 CD GLU A 64 4.363 34.197 -13.139 1.00 0.00 C ATOM 1065 OE1 GLU A 64 4.236 34.623 -14.309 1.00 0.00 O ATOM 1066 OE2 GLU A 64 4.215 34.955 -12.153 1.00 0.00 O ATOM 0 H GLU A 64 8.311 31.076 -13.763 1.00 0.00 H new ATOM 0 HA GLU A 64 6.230 30.915 -11.633 1.00 0.00 H new ATOM 0 HB2 GLU A 64 6.772 33.142 -12.518 1.00 0.00 H new ATOM 0 HB3 GLU A 64 6.450 32.576 -14.145 1.00 0.00 H new ATOM 0 HG2 GLU A 64 4.108 32.095 -13.584 1.00 0.00 H new ATOM 0 HG3 GLU A 64 4.396 32.431 -11.889 1.00 0.00 H new ATOM 1073 N VAL A 65 5.019 29.098 -12.957 1.00 0.00 N ATOM 1074 CA VAL A 65 4.209 28.155 -13.717 1.00 0.00 C ATOM 1075 C VAL A 65 2.992 28.914 -14.235 1.00 0.00 C ATOM 1076 O VAL A 65 2.366 29.668 -13.485 1.00 0.00 O ATOM 1077 CB VAL A 65 3.838 26.875 -12.927 1.00 0.00 C ATOM 1078 CG1 VAL A 65 4.970 26.398 -11.999 1.00 0.00 C ATOM 1079 CG2 VAL A 65 2.520 26.914 -12.143 1.00 0.00 C ATOM 0 H VAL A 65 4.875 29.050 -11.948 1.00 0.00 H new ATOM 0 HA VAL A 65 4.791 27.770 -14.554 1.00 0.00 H new ATOM 0 HB VAL A 65 3.684 26.154 -13.730 1.00 0.00 H new ATOM 0 HG11 VAL A 65 4.653 25.498 -11.472 1.00 0.00 H new ATOM 0 HG12 VAL A 65 5.858 26.178 -12.592 1.00 0.00 H new ATOM 0 HG13 VAL A 65 5.201 27.180 -11.276 1.00 0.00 H new ATOM 0 HG21 VAL A 65 2.372 25.962 -11.633 1.00 0.00 H new ATOM 0 HG22 VAL A 65 2.558 27.718 -11.408 1.00 0.00 H new ATOM 0 HG23 VAL A 65 1.693 27.090 -12.831 1.00 0.00 H new ATOM 1089 N LEU A 66 2.645 28.702 -15.502 1.00 0.00 N ATOM 1090 CA LEU A 66 1.497 29.345 -16.127 1.00 0.00 C ATOM 1091 C LEU A 66 0.261 28.450 -16.026 1.00 0.00 C ATOM 1092 O LEU A 66 -0.859 28.960 -16.040 1.00 0.00 O ATOM 1093 CB LEU A 66 1.788 29.692 -17.600 1.00 0.00 C ATOM 1094 CG LEU A 66 2.934 30.692 -17.872 1.00 0.00 C ATOM 1095 CD1 LEU A 66 2.907 31.909 -16.938 1.00 0.00 C ATOM 1096 CD2 LEU A 66 4.319 30.041 -17.801 1.00 0.00 C ATOM 0 H LEU A 66 3.156 28.076 -16.125 1.00 0.00 H new ATOM 0 HA LEU A 66 1.301 30.275 -15.593 1.00 0.00 H new ATOM 0 HB2 LEU A 66 2.014 28.766 -18.128 1.00 0.00 H new ATOM 0 HB3 LEU A 66 0.876 30.095 -18.040 1.00 0.00 H new ATOM 0 HG LEU A 66 2.756 31.034 -18.892 1.00 0.00 H new ATOM 0 HD11 LEU A 66 3.737 32.572 -17.181 1.00 0.00 H new ATOM 0 HD12 LEU A 66 1.966 32.444 -17.065 1.00 0.00 H new ATOM 0 HD13 LEU A 66 2.999 31.576 -15.904 1.00 0.00 H new ATOM 0 HD21 LEU A 66 5.084 30.791 -18.000 1.00 0.00 H new ATOM 0 HD22 LEU A 66 4.473 29.621 -16.807 1.00 0.00 H new ATOM 0 HD23 LEU A 66 4.387 29.247 -18.545 1.00 0.00 H new ATOM 1108 N GLY A 67 0.446 27.132 -15.908 1.00 0.00 N ATOM 1109 CA GLY A 67 -0.620 26.156 -15.833 1.00 0.00 C ATOM 1110 C GLY A 67 -0.081 24.787 -16.207 1.00 0.00 C ATOM 1111 O GLY A 67 1.091 24.641 -16.565 1.00 0.00 O ATOM 0 H GLY A 67 1.374 26.712 -15.861 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -1.035 26.132 -14.825 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -1.431 26.435 -16.506 1.00 0.00 H new ATOM 1115 N MET A 68 -0.940 23.778 -16.116 1.00 0.00 N ATOM 1116 CA MET A 68 -0.645 22.449 -16.641 1.00 0.00 C ATOM 1117 C MET A 68 -0.431 22.545 -18.154 1.00 0.00 C ATOM 1118 O MET A 68 -1.040 23.382 -18.829 1.00 0.00 O ATOM 1119 CB MET A 68 -1.780 21.463 -16.322 1.00 0.00 C ATOM 1120 CG MET A 68 -1.931 21.155 -14.826 1.00 0.00 C ATOM 1121 SD MET A 68 -0.586 20.189 -14.078 1.00 0.00 S ATOM 1122 CE MET A 68 -0.902 18.555 -14.798 1.00 0.00 C ATOM 0 H MET A 68 -1.858 23.857 -15.678 1.00 0.00 H new ATOM 0 HA MET A 68 0.261 22.073 -16.165 1.00 0.00 H new ATOM 0 HB2 MET A 68 -2.719 21.871 -16.696 1.00 0.00 H new ATOM 0 HB3 MET A 68 -1.601 20.531 -16.859 1.00 0.00 H new ATOM 0 HG2 MET A 68 -2.019 22.098 -14.287 1.00 0.00 H new ATOM 0 HG3 MET A 68 -2.866 20.615 -14.678 1.00 0.00 H new ATOM 0 HE1 MET A 68 -0.225 17.825 -14.354 1.00 0.00 H new ATOM 0 HE2 MET A 68 -1.933 18.263 -14.598 1.00 0.00 H new ATOM 0 HE3 MET A 68 -0.738 18.594 -15.875 1.00 0.00 H new ATOM 1132 N ALA A 69 0.429 21.675 -18.683 1.00 0.00 N ATOM 1133 CA ALA A 69 0.626 21.520 -20.118 1.00 0.00 C ATOM 1134 C ALA A 69 -0.660 20.983 -20.786 1.00 0.00 C ATOM 1135 O ALA A 69 -1.562 20.519 -20.080 1.00 0.00 O ATOM 1136 CB ALA A 69 1.818 20.582 -20.339 1.00 0.00 C ATOM 0 H ALA A 69 1.011 21.055 -18.121 1.00 0.00 H new ATOM 0 HA ALA A 69 0.840 22.484 -20.580 1.00 0.00 H new ATOM 0 HB1 ALA A 69 1.985 20.451 -21.408 1.00 0.00 H new ATOM 0 HB2 ALA A 69 2.709 21.013 -19.883 1.00 0.00 H new ATOM 0 HB3 ALA A 69 1.609 19.614 -19.883 1.00 0.00 H new ATOM 1142 N PRO A 70 -0.766 21.025 -22.129 1.00 0.00 N ATOM 1143 CA PRO A 70 -1.859 20.394 -22.861 1.00 0.00 C ATOM 1144 C PRO A 70 -2.051 18.921 -22.489 1.00 0.00 C ATOM 1145 O PRO A 70 -1.101 18.228 -22.109 1.00 0.00 O ATOM 1146 CB PRO A 70 -1.505 20.543 -24.345 1.00 0.00 C ATOM 1147 CG PRO A 70 -0.638 21.798 -24.373 1.00 0.00 C ATOM 1148 CD PRO A 70 0.126 21.709 -23.054 1.00 0.00 C ATOM 0 HA PRO A 70 -2.806 20.873 -22.613 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -0.966 19.673 -24.720 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -2.396 20.656 -24.962 1.00 0.00 H new ATOM 0 HG2 PRO A 70 0.035 21.806 -25.231 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -1.240 22.705 -24.432 1.00 0.00 H new ATOM 0 HD2 PRO A 70 1.059 21.159 -23.178 1.00 0.00 H new ATOM 0 HD3 PRO A 70 0.388 22.701 -22.685 1.00 0.00 H new ATOM 1156 N ASP A 71 -3.268 18.413 -22.688 1.00 0.00 N ATOM 1157 CA ASP A 71 -3.600 17.009 -22.448 1.00 0.00 C ATOM 1158 C ASP A 71 -2.721 16.072 -23.279 1.00 0.00 C ATOM 1159 O ASP A 71 -2.362 14.997 -22.808 1.00 0.00 O ATOM 1160 CB ASP A 71 -5.088 16.734 -22.719 1.00 0.00 C ATOM 1161 CG ASP A 71 -5.409 16.502 -24.206 1.00 0.00 C ATOM 1162 OD1 ASP A 71 -5.424 17.487 -24.979 1.00 0.00 O ATOM 1163 OD2 ASP A 71 -5.686 15.349 -24.603 1.00 0.00 O ATOM 0 H ASP A 71 -4.056 18.968 -23.022 1.00 0.00 H new ATOM 0 HA ASP A 71 -3.402 16.808 -21.395 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -5.397 15.859 -22.148 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -5.677 17.576 -22.356 1.00 0.00 H new ATOM 1168 N ASP A 72 -2.313 16.493 -24.481 1.00 0.00 N ATOM 1169 CA ASP A 72 -1.464 15.692 -25.362 1.00 0.00 C ATOM 1170 C ASP A 72 -0.053 15.510 -24.792 1.00 0.00 C ATOM 1171 O ASP A 72 0.595 14.497 -25.055 1.00 0.00 O ATOM 1172 CB ASP A 72 -1.389 16.343 -26.747 1.00 0.00 C ATOM 1173 CG ASP A 72 -0.546 15.496 -27.717 1.00 0.00 C ATOM 1174 OD1 ASP A 72 -0.991 14.392 -28.104 1.00 0.00 O ATOM 1175 OD2 ASP A 72 0.539 15.951 -28.142 1.00 0.00 O ATOM 0 H ASP A 72 -2.564 17.402 -24.869 1.00 0.00 H new ATOM 0 HA ASP A 72 -1.915 14.703 -25.444 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -2.395 16.466 -27.148 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -0.956 17.340 -26.660 1.00 0.00 H new ATOM 1180 N GLU A 73 0.417 16.459 -23.976 1.00 0.00 N ATOM 1181 CA GLU A 73 1.661 16.308 -23.227 1.00 0.00 C ATOM 1182 C GLU A 73 1.394 15.454 -21.985 1.00 0.00 C ATOM 1183 O GLU A 73 2.179 14.564 -21.657 1.00 0.00 O ATOM 1184 CB GLU A 73 2.216 17.679 -22.798 1.00 0.00 C ATOM 1185 CG GLU A 73 2.546 18.625 -23.963 1.00 0.00 C ATOM 1186 CD GLU A 73 3.567 18.046 -24.962 1.00 0.00 C ATOM 1187 OE1 GLU A 73 4.615 17.506 -24.540 1.00 0.00 O ATOM 1188 OE2 GLU A 73 3.352 18.163 -26.189 1.00 0.00 O ATOM 0 H GLU A 73 -0.055 17.349 -23.819 1.00 0.00 H new ATOM 0 HA GLU A 73 2.400 15.825 -23.867 1.00 0.00 H new ATOM 0 HB2 GLU A 73 1.488 18.164 -22.147 1.00 0.00 H new ATOM 0 HB3 GLU A 73 3.118 17.523 -22.206 1.00 0.00 H new ATOM 0 HG2 GLU A 73 1.626 18.865 -24.496 1.00 0.00 H new ATOM 0 HG3 GLU A 73 2.935 19.560 -23.561 1.00 0.00 H new ATOM 1195 N CYS A 74 0.257 15.676 -21.317 1.00 0.00 N ATOM 1196 CA CYS A 74 -0.058 15.065 -20.029 1.00 0.00 C ATOM 1197 C CYS A 74 -0.525 13.607 -20.159 1.00 0.00 C ATOM 1198 O CYS A 74 -0.993 13.001 -19.196 1.00 0.00 O ATOM 1199 CB CYS A 74 -1.064 15.927 -19.264 1.00 0.00 C ATOM 1200 SG CYS A 74 -0.345 17.569 -18.973 1.00 0.00 S ATOM 0 H CYS A 74 -0.477 16.294 -21.663 1.00 0.00 H new ATOM 0 HA CYS A 74 0.865 15.024 -19.451 1.00 0.00 H new ATOM 0 HB2 CYS A 74 -1.990 16.018 -19.833 1.00 0.00 H new ATOM 0 HB3 CYS A 74 -1.318 15.455 -18.315 1.00 0.00 H new ATOM 0 HG CYS A 74 -0.423 18.276 -20.061 1.00 0.00 H new ATOM 1206 N LEU A 75 -0.420 13.053 -21.365 1.00 0.00 N ATOM 1207 CA LEU A 75 -0.857 11.723 -21.748 1.00 0.00 C ATOM 1208 C LEU A 75 0.087 10.649 -21.194 1.00 0.00 C ATOM 1209 O LEU A 75 -0.319 9.496 -21.057 1.00 0.00 O ATOM 1210 CB LEU A 75 -0.914 11.691 -23.290 1.00 0.00 C ATOM 1211 CG LEU A 75 -2.117 10.981 -23.930 1.00 0.00 C ATOM 1212 CD1 LEU A 75 -2.144 9.473 -23.669 1.00 0.00 C ATOM 1213 CD2 LEU A 75 -3.462 11.592 -23.524 1.00 0.00 C ATOM 0 H LEU A 75 -0.000 13.557 -22.146 1.00 0.00 H new ATOM 0 HA LEU A 75 -1.840 11.505 -21.330 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -0.897 12.719 -23.651 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -0.005 11.211 -23.652 1.00 0.00 H new ATOM 0 HG LEU A 75 -1.976 11.137 -24.999 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -3.019 9.036 -24.149 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -1.241 9.017 -24.076 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -2.190 9.290 -22.595 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -4.271 11.046 -24.009 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -3.579 11.528 -22.442 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -3.494 12.637 -23.831 1.00 0.00 H new ATOM 1225 N LYS A 76 1.337 11.012 -20.869 1.00 0.00 N ATOM 1226 CA LYS A 76 2.377 10.058 -20.474 1.00 0.00 C ATOM 1227 C LYS A 76 2.998 10.390 -19.119 1.00 0.00 C ATOM 1228 O LYS A 76 3.458 9.475 -18.435 1.00 0.00 O ATOM 1229 CB LYS A 76 3.471 9.986 -21.557 1.00 0.00 C ATOM 1230 CG LYS A 76 2.995 9.512 -22.943 1.00 0.00 C ATOM 1231 CD LYS A 76 2.460 8.069 -22.948 1.00 0.00 C ATOM 1232 CE LYS A 76 2.028 7.606 -24.349 1.00 0.00 C ATOM 1233 NZ LYS A 76 3.169 7.433 -25.285 1.00 0.00 N ATOM 0 H LYS A 76 1.654 11.982 -20.874 1.00 0.00 H new ATOM 0 HA LYS A 76 1.895 9.085 -20.373 1.00 0.00 H new ATOM 0 HB2 LYS A 76 3.919 10.974 -21.663 1.00 0.00 H new ATOM 0 HB3 LYS A 76 4.257 9.315 -21.212 1.00 0.00 H new ATOM 0 HG2 LYS A 76 2.213 10.182 -23.298 1.00 0.00 H new ATOM 0 HG3 LYS A 76 3.823 9.587 -23.648 1.00 0.00 H new ATOM 0 HD2 LYS A 76 3.231 7.398 -22.569 1.00 0.00 H new ATOM 0 HD3 LYS A 76 1.612 7.997 -22.267 1.00 0.00 H new ATOM 0 HE2 LYS A 76 1.490 6.662 -24.263 1.00 0.00 H new ATOM 0 HE3 LYS A 76 1.331 8.333 -24.766 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 2.816 7.104 -26.206 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 3.659 8.342 -25.407 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 3.832 6.731 -24.898 1.00 0.00 H new ATOM 1247 N ASP A 77 3.011 11.659 -18.713 1.00 0.00 N ATOM 1248 CA ASP A 77 3.551 12.127 -17.435 1.00 0.00 C ATOM 1249 C ASP A 77 2.937 13.504 -17.164 1.00 0.00 C ATOM 1250 O ASP A 77 2.393 14.109 -18.086 1.00 0.00 O ATOM 1251 CB ASP A 77 5.087 12.210 -17.516 1.00 0.00 C ATOM 1252 CG ASP A 77 5.772 12.521 -16.174 1.00 0.00 C ATOM 1253 OD1 ASP A 77 5.131 12.388 -15.111 1.00 0.00 O ATOM 1254 OD2 ASP A 77 6.983 12.835 -16.192 1.00 0.00 O ATOM 0 H ASP A 77 2.633 12.416 -19.283 1.00 0.00 H new ATOM 0 HA ASP A 77 3.305 11.441 -16.624 1.00 0.00 H new ATOM 0 HB2 ASP A 77 5.471 11.264 -17.897 1.00 0.00 H new ATOM 0 HB3 ASP A 77 5.361 12.979 -18.238 1.00 0.00 H new ATOM 1259 N MET A 78 2.966 14.002 -15.932 1.00 0.00 N ATOM 1260 CA MET A 78 2.385 15.288 -15.566 1.00 0.00 C ATOM 1261 C MET A 78 3.385 16.400 -15.901 1.00 0.00 C ATOM 1262 O MET A 78 4.543 16.342 -15.475 1.00 0.00 O ATOM 1263 CB MET A 78 2.054 15.268 -14.067 1.00 0.00 C ATOM 1264 CG MET A 78 0.759 14.518 -13.712 1.00 0.00 C ATOM 1265 SD MET A 78 0.502 12.824 -14.333 1.00 0.00 S ATOM 1266 CE MET A 78 -0.499 13.134 -15.815 1.00 0.00 C ATOM 0 H MET A 78 3.401 13.515 -15.148 1.00 0.00 H new ATOM 0 HA MET A 78 1.467 15.474 -16.123 1.00 0.00 H new ATOM 0 HB2 MET A 78 2.884 14.809 -13.530 1.00 0.00 H new ATOM 0 HB3 MET A 78 1.974 16.295 -13.711 1.00 0.00 H new ATOM 0 HG2 MET A 78 0.691 14.481 -12.625 1.00 0.00 H new ATOM 0 HG3 MET A 78 -0.076 15.124 -14.063 1.00 0.00 H new ATOM 0 HE1 MET A 78 -0.882 12.189 -16.200 1.00 0.00 H new ATOM 0 HE2 MET A 78 -1.334 13.787 -15.560 1.00 0.00 H new ATOM 0 HE3 MET A 78 0.117 13.613 -16.576 1.00 0.00 H new ATOM 1276 N TYR A 79 2.936 17.445 -16.604 1.00 0.00 N ATOM 1277 CA TYR A 79 3.780 18.553 -17.046 1.00 0.00 C ATOM 1278 C TYR A 79 3.064 19.885 -16.829 1.00 0.00 C ATOM 1279 O TYR A 79 1.833 19.948 -16.785 1.00 0.00 O ATOM 1280 CB TYR A 79 4.119 18.418 -18.541 1.00 0.00 C ATOM 1281 CG TYR A 79 4.937 17.218 -18.974 1.00 0.00 C ATOM 1282 CD1 TYR A 79 6.344 17.256 -18.935 1.00 0.00 C ATOM 1283 CD2 TYR A 79 4.286 16.096 -19.518 1.00 0.00 C ATOM 1284 CE1 TYR A 79 7.095 16.173 -19.429 1.00 0.00 C ATOM 1285 CE2 TYR A 79 5.027 15.009 -20.006 1.00 0.00 C ATOM 1286 CZ TYR A 79 6.439 15.038 -19.960 1.00 0.00 C ATOM 1287 OH TYR A 79 7.169 13.987 -20.429 1.00 0.00 O ATOM 0 H TYR A 79 1.960 17.543 -16.885 1.00 0.00 H new ATOM 0 HA TYR A 79 4.699 18.524 -16.460 1.00 0.00 H new ATOM 0 HB2 TYR A 79 3.182 18.403 -19.097 1.00 0.00 H new ATOM 0 HB3 TYR A 79 4.656 19.317 -18.845 1.00 0.00 H new ATOM 0 HD1 TYR A 79 6.848 18.119 -18.525 1.00 0.00 H new ATOM 0 HD2 TYR A 79 3.207 16.071 -19.560 1.00 0.00 H new ATOM 0 HE1 TYR A 79 8.174 16.209 -19.403 1.00 0.00 H new ATOM 0 HE2 TYR A 79 4.518 14.150 -20.417 1.00 0.00 H new ATOM 0 HH TYR A 79 6.564 13.289 -20.758 1.00 0.00 H new ATOM 1297 N VAL A 80 3.850 20.955 -16.761 1.00 0.00 N ATOM 1298 CA VAL A 80 3.408 22.318 -16.517 1.00 0.00 C ATOM 1299 C VAL A 80 4.189 23.230 -17.454 1.00 0.00 C ATOM 1300 O VAL A 80 5.373 23.002 -17.707 1.00 0.00 O ATOM 1301 CB VAL A 80 3.613 22.710 -15.033 1.00 0.00 C ATOM 1302 CG1 VAL A 80 2.462 22.199 -14.159 1.00 0.00 C ATOM 1303 CG2 VAL A 80 4.935 22.204 -14.428 1.00 0.00 C ATOM 0 H VAL A 80 4.861 20.889 -16.881 1.00 0.00 H new ATOM 0 HA VAL A 80 2.340 22.414 -16.714 1.00 0.00 H new ATOM 0 HB VAL A 80 3.642 23.800 -15.039 1.00 0.00 H new ATOM 0 HG11 VAL A 80 2.635 22.490 -13.123 1.00 0.00 H new ATOM 0 HG12 VAL A 80 1.523 22.631 -14.505 1.00 0.00 H new ATOM 0 HG13 VAL A 80 2.409 21.112 -14.227 1.00 0.00 H new ATOM 0 HG21 VAL A 80 5.003 22.520 -13.387 1.00 0.00 H new ATOM 0 HG22 VAL A 80 4.966 21.116 -14.480 1.00 0.00 H new ATOM 0 HG23 VAL A 80 5.773 22.618 -14.988 1.00 0.00 H new ATOM 1313 N GLU A 81 3.522 24.248 -17.986 1.00 0.00 N ATOM 1314 CA GLU A 81 4.181 25.318 -18.720 1.00 0.00 C ATOM 1315 C GLU A 81 4.796 26.250 -17.679 1.00 0.00 C ATOM 1316 O GLU A 81 4.130 26.589 -16.695 1.00 0.00 O ATOM 1317 CB GLU A 81 3.178 26.076 -19.600 1.00 0.00 C ATOM 1318 CG GLU A 81 2.653 25.204 -20.748 1.00 0.00 C ATOM 1319 CD GLU A 81 1.758 26.010 -21.706 1.00 0.00 C ATOM 1320 OE1 GLU A 81 0.550 26.182 -21.424 1.00 0.00 O ATOM 1321 OE2 GLU A 81 2.249 26.466 -22.764 1.00 0.00 O ATOM 0 H GLU A 81 2.510 24.353 -17.920 1.00 0.00 H new ATOM 0 HA GLU A 81 4.945 24.917 -19.386 1.00 0.00 H new ATOM 0 HB2 GLU A 81 2.341 26.414 -18.989 1.00 0.00 H new ATOM 0 HB3 GLU A 81 3.654 26.967 -20.009 1.00 0.00 H new ATOM 0 HG2 GLU A 81 3.493 24.784 -21.301 1.00 0.00 H new ATOM 0 HG3 GLU A 81 2.089 24.365 -20.340 1.00 0.00 H new ATOM 1328 N VAL A 82 6.044 26.675 -17.877 1.00 0.00 N ATOM 1329 CA VAL A 82 6.777 27.476 -16.903 1.00 0.00 C ATOM 1330 C VAL A 82 7.598 28.535 -17.633 1.00 0.00 C ATOM 1331 O VAL A 82 8.066 28.295 -18.744 1.00 0.00 O ATOM 1332 CB VAL A 82 7.652 26.590 -15.981 1.00 0.00 C ATOM 1333 CG1 VAL A 82 6.858 25.470 -15.289 1.00 0.00 C ATOM 1334 CG2 VAL A 82 8.856 25.943 -16.684 1.00 0.00 C ATOM 0 H VAL A 82 6.576 26.471 -18.723 1.00 0.00 H new ATOM 0 HA VAL A 82 6.066 27.982 -16.250 1.00 0.00 H new ATOM 0 HB VAL A 82 8.018 27.301 -15.240 1.00 0.00 H new ATOM 0 HG11 VAL A 82 7.528 24.886 -14.658 1.00 0.00 H new ATOM 0 HG12 VAL A 82 6.071 25.908 -14.675 1.00 0.00 H new ATOM 0 HG13 VAL A 82 6.412 24.821 -16.043 1.00 0.00 H new ATOM 0 HG21 VAL A 82 9.415 25.340 -15.968 1.00 0.00 H new ATOM 0 HG22 VAL A 82 8.504 25.308 -17.497 1.00 0.00 H new ATOM 0 HG23 VAL A 82 9.504 26.722 -17.086 1.00 0.00 H new ATOM 1344 N ALA A 83 7.817 29.688 -17.011 1.00 0.00 N ATOM 1345 CA ALA A 83 8.643 30.763 -17.535 1.00 0.00 C ATOM 1346 C ALA A 83 9.685 31.060 -16.469 1.00 0.00 C ATOM 1347 O ALA A 83 9.350 31.205 -15.293 1.00 0.00 O ATOM 1348 CB ALA A 83 7.787 31.994 -17.848 1.00 0.00 C ATOM 0 H ALA A 83 7.411 29.904 -16.101 1.00 0.00 H new ATOM 0 HA ALA A 83 9.125 30.480 -18.471 1.00 0.00 H new ATOM 0 HB1 ALA A 83 8.422 32.789 -18.239 1.00 0.00 H new ATOM 0 HB2 ALA A 83 7.033 31.733 -18.591 1.00 0.00 H new ATOM 0 HB3 ALA A 83 7.296 32.337 -16.937 1.00 0.00 H new ATOM 1354 N ASP A 84 10.952 31.090 -16.868 1.00 0.00 N ATOM 1355 CA ASP A 84 12.054 31.347 -15.947 1.00 0.00 C ATOM 1356 C ASP A 84 11.952 32.785 -15.427 1.00 0.00 C ATOM 1357 O ASP A 84 11.625 33.689 -16.198 1.00 0.00 O ATOM 1358 CB ASP A 84 13.387 31.073 -16.651 1.00 0.00 C ATOM 1359 CG ASP A 84 14.542 30.983 -15.649 1.00 0.00 C ATOM 1360 OD1 ASP A 84 14.882 32.013 -15.035 1.00 0.00 O ATOM 1361 OD2 ASP A 84 15.110 29.877 -15.499 1.00 0.00 O ATOM 0 H ASP A 84 11.243 30.938 -17.834 1.00 0.00 H new ATOM 0 HA ASP A 84 11.999 30.679 -15.087 1.00 0.00 H new ATOM 0 HB2 ASP A 84 13.318 30.142 -17.213 1.00 0.00 H new ATOM 0 HB3 ASP A 84 13.589 31.866 -17.371 1.00 0.00 H new ATOM 1366 N ILE A 85 12.202 32.993 -14.132 1.00 0.00 N ATOM 1367 CA ILE A 85 12.196 34.305 -13.486 1.00 0.00 C ATOM 1368 C ILE A 85 13.647 34.736 -13.224 1.00 0.00 C ATOM 1369 O ILE A 85 14.017 35.867 -13.543 1.00 0.00 O ATOM 1370 CB ILE A 85 11.393 34.272 -12.158 1.00 0.00 C ATOM 1371 CG1 ILE A 85 9.979 33.656 -12.277 1.00 0.00 C ATOM 1372 CG2 ILE A 85 11.259 35.697 -11.587 1.00 0.00 C ATOM 1373 CD1 ILE A 85 9.360 33.355 -10.903 1.00 0.00 C ATOM 0 H ILE A 85 12.420 32.233 -13.488 1.00 0.00 H new ATOM 0 HA ILE A 85 11.710 35.024 -14.145 1.00 0.00 H new ATOM 0 HB ILE A 85 11.965 33.624 -11.494 1.00 0.00 H new ATOM 0 HG12 ILE A 85 9.331 34.341 -12.823 1.00 0.00 H new ATOM 0 HG13 ILE A 85 10.033 32.736 -12.859 1.00 0.00 H new ATOM 0 HG21 ILE A 85 10.694 35.664 -10.655 1.00 0.00 H new ATOM 0 HG22 ILE A 85 12.251 36.107 -11.396 1.00 0.00 H new ATOM 0 HG23 ILE A 85 10.737 36.329 -12.305 1.00 0.00 H new ATOM 0 HD11 ILE A 85 8.368 32.924 -11.037 1.00 0.00 H new ATOM 0 HD12 ILE A 85 9.993 32.649 -10.366 1.00 0.00 H new ATOM 0 HD13 ILE A 85 9.280 34.279 -10.330 1.00 0.00 H new ATOM 1457 N VAL A 92 8.936 30.989 -22.562 1.00 0.00 N ATOM 1458 CA VAL A 92 8.247 29.957 -21.802 1.00 0.00 C ATOM 1459 C VAL A 92 8.709 28.571 -22.273 1.00 0.00 C ATOM 1460 O VAL A 92 9.171 28.389 -23.404 1.00 0.00 O ATOM 1461 CB VAL A 92 6.725 30.201 -21.934 1.00 0.00 C ATOM 1462 CG1 VAL A 92 6.207 30.099 -23.379 1.00 0.00 C ATOM 1463 CG2 VAL A 92 5.864 29.310 -21.031 1.00 0.00 C ATOM 0 HA VAL A 92 8.490 29.999 -20.740 1.00 0.00 H new ATOM 0 HB VAL A 92 6.616 31.231 -21.595 1.00 0.00 H new ATOM 0 HG11 VAL A 92 5.133 30.282 -23.394 1.00 0.00 H new ATOM 0 HG12 VAL A 92 6.710 30.841 -23.999 1.00 0.00 H new ATOM 0 HG13 VAL A 92 6.411 29.102 -23.769 1.00 0.00 H new ATOM 0 HG21 VAL A 92 4.811 29.545 -21.185 1.00 0.00 H new ATOM 0 HG22 VAL A 92 6.042 28.263 -21.277 1.00 0.00 H new ATOM 0 HG23 VAL A 92 6.126 29.487 -19.988 1.00 0.00 H new ATOM 1473 N TYR A 93 8.575 27.602 -21.374 1.00 0.00 N ATOM 1474 CA TYR A 93 9.105 26.253 -21.452 1.00 0.00 C ATOM 1475 C TYR A 93 8.066 25.291 -20.861 1.00 0.00 C ATOM 1476 O TYR A 93 6.998 25.715 -20.411 1.00 0.00 O ATOM 1477 CB TYR A 93 10.423 26.190 -20.648 1.00 0.00 C ATOM 1478 CG TYR A 93 11.405 27.319 -20.924 1.00 0.00 C ATOM 1479 CD1 TYR A 93 12.286 27.241 -22.020 1.00 0.00 C ATOM 1480 CD2 TYR A 93 11.409 28.465 -20.102 1.00 0.00 C ATOM 1481 CE1 TYR A 93 13.164 28.303 -22.300 1.00 0.00 C ATOM 1482 CE2 TYR A 93 12.279 29.534 -20.381 1.00 0.00 C ATOM 1483 CZ TYR A 93 13.161 29.458 -21.483 1.00 0.00 C ATOM 1484 OH TYR A 93 14.002 30.499 -21.740 1.00 0.00 O ATOM 0 H TYR A 93 8.054 27.754 -20.510 1.00 0.00 H new ATOM 0 HA TYR A 93 9.309 25.971 -22.485 1.00 0.00 H new ATOM 0 HB2 TYR A 93 10.182 26.191 -19.585 1.00 0.00 H new ATOM 0 HB3 TYR A 93 10.915 25.241 -20.862 1.00 0.00 H new ATOM 0 HD1 TYR A 93 12.287 26.362 -22.648 1.00 0.00 H new ATOM 0 HD2 TYR A 93 10.741 28.522 -19.255 1.00 0.00 H new ATOM 0 HE1 TYR A 93 13.841 28.237 -23.139 1.00 0.00 H new ATOM 0 HE2 TYR A 93 12.273 30.413 -19.753 1.00 0.00 H new ATOM 0 HH TYR A 93 13.860 31.206 -21.076 1.00 0.00 H new ATOM 1494 N THR A 94 8.408 24.007 -20.806 1.00 0.00 N ATOM 1495 CA THR A 94 7.595 22.973 -20.178 1.00 0.00 C ATOM 1496 C THR A 94 8.508 22.191 -19.233 1.00 0.00 C ATOM 1497 O THR A 94 9.645 21.869 -19.590 1.00 0.00 O ATOM 1498 CB THR A 94 6.930 22.089 -21.253 1.00 0.00 C ATOM 1499 OG1 THR A 94 6.356 22.885 -22.278 1.00 0.00 O ATOM 1500 CG2 THR A 94 5.826 21.212 -20.656 1.00 0.00 C ATOM 0 H THR A 94 9.276 23.650 -21.205 1.00 0.00 H new ATOM 0 HA THR A 94 6.774 23.398 -19.600 1.00 0.00 H new ATOM 0 HB THR A 94 7.715 21.455 -21.665 1.00 0.00 H new ATOM 0 HG1 THR A 94 5.941 22.304 -22.950 1.00 0.00 H new ATOM 0 HG21 THR A 94 5.380 20.603 -21.442 1.00 0.00 H new ATOM 0 HG22 THR A 94 6.251 20.562 -19.891 1.00 0.00 H new ATOM 0 HG23 THR A 94 5.060 21.846 -20.209 1.00 0.00 H new ATOM 1508 N ALA A 95 8.005 21.893 -18.035 1.00 0.00 N ATOM 1509 CA ALA A 95 8.704 21.165 -16.989 1.00 0.00 C ATOM 1510 C ALA A 95 7.809 20.019 -16.527 1.00 0.00 C ATOM 1511 O ALA A 95 6.583 20.112 -16.609 1.00 0.00 O ATOM 1512 CB ALA A 95 9.009 22.116 -15.826 1.00 0.00 C ATOM 0 H ALA A 95 7.061 22.166 -17.761 1.00 0.00 H new ATOM 0 HA ALA A 95 9.647 20.763 -17.360 1.00 0.00 H new ATOM 0 HB1 ALA A 95 9.533 21.573 -15.040 1.00 0.00 H new ATOM 0 HB2 ALA A 95 9.635 22.935 -16.180 1.00 0.00 H new ATOM 0 HB3 ALA A 95 8.076 22.517 -15.430 1.00 0.00 H new ATOM 1518 N LYS A 96 8.408 18.938 -16.027 1.00 0.00 N ATOM 1519 CA LYS A 96 7.663 17.878 -15.373 1.00 0.00 C ATOM 1520 C LYS A 96 7.195 18.431 -14.039 1.00 0.00 C ATOM 1521 O LYS A 96 7.996 19.010 -13.301 1.00 0.00 O ATOM 1522 CB LYS A 96 8.574 16.665 -15.145 1.00 0.00 C ATOM 1523 CG LYS A 96 8.926 15.948 -16.457 1.00 0.00 C ATOM 1524 CD LYS A 96 10.029 14.906 -16.234 1.00 0.00 C ATOM 1525 CE LYS A 96 11.419 15.562 -16.255 1.00 0.00 C ATOM 1526 NZ LYS A 96 12.422 14.773 -15.505 1.00 0.00 N ATOM 0 H LYS A 96 9.415 18.779 -16.066 1.00 0.00 H new ATOM 0 HA LYS A 96 6.819 17.557 -15.983 1.00 0.00 H new ATOM 0 HB2 LYS A 96 9.491 16.989 -14.653 1.00 0.00 H new ATOM 0 HB3 LYS A 96 8.081 15.964 -14.471 1.00 0.00 H new ATOM 0 HG2 LYS A 96 8.037 15.462 -16.860 1.00 0.00 H new ATOM 0 HG3 LYS A 96 9.254 16.677 -17.198 1.00 0.00 H new ATOM 0 HD2 LYS A 96 9.874 14.406 -15.278 1.00 0.00 H new ATOM 0 HD3 LYS A 96 9.973 14.140 -17.008 1.00 0.00 H new ATOM 0 HE2 LYS A 96 11.749 15.678 -17.288 1.00 0.00 H new ATOM 0 HE3 LYS A 96 11.353 16.563 -15.828 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 13.374 14.995 -15.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 12.365 15.011 -14.494 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 12.232 13.759 -15.633 1.00 0.00 H new ATOM 1540 N LEU A 97 5.936 18.185 -13.681 1.00 0.00 N ATOM 1541 CA LEU A 97 5.465 18.477 -12.327 1.00 0.00 C ATOM 1542 C LEU A 97 6.292 17.666 -11.316 1.00 0.00 C ATOM 1543 O LEU A 97 6.529 18.113 -10.197 1.00 0.00 O ATOM 1544 CB LEU A 97 3.965 18.161 -12.204 1.00 0.00 C ATOM 1545 CG LEU A 97 3.339 18.657 -10.883 1.00 0.00 C ATOM 1546 CD1 LEU A 97 3.352 20.189 -10.782 1.00 0.00 C ATOM 1547 CD2 LEU A 97 1.893 18.168 -10.796 1.00 0.00 C ATOM 0 H LEU A 97 5.230 17.789 -14.301 1.00 0.00 H new ATOM 0 HA LEU A 97 5.596 19.538 -12.113 1.00 0.00 H new ATOM 0 HB2 LEU A 97 3.436 18.616 -13.041 1.00 0.00 H new ATOM 0 HB3 LEU A 97 3.821 17.084 -12.283 1.00 0.00 H new ATOM 0 HG LEU A 97 3.935 18.258 -10.062 1.00 0.00 H new ATOM 0 HD11 LEU A 97 2.902 20.495 -9.837 1.00 0.00 H new ATOM 0 HD12 LEU A 97 4.380 20.548 -10.828 1.00 0.00 H new ATOM 0 HD13 LEU A 97 2.783 20.613 -11.609 1.00 0.00 H new ATOM 0 HD21 LEU A 97 1.447 18.516 -9.864 1.00 0.00 H new ATOM 0 HD22 LEU A 97 1.325 18.560 -11.639 1.00 0.00 H new ATOM 0 HD23 LEU A 97 1.875 17.078 -10.822 1.00 0.00 H new ATOM 1559 N SER A 98 6.792 16.508 -11.753 1.00 0.00 N ATOM 1560 CA SER A 98 7.645 15.586 -11.013 1.00 0.00 C ATOM 1561 C SER A 98 8.992 16.193 -10.586 1.00 0.00 C ATOM 1562 O SER A 98 9.698 15.590 -9.779 1.00 0.00 O ATOM 1563 CB SER A 98 7.885 14.368 -11.916 1.00 0.00 C ATOM 1564 OG SER A 98 6.678 14.009 -12.572 1.00 0.00 O ATOM 0 H SER A 98 6.597 16.171 -12.696 1.00 0.00 H new ATOM 0 HA SER A 98 7.138 15.321 -10.085 1.00 0.00 H new ATOM 0 HB2 SER A 98 8.656 14.596 -12.652 1.00 0.00 H new ATOM 0 HB3 SER A 98 8.250 13.530 -11.322 1.00 0.00 H new ATOM 0 HG SER A 98 6.883 13.459 -13.357 1.00 0.00 H new ATOM 1570 N ASP A 99 9.357 17.369 -11.111 1.00 0.00 N ATOM 1571 CA ASP A 99 10.618 18.053 -10.820 1.00 0.00 C ATOM 1572 C ASP A 99 10.352 19.525 -10.481 1.00 0.00 C ATOM 1573 O ASP A 99 11.270 20.344 -10.485 1.00 0.00 O ATOM 1574 CB ASP A 99 11.603 17.875 -11.992 1.00 0.00 C ATOM 1575 CG ASP A 99 12.190 16.455 -12.044 1.00 0.00 C ATOM 1576 OD1 ASP A 99 13.019 16.098 -11.177 1.00 0.00 O ATOM 1577 OD2 ASP A 99 11.840 15.697 -12.977 1.00 0.00 O ATOM 0 H ASP A 99 8.767 17.882 -11.766 1.00 0.00 H new ATOM 0 HA ASP A 99 11.088 17.606 -9.944 1.00 0.00 H new ATOM 0 HB2 ASP A 99 11.092 18.090 -12.930 1.00 0.00 H new ATOM 0 HB3 ASP A 99 12.413 18.598 -11.897 1.00 0.00 H new ATOM 1582 N ILE A 100 9.104 19.877 -10.161 1.00 0.00 N ATOM 1583 CA ILE A 100 8.725 21.202 -9.689 1.00 0.00 C ATOM 1584 C ILE A 100 8.465 21.103 -8.192 1.00 0.00 C ATOM 1585 O ILE A 100 7.958 20.102 -7.680 1.00 0.00 O ATOM 1586 CB ILE A 100 7.516 21.725 -10.508 1.00 0.00 C ATOM 1587 CG1 ILE A 100 8.049 22.396 -11.790 1.00 0.00 C ATOM 1588 CG2 ILE A 100 6.533 22.649 -9.757 1.00 0.00 C ATOM 1589 CD1 ILE A 100 8.451 23.869 -11.665 1.00 0.00 C ATOM 0 H ILE A 100 8.316 19.232 -10.226 1.00 0.00 H new ATOM 0 HA ILE A 100 9.518 21.935 -9.840 1.00 0.00 H new ATOM 0 HB ILE A 100 6.904 20.853 -10.737 1.00 0.00 H new ATOM 0 HG12 ILE A 100 8.915 21.833 -12.137 1.00 0.00 H new ATOM 0 HG13 ILE A 100 7.285 22.314 -12.563 1.00 0.00 H new ATOM 0 HG21 ILE A 100 5.731 22.951 -10.430 1.00 0.00 H new ATOM 0 HG22 ILE A 100 6.111 22.116 -8.905 1.00 0.00 H new ATOM 0 HG23 ILE A 100 7.063 23.534 -9.405 1.00 0.00 H new ATOM 0 HD11 ILE A 100 8.810 24.231 -12.628 1.00 0.00 H new ATOM 0 HD12 ILE A 100 7.587 24.457 -11.355 1.00 0.00 H new ATOM 0 HD13 ILE A 100 9.243 23.968 -10.922 1.00 0.00 H new ATOM 1601 N GLU A 101 8.796 22.191 -7.511 1.00 0.00 N ATOM 1602 CA GLU A 101 8.564 22.386 -6.091 1.00 0.00 C ATOM 1603 C GLU A 101 7.943 23.775 -5.955 1.00 0.00 C ATOM 1604 O GLU A 101 8.619 24.782 -6.164 1.00 0.00 O ATOM 1605 CB GLU A 101 9.892 22.222 -5.334 1.00 0.00 C ATOM 1606 CG GLU A 101 9.696 22.262 -3.813 1.00 0.00 C ATOM 1607 CD GLU A 101 11.026 22.053 -3.067 1.00 0.00 C ATOM 1608 OE1 GLU A 101 11.576 20.928 -3.103 1.00 0.00 O ATOM 1609 OE2 GLU A 101 11.520 23.004 -2.420 1.00 0.00 O ATOM 0 H GLU A 101 9.251 22.991 -7.951 1.00 0.00 H new ATOM 0 HA GLU A 101 7.886 21.652 -5.655 1.00 0.00 H new ATOM 0 HB2 GLU A 101 10.355 21.276 -5.615 1.00 0.00 H new ATOM 0 HB3 GLU A 101 10.579 23.014 -5.632 1.00 0.00 H new ATOM 0 HG2 GLU A 101 9.263 23.220 -3.526 1.00 0.00 H new ATOM 0 HG3 GLU A 101 8.986 21.490 -3.516 1.00 0.00 H new ATOM 1616 N ALA A 102 6.634 23.839 -5.703 1.00 0.00 N ATOM 1617 CA ALA A 102 5.922 25.109 -5.633 1.00 0.00 C ATOM 1618 C ALA A 102 6.381 25.909 -4.413 1.00 0.00 C ATOM 1619 O ALA A 102 6.730 25.343 -3.372 1.00 0.00 O ATOM 1620 CB ALA A 102 4.413 24.871 -5.575 1.00 0.00 C ATOM 0 H ALA A 102 6.047 23.020 -5.544 1.00 0.00 H new ATOM 0 HA ALA A 102 6.148 25.684 -6.531 1.00 0.00 H new ATOM 0 HB1 ALA A 102 3.895 25.829 -5.523 1.00 0.00 H new ATOM 0 HB2 ALA A 102 4.095 24.334 -6.469 1.00 0.00 H new ATOM 0 HB3 ALA A 102 4.172 24.280 -4.692 1.00 0.00 H new ATOM 1626 N ILE A 103 6.323 27.231 -4.542 1.00 0.00 N ATOM 1627 CA ILE A 103 6.753 28.189 -3.532 1.00 0.00 C ATOM 1628 C ILE A 103 5.524 29.014 -3.139 1.00 0.00 C ATOM 1629 O ILE A 103 4.811 29.527 -4.003 1.00 0.00 O ATOM 1630 CB ILE A 103 7.904 29.060 -4.096 1.00 0.00 C ATOM 1631 CG1 ILE A 103 9.163 28.217 -4.416 1.00 0.00 C ATOM 1632 CG2 ILE A 103 8.286 30.185 -3.116 1.00 0.00 C ATOM 1633 CD1 ILE A 103 10.191 28.964 -5.276 1.00 0.00 C ATOM 0 H ILE A 103 5.962 27.680 -5.384 1.00 0.00 H new ATOM 0 HA ILE A 103 7.147 27.697 -2.643 1.00 0.00 H new ATOM 0 HB ILE A 103 7.533 29.499 -5.022 1.00 0.00 H new ATOM 0 HG12 ILE A 103 9.634 27.912 -3.482 1.00 0.00 H new ATOM 0 HG13 ILE A 103 8.860 27.306 -4.933 1.00 0.00 H new ATOM 0 HG21 ILE A 103 9.096 30.778 -3.541 1.00 0.00 H new ATOM 0 HG22 ILE A 103 7.421 30.825 -2.941 1.00 0.00 H new ATOM 0 HG23 ILE A 103 8.612 29.750 -2.171 1.00 0.00 H new ATOM 0 HD11 ILE A 103 11.048 28.317 -5.463 1.00 0.00 H new ATOM 0 HD12 ILE A 103 9.735 29.246 -6.225 1.00 0.00 H new ATOM 0 HD13 ILE A 103 10.521 29.861 -4.752 1.00 0.00 H new ATOM 1645 N ASP A 104 5.321 29.164 -1.824 1.00 0.00 N ATOM 1646 CA ASP A 104 4.292 30.006 -1.199 1.00 0.00 C ATOM 1647 C ASP A 104 2.896 29.815 -1.819 1.00 0.00 C ATOM 1648 O ASP A 104 2.154 30.774 -2.051 1.00 0.00 O ATOM 1649 CB ASP A 104 4.767 31.469 -1.167 1.00 0.00 C ATOM 1650 CG ASP A 104 3.838 32.377 -0.338 1.00 0.00 C ATOM 1651 OD1 ASP A 104 3.452 32.000 0.792 1.00 0.00 O ATOM 1652 OD2 ASP A 104 3.539 33.510 -0.783 1.00 0.00 O ATOM 0 H ASP A 104 5.896 28.680 -1.135 1.00 0.00 H new ATOM 0 HA ASP A 104 4.161 29.682 -0.167 1.00 0.00 H new ATOM 0 HB2 ASP A 104 5.774 31.511 -0.752 1.00 0.00 H new ATOM 0 HB3 ASP A 104 4.826 31.850 -2.186 1.00 0.00 H new ATOM 1657 N VAL A 105 2.554 28.564 -2.143 1.00 0.00 N ATOM 1658 CA VAL A 105 1.322 28.219 -2.848 1.00 0.00 C ATOM 1659 C VAL A 105 0.232 27.797 -1.849 1.00 0.00 C ATOM 1660 O VAL A 105 0.501 27.657 -0.650 1.00 0.00 O ATOM 1661 CB VAL A 105 1.653 27.184 -3.947 1.00 0.00 C ATOM 1662 CG1 VAL A 105 1.775 25.734 -3.451 1.00 0.00 C ATOM 1663 CG2 VAL A 105 0.696 27.320 -5.131 1.00 0.00 C ATOM 0 H VAL A 105 3.134 27.755 -1.919 1.00 0.00 H new ATOM 0 HA VAL A 105 0.897 29.082 -3.361 1.00 0.00 H new ATOM 0 HB VAL A 105 2.659 27.428 -4.289 1.00 0.00 H new ATOM 0 HG11 VAL A 105 2.009 25.080 -4.291 1.00 0.00 H new ATOM 0 HG12 VAL A 105 2.571 25.669 -2.709 1.00 0.00 H new ATOM 0 HG13 VAL A 105 0.832 25.423 -3.001 1.00 0.00 H new ATOM 0 HG21 VAL A 105 0.950 26.581 -5.891 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -0.327 27.156 -4.793 1.00 0.00 H new ATOM 0 HG23 VAL A 105 0.782 28.320 -5.555 1.00 0.00 H new ATOM 1673 N ASP A 106 -1.007 27.620 -2.325 1.00 0.00 N ATOM 1674 CA ASP A 106 -2.113 27.171 -1.483 1.00 0.00 C ATOM 1675 C ASP A 106 -1.878 25.742 -1.003 1.00 0.00 C ATOM 1676 O ASP A 106 -1.162 24.953 -1.623 1.00 0.00 O ATOM 1677 CB ASP A 106 -3.451 27.222 -2.225 1.00 0.00 C ATOM 1678 CG ASP A 106 -4.651 27.035 -1.284 1.00 0.00 C ATOM 1679 OD1 ASP A 106 -5.044 28.008 -0.604 1.00 0.00 O ATOM 1680 OD2 ASP A 106 -5.171 25.901 -1.197 1.00 0.00 O ATOM 0 H ASP A 106 -1.266 27.784 -3.298 1.00 0.00 H new ATOM 0 HA ASP A 106 -2.155 27.851 -0.632 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -3.542 28.179 -2.739 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -3.469 26.446 -2.990 1.00 0.00 H new ATOM 1685 N ASP A 107 -2.561 25.397 0.075 1.00 0.00 N ATOM 1686 CA ASP A 107 -2.469 24.097 0.726 1.00 0.00 C ATOM 1687 C ASP A 107 -2.891 22.984 -0.225 1.00 0.00 C ATOM 1688 O ASP A 107 -2.222 21.957 -0.288 1.00 0.00 O ATOM 1689 CB ASP A 107 -3.346 24.077 1.981 1.00 0.00 C ATOM 1690 CG ASP A 107 -3.325 22.692 2.649 1.00 0.00 C ATOM 1691 OD1 ASP A 107 -2.314 22.349 3.301 1.00 0.00 O ATOM 1692 OD2 ASP A 107 -4.343 21.968 2.575 1.00 0.00 O ATOM 0 H ASP A 107 -3.214 26.030 0.536 1.00 0.00 H new ATOM 0 HA ASP A 107 -1.431 23.928 1.012 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -2.994 24.830 2.686 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -4.370 24.341 1.717 1.00 0.00 H new ATOM 1697 N ASP A 108 -3.950 23.190 -1.013 1.00 0.00 N ATOM 1698 CA ASP A 108 -4.476 22.146 -1.887 1.00 0.00 C ATOM 1699 C ASP A 108 -3.557 21.939 -3.099 1.00 0.00 C ATOM 1700 O ASP A 108 -3.431 20.826 -3.610 1.00 0.00 O ATOM 1701 CB ASP A 108 -5.908 22.514 -2.309 1.00 0.00 C ATOM 1702 CG ASP A 108 -6.791 21.309 -2.684 1.00 0.00 C ATOM 1703 OD1 ASP A 108 -6.479 20.152 -2.325 1.00 0.00 O ATOM 1704 OD2 ASP A 108 -7.874 21.539 -3.269 1.00 0.00 O ATOM 0 H ASP A 108 -4.458 24.073 -1.061 1.00 0.00 H new ATOM 0 HA ASP A 108 -4.508 21.198 -1.349 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -6.385 23.059 -1.494 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -5.860 23.192 -3.161 1.00 0.00 H new ATOM 1709 N THR A 109 -2.850 22.996 -3.523 1.00 0.00 N ATOM 1710 CA THR A 109 -1.838 22.911 -4.576 1.00 0.00 C ATOM 1711 C THR A 109 -0.638 22.127 -4.040 1.00 0.00 C ATOM 1712 O THR A 109 -0.177 21.189 -4.694 1.00 0.00 O ATOM 1713 CB THR A 109 -1.448 24.330 -5.041 1.00 0.00 C ATOM 1714 OG1 THR A 109 -2.622 25.033 -5.396 1.00 0.00 O ATOM 1715 CG2 THR A 109 -0.565 24.345 -6.288 1.00 0.00 C ATOM 0 H THR A 109 -2.967 23.935 -3.142 1.00 0.00 H new ATOM 0 HA THR A 109 -2.229 22.384 -5.447 1.00 0.00 H new ATOM 0 HB THR A 109 -0.900 24.777 -4.211 1.00 0.00 H new ATOM 0 HG1 THR A 109 -3.344 24.395 -5.575 1.00 0.00 H new ATOM 0 HG21 THR A 109 -0.331 25.375 -6.556 1.00 0.00 H new ATOM 0 HG22 THR A 109 0.359 23.804 -6.086 1.00 0.00 H new ATOM 0 HG23 THR A 109 -1.092 23.866 -7.113 1.00 0.00 H new ATOM 1723 N GLN A 110 -0.166 22.464 -2.833 1.00 0.00 N ATOM 1724 CA GLN A 110 0.962 21.783 -2.218 1.00 0.00 C ATOM 1725 C GLN A 110 0.617 20.303 -2.017 1.00 0.00 C ATOM 1726 O GLN A 110 1.417 19.441 -2.370 1.00 0.00 O ATOM 1727 CB GLN A 110 1.344 22.489 -0.901 1.00 0.00 C ATOM 1728 CG GLN A 110 2.836 22.362 -0.554 1.00 0.00 C ATOM 1729 CD GLN A 110 3.297 20.914 -0.367 1.00 0.00 C ATOM 1730 OE1 GLN A 110 2.928 20.245 0.594 1.00 0.00 O ATOM 1731 NE2 GLN A 110 4.101 20.398 -1.285 1.00 0.00 N ATOM 0 H GLN A 110 -0.559 23.214 -2.264 1.00 0.00 H new ATOM 0 HA GLN A 110 1.835 21.829 -2.869 1.00 0.00 H new ATOM 0 HB2 GLN A 110 1.084 23.545 -0.974 1.00 0.00 H new ATOM 0 HB3 GLN A 110 0.752 22.070 -0.087 1.00 0.00 H new ATOM 0 HG2 GLN A 110 3.426 22.824 -1.346 1.00 0.00 H new ATOM 0 HG3 GLN A 110 3.037 22.920 0.360 1.00 0.00 H new ATOM 0 HE21 GLN A 110 4.400 20.965 -2.078 1.00 0.00 H new ATOM 0 HE22 GLN A 110 4.421 19.433 -1.198 1.00 0.00 H new ATOM 1740 N GLU A 111 -0.585 19.991 -1.524 1.00 0.00 N ATOM 1741 CA GLU A 111 -1.026 18.620 -1.317 1.00 0.00 C ATOM 1742 C GLU A 111 -1.029 17.836 -2.622 1.00 0.00 C ATOM 1743 O GLU A 111 -0.535 16.714 -2.630 1.00 0.00 O ATOM 1744 CB GLU A 111 -2.419 18.587 -0.673 1.00 0.00 C ATOM 1745 CG GLU A 111 -2.362 18.834 0.840 1.00 0.00 C ATOM 1746 CD GLU A 111 -1.713 17.674 1.615 1.00 0.00 C ATOM 1747 OE1 GLU A 111 -2.047 16.493 1.369 1.00 0.00 O ATOM 1748 OE2 GLU A 111 -0.872 17.911 2.510 1.00 0.00 O ATOM 0 H GLU A 111 -1.278 20.690 -1.258 1.00 0.00 H new ATOM 0 HA GLU A 111 -0.317 18.145 -0.639 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -3.051 19.342 -1.139 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -2.884 17.620 -0.865 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -1.803 19.750 1.032 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -3.373 18.993 1.215 1.00 0.00 H new ATOM 1755 N ALA A 112 -1.530 18.403 -3.723 1.00 0.00 N ATOM 1756 CA ALA A 112 -1.546 17.712 -5.007 1.00 0.00 C ATOM 1757 C ALA A 112 -0.126 17.415 -5.503 1.00 0.00 C ATOM 1758 O ALA A 112 0.135 16.327 -6.017 1.00 0.00 O ATOM 1759 CB ALA A 112 -2.308 18.559 -6.026 1.00 0.00 C ATOM 0 H ALA A 112 -1.930 19.341 -3.747 1.00 0.00 H new ATOM 0 HA ALA A 112 -2.050 16.754 -4.881 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -2.322 18.046 -6.988 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -3.331 18.711 -5.681 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -1.815 19.525 -6.137 1.00 0.00 H new ATOM 1765 N ILE A 113 0.796 18.368 -5.339 1.00 0.00 N ATOM 1766 CA ILE A 113 2.192 18.195 -5.726 1.00 0.00 C ATOM 1767 C ILE A 113 2.823 17.101 -4.864 1.00 0.00 C ATOM 1768 O ILE A 113 3.424 16.173 -5.401 1.00 0.00 O ATOM 1769 CB ILE A 113 2.916 19.551 -5.609 1.00 0.00 C ATOM 1770 CG1 ILE A 113 2.411 20.483 -6.729 1.00 0.00 C ATOM 1771 CG2 ILE A 113 4.448 19.411 -5.673 1.00 0.00 C ATOM 1772 CD1 ILE A 113 2.655 21.956 -6.414 1.00 0.00 C ATOM 0 H ILE A 113 0.591 19.281 -4.933 1.00 0.00 H new ATOM 0 HA ILE A 113 2.277 17.871 -6.763 1.00 0.00 H new ATOM 0 HB ILE A 113 2.687 19.975 -4.631 1.00 0.00 H new ATOM 0 HG12 ILE A 113 2.910 20.227 -7.664 1.00 0.00 H new ATOM 0 HG13 ILE A 113 1.344 20.319 -6.881 1.00 0.00 H new ATOM 0 HG21 ILE A 113 4.907 20.396 -5.586 1.00 0.00 H new ATOM 0 HG22 ILE A 113 4.790 18.777 -4.855 1.00 0.00 H new ATOM 0 HG23 ILE A 113 4.733 18.961 -6.624 1.00 0.00 H new ATOM 0 HD11 ILE A 113 2.282 22.570 -7.234 1.00 0.00 H new ATOM 0 HD12 ILE A 113 2.134 22.223 -5.494 1.00 0.00 H new ATOM 0 HD13 ILE A 113 3.724 22.129 -6.289 1.00 0.00 H new ATOM 1784 N ALA A 114 2.674 17.188 -3.540 1.00 0.00 N ATOM 1785 CA ALA A 114 3.223 16.214 -2.612 1.00 0.00 C ATOM 1786 C ALA A 114 2.681 14.821 -2.937 1.00 0.00 C ATOM 1787 O ALA A 114 3.456 13.880 -3.079 1.00 0.00 O ATOM 1788 CB ALA A 114 2.881 16.631 -1.177 1.00 0.00 C ATOM 0 H ALA A 114 2.164 17.945 -3.085 1.00 0.00 H new ATOM 0 HA ALA A 114 4.308 16.178 -2.708 1.00 0.00 H new ATOM 0 HB1 ALA A 114 3.292 15.902 -0.479 1.00 0.00 H new ATOM 0 HB2 ALA A 114 3.309 17.612 -0.971 1.00 0.00 H new ATOM 0 HB3 ALA A 114 1.798 16.676 -1.059 1.00 0.00 H new ATOM 1794 N ASP A 115 1.365 14.707 -3.128 1.00 0.00 N ATOM 1795 CA ASP A 115 0.680 13.459 -3.465 1.00 0.00 C ATOM 1796 C ASP A 115 1.279 12.815 -4.716 1.00 0.00 C ATOM 1797 O ASP A 115 1.571 11.617 -4.724 1.00 0.00 O ATOM 1798 CB ASP A 115 -0.815 13.723 -3.678 1.00 0.00 C ATOM 1799 CG ASP A 115 -1.620 12.424 -3.701 1.00 0.00 C ATOM 1800 OD1 ASP A 115 -2.097 12.030 -2.610 1.00 0.00 O ATOM 1801 OD2 ASP A 115 -1.832 11.857 -4.790 1.00 0.00 O ATOM 0 H ASP A 115 0.730 15.502 -3.050 1.00 0.00 H new ATOM 0 HA ASP A 115 0.812 12.767 -2.633 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -1.188 14.368 -2.882 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -0.960 14.258 -4.617 1.00 0.00 H new ATOM 1806 N TRP A 116 1.535 13.631 -5.744 1.00 0.00 N ATOM 1807 CA TRP A 116 2.152 13.171 -6.978 1.00 0.00 C ATOM 1808 C TRP A 116 3.593 12.721 -6.726 1.00 0.00 C ATOM 1809 O TRP A 116 3.999 11.674 -7.224 1.00 0.00 O ATOM 1810 CB TRP A 116 2.096 14.270 -8.051 1.00 0.00 C ATOM 1811 CG TRP A 116 2.779 13.892 -9.330 1.00 0.00 C ATOM 1812 CD1 TRP A 116 3.895 14.465 -9.836 1.00 0.00 C ATOM 1813 CD2 TRP A 116 2.464 12.781 -10.226 1.00 0.00 C ATOM 1814 NE1 TRP A 116 4.297 13.780 -10.965 1.00 0.00 N ATOM 1815 CE2 TRP A 116 3.474 12.708 -11.230 1.00 0.00 C ATOM 1816 CE3 TRP A 116 1.448 11.803 -10.271 1.00 0.00 C ATOM 1817 CZ2 TRP A 116 3.493 11.693 -12.198 1.00 0.00 C ATOM 1818 CZ3 TRP A 116 1.435 10.806 -11.263 1.00 0.00 C ATOM 1819 CH2 TRP A 116 2.464 10.739 -12.218 1.00 0.00 C ATOM 0 H TRP A 116 1.318 14.628 -5.737 1.00 0.00 H new ATOM 0 HA TRP A 116 1.591 12.311 -7.345 1.00 0.00 H new ATOM 0 HB2 TRP A 116 1.053 14.508 -8.262 1.00 0.00 H new ATOM 0 HB3 TRP A 116 2.556 15.176 -7.656 1.00 0.00 H new ATOM 0 HD1 TRP A 116 4.395 15.327 -9.420 1.00 0.00 H new ATOM 0 HE1 TRP A 116 5.104 14.036 -11.533 1.00 0.00 H new ATOM 0 HE3 TRP A 116 0.664 11.820 -9.528 1.00 0.00 H new ATOM 0 HZ2 TRP A 116 4.293 11.646 -12.922 1.00 0.00 H new ATOM 0 HZ3 TRP A 116 0.629 10.087 -11.291 1.00 0.00 H new ATOM 0 HH2 TRP A 116 2.463 9.957 -12.963 1.00 0.00 H new ATOM 1830 N LEU A 117 4.370 13.469 -5.938 1.00 0.00 N ATOM 1831 CA LEU A 117 5.760 13.129 -5.649 1.00 0.00 C ATOM 1832 C LEU A 117 5.858 11.836 -4.835 1.00 0.00 C ATOM 1833 O LEU A 117 6.771 11.045 -5.068 1.00 0.00 O ATOM 1834 CB LEU A 117 6.461 14.293 -4.926 1.00 0.00 C ATOM 1835 CG LEU A 117 6.698 15.530 -5.819 1.00 0.00 C ATOM 1836 CD1 LEU A 117 7.145 16.713 -4.953 1.00 0.00 C ATOM 1837 CD2 LEU A 117 7.744 15.273 -6.912 1.00 0.00 C ATOM 0 H LEU A 117 4.051 14.325 -5.485 1.00 0.00 H new ATOM 0 HA LEU A 117 6.270 12.958 -6.597 1.00 0.00 H new ATOM 0 HB2 LEU A 117 5.861 14.588 -4.065 1.00 0.00 H new ATOM 0 HB3 LEU A 117 7.420 13.945 -4.542 1.00 0.00 H new ATOM 0 HG LEU A 117 5.754 15.757 -6.315 1.00 0.00 H new ATOM 0 HD11 LEU A 117 7.312 17.585 -5.586 1.00 0.00 H new ATOM 0 HD12 LEU A 117 6.371 16.940 -4.219 1.00 0.00 H new ATOM 0 HD13 LEU A 117 8.070 16.457 -4.437 1.00 0.00 H new ATOM 0 HD21 LEU A 117 7.873 16.174 -7.511 1.00 0.00 H new ATOM 0 HD22 LEU A 117 8.694 15.005 -6.450 1.00 0.00 H new ATOM 0 HD23 LEU A 117 7.409 14.457 -7.552 1.00 0.00 H new ATOM 1849 N TYR A 118 4.922 11.570 -3.919 1.00 0.00 N ATOM 1850 CA TYR A 118 4.901 10.311 -3.180 1.00 0.00 C ATOM 1851 C TYR A 118 4.567 9.143 -4.105 1.00 0.00 C ATOM 1852 O TYR A 118 5.175 8.082 -3.983 1.00 0.00 O ATOM 1853 CB TYR A 118 3.893 10.369 -2.025 1.00 0.00 C ATOM 1854 CG TYR A 118 4.142 11.462 -1.000 1.00 0.00 C ATOM 1855 CD1 TYR A 118 5.426 11.689 -0.465 1.00 0.00 C ATOM 1856 CD2 TYR A 118 3.073 12.280 -0.599 1.00 0.00 C ATOM 1857 CE1 TYR A 118 5.642 12.730 0.456 1.00 0.00 C ATOM 1858 CE2 TYR A 118 3.283 13.339 0.296 1.00 0.00 C ATOM 1859 CZ TYR A 118 4.568 13.566 0.839 1.00 0.00 C ATOM 1860 OH TYR A 118 4.761 14.594 1.713 1.00 0.00 O ATOM 0 H TYR A 118 4.169 12.213 -3.674 1.00 0.00 H new ATOM 0 HA TYR A 118 5.897 10.155 -2.765 1.00 0.00 H new ATOM 0 HB2 TYR A 118 2.895 10.505 -2.442 1.00 0.00 H new ATOM 0 HB3 TYR A 118 3.896 9.407 -1.513 1.00 0.00 H new ATOM 0 HD1 TYR A 118 6.250 11.059 -0.764 1.00 0.00 H new ATOM 0 HD2 TYR A 118 2.081 12.092 -0.983 1.00 0.00 H new ATOM 0 HE1 TYR A 118 6.627 12.890 0.870 1.00 0.00 H new ATOM 0 HE2 TYR A 118 2.461 13.983 0.571 1.00 0.00 H new ATOM 0 HH TYR A 118 3.913 15.062 1.860 1.00 0.00 H new ATOM 1870 N TRP A 119 3.643 9.329 -5.053 1.00 0.00 N ATOM 1871 CA TRP A 119 3.326 8.322 -6.051 1.00 0.00 C ATOM 1872 C TRP A 119 4.564 8.067 -6.909 1.00 0.00 C ATOM 1873 O TRP A 119 4.939 6.912 -7.117 1.00 0.00 O ATOM 1874 CB TRP A 119 2.121 8.816 -6.858 1.00 0.00 C ATOM 1875 CG TRP A 119 1.737 7.999 -8.045 1.00 0.00 C ATOM 1876 CD1 TRP A 119 2.099 8.264 -9.318 1.00 0.00 C ATOM 1877 CD2 TRP A 119 0.924 6.791 -8.102 1.00 0.00 C ATOM 1878 NE1 TRP A 119 1.493 7.362 -10.170 1.00 0.00 N ATOM 1879 CE2 TRP A 119 0.778 6.413 -9.470 1.00 0.00 C ATOM 1880 CE3 TRP A 119 0.299 5.972 -7.136 1.00 0.00 C ATOM 1881 CZ2 TRP A 119 0.053 5.277 -9.856 1.00 0.00 C ATOM 1882 CZ3 TRP A 119 -0.441 4.835 -7.515 1.00 0.00 C ATOM 1883 CH2 TRP A 119 -0.563 4.486 -8.872 1.00 0.00 C ATOM 0 H TRP A 119 3.097 10.186 -5.144 1.00 0.00 H new ATOM 0 HA TRP A 119 3.054 7.368 -5.600 1.00 0.00 H new ATOM 0 HB2 TRP A 119 1.262 8.872 -6.189 1.00 0.00 H new ATOM 0 HB3 TRP A 119 2.329 9.831 -7.195 1.00 0.00 H new ATOM 0 HD1 TRP A 119 2.762 9.060 -9.624 1.00 0.00 H new ATOM 0 HE1 TRP A 119 1.565 7.394 -11.187 1.00 0.00 H new ATOM 0 HE3 TRP A 119 0.390 6.222 -6.089 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 -0.031 5.013 -10.900 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 -0.917 4.228 -6.759 1.00 0.00 H new ATOM 0 HH2 TRP A 119 -1.129 3.612 -9.157 1.00 0.00 H new ATOM 1894 N LEU A 120 5.262 9.132 -7.315 1.00 0.00 N ATOM 1895 CA LEU A 120 6.498 9.048 -8.074 1.00 0.00 C ATOM 1896 C LEU A 120 7.510 8.162 -7.332 1.00 0.00 C ATOM 1897 O LEU A 120 8.067 7.223 -7.902 1.00 0.00 O ATOM 1898 CB LEU A 120 7.075 10.465 -8.272 1.00 0.00 C ATOM 1899 CG LEU A 120 7.929 10.588 -9.542 1.00 0.00 C ATOM 1900 CD1 LEU A 120 7.025 10.953 -10.723 1.00 0.00 C ATOM 1901 CD2 LEU A 120 9.000 11.670 -9.364 1.00 0.00 C ATOM 0 H LEU A 120 4.973 10.090 -7.118 1.00 0.00 H new ATOM 0 HA LEU A 120 6.296 8.604 -9.049 1.00 0.00 H new ATOM 0 HB2 LEU A 120 6.256 11.182 -8.320 1.00 0.00 H new ATOM 0 HB3 LEU A 120 7.681 10.730 -7.405 1.00 0.00 H new ATOM 0 HG LEU A 120 8.423 9.635 -9.732 1.00 0.00 H new ATOM 0 HD11 LEU A 120 7.626 11.042 -11.628 1.00 0.00 H new ATOM 0 HD12 LEU A 120 6.275 10.175 -10.861 1.00 0.00 H new ATOM 0 HD13 LEU A 120 6.530 11.903 -10.522 1.00 0.00 H new ATOM 0 HD21 LEU A 120 9.597 11.744 -10.273 1.00 0.00 H new ATOM 0 HD22 LEU A 120 8.520 12.628 -9.166 1.00 0.00 H new ATOM 0 HD23 LEU A 120 9.646 11.408 -8.526 1.00 0.00 H new ATOM 1913 N ALA A 121 7.709 8.439 -6.038 1.00 0.00 N ATOM 1914 CA ALA A 121 8.665 7.739 -5.187 1.00 0.00 C ATOM 1915 C ALA A 121 8.266 6.283 -4.909 1.00 0.00 C ATOM 1916 O ALA A 121 9.139 5.458 -4.633 1.00 0.00 O ATOM 1917 CB ALA A 121 8.807 8.503 -3.866 1.00 0.00 C ATOM 0 H ALA A 121 7.197 9.172 -5.548 1.00 0.00 H new ATOM 0 HA ALA A 121 9.616 7.704 -5.718 1.00 0.00 H new ATOM 0 HB1 ALA A 121 9.520 7.988 -3.222 1.00 0.00 H new ATOM 0 HB2 ALA A 121 9.164 9.513 -4.067 1.00 0.00 H new ATOM 0 HB3 ALA A 121 7.839 8.552 -3.368 1.00 0.00 H new ATOM 1923 N ARG A 122 6.970 5.948 -4.967 1.00 0.00 N ATOM 1924 CA ARG A 122 6.473 4.602 -4.663 1.00 0.00 C ATOM 1925 C ARG A 122 6.935 3.572 -5.703 1.00 0.00 C ATOM 1926 O ARG A 122 6.908 2.377 -5.405 1.00 0.00 O ATOM 1927 CB ARG A 122 4.935 4.653 -4.525 1.00 0.00 C ATOM 1928 CG ARG A 122 4.211 3.361 -4.096 1.00 0.00 C ATOM 1929 CD ARG A 122 4.627 2.785 -2.733 1.00 0.00 C ATOM 1930 NE ARG A 122 5.905 2.057 -2.795 1.00 0.00 N ATOM 1931 CZ ARG A 122 6.590 1.555 -1.761 1.00 0.00 C ATOM 1932 NH1 ARG A 122 6.096 1.598 -0.526 1.00 0.00 N ATOM 1933 NH2 ARG A 122 7.780 1.007 -1.978 1.00 0.00 N ATOM 0 H ARG A 122 6.235 6.606 -5.227 1.00 0.00 H new ATOM 0 HA ARG A 122 6.897 4.269 -3.716 1.00 0.00 H new ATOM 0 HB2 ARG A 122 4.689 5.431 -3.803 1.00 0.00 H new ATOM 0 HB3 ARG A 122 4.522 4.966 -5.484 1.00 0.00 H new ATOM 0 HG2 ARG A 122 3.139 3.557 -4.075 1.00 0.00 H new ATOM 0 HG3 ARG A 122 4.381 2.601 -4.858 1.00 0.00 H new ATOM 0 HD2 ARG A 122 4.709 3.596 -2.009 1.00 0.00 H new ATOM 0 HD3 ARG A 122 3.847 2.114 -2.373 1.00 0.00 H new ATOM 0 HE ARG A 122 6.310 1.921 -3.721 1.00 0.00 H new ATOM 0 HH11 ARG A 122 5.182 2.018 -0.357 1.00 0.00 H new ATOM 0 HH12 ARG A 122 6.631 1.211 0.251 1.00 0.00 H new ATOM 0 HH21 ARG A 122 8.161 0.973 -2.924 1.00 0.00 H new ATOM 0 HH22 ARG A 122 8.313 0.620 -1.199 1.00 0.00 H new