USER MOD reduce.3.24.130724 H: found=0, std=0, add=563, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 565 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 768 TYR OH : rot 180:sc= 0 USER MOD Single : A 769 HIS : no HD1:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 779 THR OG1 : rot 180:sc= 0 USER MOD Single : A 801 GLN : amide:sc= -0.32 K(o=-0.32,f=-2.1) USER MOD Single : A 802 TYR OH : rot 180:sc= 0 USER MOD Single : A 804 SER OG : rot 180:sc= 0 USER MOD Single : A 805 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 808 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 809 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 810 SER OG : rot 180:sc= 0 USER MOD Single : A 813 ASN : amide:sc= 0 K(o=0,f=-0.75) USER MOD Single : A 816 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 818 THR OG1 : rot 81:sc= 1.28 USER MOD Single : A 826 THR OG1 : rot 19:sc= 0.396 USER MOD Single : A 834 GLN : amide:sc= -1.2 K(o=-1.2,f=-2.6) USER MOD Single : A 837 TYR OH : rot 180:sc= 0 USER MOD Single : A 842 HIS : no HD1:sc= -0.345 X(o=-0.35,f=0.04) USER MOD Single : A 849 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 261 N TYR A 768 3.234 13.947 -18.269 1.00 2.43 N ATOM 262 CA TYR A 768 3.653 14.618 -17.044 1.00 12.42 C ATOM 263 C TYR A 768 3.631 16.134 -17.218 1.00 33.10 C ATOM 264 O TYR A 768 2.977 16.849 -16.458 1.00 30.34 O ATOM 265 CB TYR A 768 5.055 14.161 -16.640 1.00 64.43 C ATOM 266 CG TYR A 768 5.573 14.829 -15.387 1.00 21.34 C ATOM 267 CD1 TYR A 768 6.818 15.445 -15.368 1.00 41.41 C ATOM 268 CD2 TYR A 768 4.818 14.842 -14.220 1.00 41.43 C ATOM 269 CE1 TYR A 768 7.296 16.056 -14.225 1.00 13.51 C ATOM 270 CE2 TYR A 768 5.287 15.452 -13.073 1.00 40.20 C ATOM 271 CZ TYR A 768 6.526 16.058 -13.080 1.00 63.31 C ATOM 272 OH TYR A 768 6.998 16.665 -11.939 1.00 14.02 O ATOM 0 HA TYR A 768 2.950 14.350 -16.255 1.00 12.42 H new ATOM 0 HB2 TYR A 768 5.046 13.082 -16.489 1.00 64.43 H new ATOM 0 HB3 TYR A 768 5.744 14.363 -17.460 1.00 64.43 H new ATOM 0 HD1 TYR A 768 7.423 15.446 -16.263 1.00 41.41 H new ATOM 0 HD2 TYR A 768 3.848 14.367 -14.210 1.00 41.43 H new ATOM 0 HE1 TYR A 768 8.267 16.529 -14.228 1.00 13.51 H new ATOM 0 HE2 TYR A 768 4.687 15.454 -12.175 1.00 40.20 H new ATOM 0 HH TYR A 768 6.334 16.578 -11.224 1.00 14.02 H new ATOM 282 N HIS A 769 4.350 16.618 -18.226 1.00 31.32 N ATOM 283 CA HIS A 769 4.413 18.048 -18.502 1.00 50.44 C ATOM 284 C HIS A 769 3.012 18.642 -18.617 1.00 61.10 C ATOM 285 O HIS A 769 2.737 19.716 -18.081 1.00 74.53 O ATOM 286 CB HIS A 769 5.196 18.306 -19.790 1.00 54.33 C ATOM 287 CG HIS A 769 6.679 18.184 -19.624 1.00 41.33 C ATOM 288 ND1 HIS A 769 7.266 17.533 -18.560 1.00 63.33 N ATOM 289 CD2 HIS A 769 7.696 18.634 -20.396 1.00 23.20 C ATOM 290 CE1 HIS A 769 8.580 17.588 -18.684 1.00 4.12 C ATOM 291 NE2 HIS A 769 8.867 18.251 -19.790 1.00 24.42 N ATOM 0 H HIS A 769 4.897 16.041 -18.865 1.00 31.32 H new ATOM 0 HA HIS A 769 4.926 18.531 -17.670 1.00 50.44 H new ATOM 0 HB2 HIS A 769 4.865 17.602 -20.554 1.00 54.33 H new ATOM 0 HB3 HIS A 769 4.961 19.306 -20.154 1.00 54.33 H new ATOM 0 HD2 HIS A 769 7.603 19.191 -21.317 1.00 23.20 H new ATOM 0 HE1 HIS A 769 9.298 17.163 -17.998 1.00 4.12 H new ATOM 0 HE2 HIS A 769 9.806 18.447 -20.137 1.00 24.42 H new ATOM 299 N ARG A 770 2.131 17.936 -19.319 1.00 44.42 N ATOM 300 CA ARG A 770 0.760 18.395 -19.506 1.00 30.44 C ATOM 301 C ARG A 770 0.046 18.533 -18.164 1.00 41.32 C ATOM 302 O ARG A 770 -0.438 19.611 -17.815 1.00 74.30 O ATOM 303 CB ARG A 770 -0.007 17.424 -20.405 1.00 62.35 C ATOM 304 CG ARG A 770 -1.508 17.430 -20.168 1.00 70.40 C ATOM 305 CD ARG A 770 -2.226 16.483 -21.117 1.00 61.12 C ATOM 306 NE ARG A 770 -1.961 15.083 -20.798 1.00 62.31 N ATOM 307 CZ ARG A 770 -2.576 14.422 -19.824 1.00 33.21 C ATOM 308 NH1 ARG A 770 -3.488 15.031 -19.078 1.00 63.31 N ATOM 309 NH2 ARG A 770 -2.281 13.149 -19.595 1.00 23.34 N ATOM 0 H ARG A 770 2.342 17.044 -19.767 1.00 44.42 H new ATOM 0 HA ARG A 770 0.793 19.374 -19.984 1.00 30.44 H new ATOM 0 HB2 ARG A 770 0.189 17.676 -21.447 1.00 62.35 H new ATOM 0 HB3 ARG A 770 0.374 16.415 -20.244 1.00 62.35 H new ATOM 0 HG2 ARG A 770 -1.716 17.141 -19.138 1.00 70.40 H new ATOM 0 HG3 ARG A 770 -1.894 18.441 -20.300 1.00 70.40 H new ATOM 0 HD2 ARG A 770 -3.299 16.668 -21.071 1.00 61.12 H new ATOM 0 HD3 ARG A 770 -1.911 16.687 -22.140 1.00 61.12 H new ATOM 0 HE ARG A 770 -1.265 14.585 -21.354 1.00 62.31 H new ATOM 0 HH11 ARG A 770 -3.719 16.009 -19.252 1.00 63.31 H new ATOM 0 HH12 ARG A 770 -3.959 14.521 -18.331 1.00 63.31 H new ATOM 0 HH21 ARG A 770 -1.581 12.677 -20.167 1.00 23.34 H new ATOM 0 HH22 ARG A 770 -2.754 12.643 -18.847 1.00 23.34 H new ATOM 323 N LEU A 771 -0.016 17.437 -17.417 1.00 23.13 N ATOM 324 CA LEU A 771 -0.671 17.435 -16.113 1.00 42.43 C ATOM 325 C LEU A 771 -0.171 18.591 -15.251 1.00 73.54 C ATOM 326 O LEU A 771 -0.963 19.367 -14.717 1.00 52.12 O ATOM 327 CB LEU A 771 -0.424 16.106 -15.398 1.00 3.22 C ATOM 328 CG LEU A 771 -1.485 15.683 -14.382 1.00 12.44 C ATOM 329 CD1 LEU A 771 -2.775 15.295 -15.087 1.00 51.24 C ATOM 330 CD2 LEU A 771 -0.976 14.533 -13.526 1.00 70.50 C ATOM 0 H LEU A 771 0.379 16.538 -17.691 1.00 23.13 H new ATOM 0 HA LEU A 771 -1.742 17.561 -16.271 1.00 42.43 H new ATOM 0 HB2 LEU A 771 -0.337 15.322 -16.151 1.00 3.22 H new ATOM 0 HB3 LEU A 771 0.537 16.165 -14.887 1.00 3.22 H new ATOM 0 HG LEU A 771 -1.693 16.531 -13.729 1.00 12.44 H new ATOM 0 HD11 LEU A 771 -3.518 14.997 -14.348 1.00 51.24 H new ATOM 0 HD12 LEU A 771 -3.150 16.147 -15.655 1.00 51.24 H new ATOM 0 HD13 LEU A 771 -2.583 14.463 -15.765 1.00 51.24 H new ATOM 0 HD21 LEU A 771 -1.745 14.245 -12.809 1.00 70.50 H new ATOM 0 HD22 LEU A 771 -0.738 13.682 -14.164 1.00 70.50 H new ATOM 0 HD23 LEU A 771 -0.080 14.847 -12.991 1.00 70.50 H new ATOM 342 N ARG A 772 1.147 18.699 -15.122 1.00 60.42 N ATOM 343 CA ARG A 772 1.752 19.760 -14.326 1.00 63.53 C ATOM 344 C ARG A 772 1.396 21.132 -14.890 1.00 4.34 C ATOM 345 O ARG A 772 1.269 22.105 -14.146 1.00 41.43 O ATOM 346 CB ARG A 772 3.272 19.592 -14.285 1.00 63.43 C ATOM 347 CG ARG A 772 3.917 20.181 -13.041 1.00 51.14 C ATOM 348 CD ARG A 772 3.488 19.437 -11.786 1.00 42.32 C ATOM 349 NE ARG A 772 4.291 19.814 -10.626 1.00 21.12 N ATOM 350 CZ ARG A 772 4.339 19.104 -9.504 1.00 3.31 C ATOM 351 NH1 ARG A 772 3.635 17.987 -9.392 1.00 31.42 N ATOM 352 NH2 ARG A 772 5.094 19.512 -8.491 1.00 53.14 N ATOM 0 H ARG A 772 1.816 18.065 -15.558 1.00 60.42 H new ATOM 0 HA ARG A 772 1.358 19.690 -13.312 1.00 63.53 H new ATOM 0 HB2 ARG A 772 3.513 18.531 -14.341 1.00 63.43 H new ATOM 0 HB3 ARG A 772 3.705 20.064 -15.167 1.00 63.43 H new ATOM 0 HG2 ARG A 772 5.002 20.139 -13.138 1.00 51.14 H new ATOM 0 HG3 ARG A 772 3.646 21.233 -12.952 1.00 51.14 H new ATOM 0 HD2 ARG A 772 2.437 19.644 -11.583 1.00 42.32 H new ATOM 0 HD3 ARG A 772 3.574 18.363 -11.953 1.00 42.32 H new ATOM 0 HE ARG A 772 4.845 20.669 -10.680 1.00 21.12 H new ATOM 0 HH11 ARG A 772 3.054 17.670 -10.168 1.00 31.42 H new ATOM 0 HH12 ARG A 772 3.674 17.444 -8.529 1.00 31.42 H new ATOM 0 HH21 ARG A 772 5.638 20.371 -8.574 1.00 53.14 H new ATOM 0 HH22 ARG A 772 5.130 18.966 -7.630 1.00 53.14 H new ATOM 366 N ASP A 773 1.238 21.202 -16.207 1.00 0.43 N ATOM 367 CA ASP A 773 0.896 22.455 -16.870 1.00 4.40 C ATOM 368 C ASP A 773 -0.500 22.920 -16.469 1.00 32.44 C ATOM 369 O ASP A 773 -0.671 24.013 -15.927 1.00 20.53 O ATOM 370 CB ASP A 773 0.976 22.291 -18.389 1.00 1.54 C ATOM 371 CG ASP A 773 0.949 23.621 -19.117 1.00 34.04 C ATOM 372 OD1 ASP A 773 0.949 23.613 -20.365 1.00 44.32 O ATOM 373 OD2 ASP A 773 0.927 24.669 -18.438 1.00 2.32 O ATOM 0 H ASP A 773 1.341 20.406 -16.837 1.00 0.43 H new ATOM 0 HA ASP A 773 1.615 23.212 -16.555 1.00 4.40 H new ATOM 0 HB2 ASP A 773 1.891 21.758 -18.646 1.00 1.54 H new ATOM 0 HB3 ASP A 773 0.143 21.677 -18.730 1.00 1.54 H new ATOM 378 N LEU A 774 -1.496 22.083 -16.739 1.00 13.33 N ATOM 379 CA LEU A 774 -2.879 22.408 -16.407 1.00 33.13 C ATOM 380 C LEU A 774 -3.019 22.743 -14.925 1.00 74.32 C ATOM 381 O LEU A 774 -3.649 23.736 -14.559 1.00 1.11 O ATOM 382 CB LEU A 774 -3.799 21.239 -16.766 1.00 44.54 C ATOM 383 CG LEU A 774 -4.281 21.186 -18.217 1.00 4.45 C ATOM 384 CD1 LEU A 774 -5.109 22.418 -18.549 1.00 61.31 C ATOM 385 CD2 LEU A 774 -3.099 21.064 -19.167 1.00 63.32 C ATOM 0 H LEU A 774 -1.372 21.175 -17.187 1.00 13.33 H new ATOM 0 HA LEU A 774 -3.170 23.283 -16.988 1.00 33.13 H new ATOM 0 HB2 LEU A 774 -3.276 20.309 -16.544 1.00 44.54 H new ATOM 0 HB3 LEU A 774 -4.672 21.277 -16.115 1.00 44.54 H new ATOM 0 HG LEU A 774 -4.912 20.305 -18.339 1.00 4.45 H new ATOM 0 HD11 LEU A 774 -5.443 22.363 -19.585 1.00 61.31 H new ATOM 0 HD12 LEU A 774 -5.976 22.462 -17.890 1.00 61.31 H new ATOM 0 HD13 LEU A 774 -4.502 23.313 -18.410 1.00 61.31 H new ATOM 0 HD21 LEU A 774 -3.460 21.028 -20.195 1.00 63.32 H new ATOM 0 HD22 LEU A 774 -2.443 21.925 -19.043 1.00 63.32 H new ATOM 0 HD23 LEU A 774 -2.546 20.151 -18.944 1.00 63.32 H new ATOM 397 N LEU A 775 -2.427 21.909 -14.077 1.00 53.11 N ATOM 398 CA LEU A 775 -2.484 22.118 -12.634 1.00 62.54 C ATOM 399 C LEU A 775 -1.932 23.490 -12.260 1.00 73.44 C ATOM 400 O LEU A 775 -2.582 24.260 -11.551 1.00 61.54 O ATOM 401 CB LEU A 775 -1.697 21.024 -11.910 1.00 45.11 C ATOM 402 CG LEU A 775 -2.176 20.673 -10.501 1.00 72.13 C ATOM 403 CD1 LEU A 775 -3.596 20.130 -10.541 1.00 31.42 C ATOM 404 CD2 LEU A 775 -1.236 19.667 -9.853 1.00 72.12 C ATOM 0 H LEU A 775 -1.902 21.082 -14.363 1.00 53.11 H new ATOM 0 HA LEU A 775 -3.528 22.071 -12.325 1.00 62.54 H new ATOM 0 HB2 LEU A 775 -1.727 20.120 -12.518 1.00 45.11 H new ATOM 0 HB3 LEU A 775 -0.654 21.334 -11.851 1.00 45.11 H new ATOM 0 HG LEU A 775 -2.173 21.582 -9.899 1.00 72.13 H new ATOM 0 HD11 LEU A 775 -3.921 19.885 -9.530 1.00 31.42 H new ATOM 0 HD12 LEU A 775 -4.262 20.883 -10.964 1.00 31.42 H new ATOM 0 HD13 LEU A 775 -3.625 19.232 -11.158 1.00 31.42 H new ATOM 0 HD21 LEU A 775 -1.593 19.429 -8.851 1.00 72.12 H new ATOM 0 HD22 LEU A 775 -1.206 18.758 -10.453 1.00 72.12 H new ATOM 0 HD23 LEU A 775 -0.235 20.093 -9.790 1.00 72.12 H new ATOM 416 N LEU A 776 -0.732 23.790 -12.743 1.00 3.32 N ATOM 417 CA LEU A 776 -0.093 25.071 -12.461 1.00 40.34 C ATOM 418 C LEU A 776 -1.009 26.231 -12.838 1.00 51.14 C ATOM 419 O LEU A 776 -1.199 27.164 -12.058 1.00 4.34 O ATOM 420 CB LEU A 776 1.229 25.183 -13.223 1.00 21.53 C ATOM 421 CG LEU A 776 2.279 26.112 -12.613 1.00 31.14 C ATOM 422 CD1 LEU A 776 1.780 27.549 -12.605 1.00 21.51 C ATOM 423 CD2 LEU A 776 2.635 25.662 -11.203 1.00 64.44 C ATOM 0 H LEU A 776 -0.182 23.164 -13.331 1.00 3.32 H new ATOM 0 HA LEU A 776 0.106 25.122 -11.391 1.00 40.34 H new ATOM 0 HB2 LEU A 776 1.661 24.186 -13.309 1.00 21.53 H new ATOM 0 HB3 LEU A 776 1.014 25.526 -14.235 1.00 21.53 H new ATOM 0 HG LEU A 776 3.179 26.064 -13.227 1.00 31.14 H new ATOM 0 HD11 LEU A 776 2.540 28.196 -12.167 1.00 21.51 H new ATOM 0 HD12 LEU A 776 1.576 27.869 -13.627 1.00 21.51 H new ATOM 0 HD13 LEU A 776 0.866 27.613 -12.015 1.00 21.51 H new ATOM 0 HD21 LEU A 776 3.384 26.335 -10.784 1.00 64.44 H new ATOM 0 HD22 LEU A 776 1.742 25.680 -10.579 1.00 64.44 H new ATOM 0 HD23 LEU A 776 3.035 24.649 -11.235 1.00 64.44 H new ATOM 435 N ILE A 777 -1.576 26.164 -14.038 1.00 52.51 N ATOM 436 CA ILE A 777 -2.475 27.207 -14.517 1.00 11.34 C ATOM 437 C ILE A 777 -3.693 27.343 -13.609 1.00 23.24 C ATOM 438 O ILE A 777 -4.159 28.450 -13.338 1.00 71.44 O ATOM 439 CB ILE A 777 -2.950 26.925 -15.954 1.00 41.34 C ATOM 440 CG1 ILE A 777 -1.758 26.902 -16.913 1.00 24.50 C ATOM 441 CG2 ILE A 777 -3.967 27.969 -16.391 1.00 4.52 C ATOM 442 CD1 ILE A 777 -1.060 28.237 -17.043 1.00 2.33 C ATOM 0 H ILE A 777 -1.429 25.399 -14.696 1.00 52.51 H new ATOM 0 HA ILE A 777 -1.910 28.139 -14.506 1.00 11.34 H new ATOM 0 HB ILE A 777 -3.430 25.947 -15.976 1.00 41.34 H new ATOM 0 HG12 ILE A 777 -1.040 26.158 -16.569 1.00 24.50 H new ATOM 0 HG13 ILE A 777 -2.100 26.583 -17.897 1.00 24.50 H new ATOM 0 HG21 ILE A 777 -4.293 27.756 -17.409 1.00 4.52 H new ATOM 0 HG22 ILE A 777 -4.827 27.942 -15.722 1.00 4.52 H new ATOM 0 HG23 ILE A 777 -3.511 28.958 -16.356 1.00 4.52 H new ATOM 0 HD11 ILE A 777 -0.226 28.145 -17.738 1.00 2.33 H new ATOM 0 HD12 ILE A 777 -1.764 28.981 -17.417 1.00 2.33 H new ATOM 0 HD13 ILE A 777 -0.687 28.549 -16.068 1.00 2.33 H new ATOM 454 N VAL A 778 -4.203 26.209 -13.138 1.00 65.23 N ATOM 455 CA VAL A 778 -5.364 26.200 -12.258 1.00 14.34 C ATOM 456 C VAL A 778 -5.068 26.926 -10.950 1.00 21.53 C ATOM 457 O VAL A 778 -5.688 27.942 -10.635 1.00 74.22 O ATOM 458 CB VAL A 778 -5.820 24.763 -11.943 1.00 23.10 C ATOM 459 CG1 VAL A 778 -6.983 24.774 -10.963 1.00 73.53 C ATOM 460 CG2 VAL A 778 -6.196 24.032 -13.223 1.00 32.33 C ATOM 0 H VAL A 778 -3.829 25.284 -13.352 1.00 65.23 H new ATOM 0 HA VAL A 778 -6.164 26.719 -12.786 1.00 14.34 H new ATOM 0 HB VAL A 778 -4.991 24.230 -11.478 1.00 23.10 H new ATOM 0 HG11 VAL A 778 -7.291 23.750 -10.753 1.00 73.53 H new ATOM 0 HG12 VAL A 778 -6.673 25.257 -10.036 1.00 73.53 H new ATOM 0 HG13 VAL A 778 -7.819 25.323 -11.397 1.00 73.53 H new ATOM 0 HG21 VAL A 778 -6.516 23.018 -12.982 1.00 32.33 H new ATOM 0 HG22 VAL A 778 -7.010 24.561 -13.719 1.00 32.33 H new ATOM 0 HG23 VAL A 778 -5.332 23.992 -13.886 1.00 32.33 H new ATOM 470 N THR A 779 -4.114 26.397 -10.189 1.00 70.03 N ATOM 471 CA THR A 779 -3.735 26.993 -8.915 1.00 22.15 C ATOM 472 C THR A 779 -3.373 28.464 -9.081 1.00 54.44 C ATOM 473 O THR A 779 -3.688 29.291 -8.225 1.00 50.44 O ATOM 474 CB THR A 779 -2.542 26.252 -8.281 1.00 34.14 C ATOM 475 OG1 THR A 779 -2.161 26.893 -7.059 1.00 5.43 O ATOM 476 CG2 THR A 779 -1.357 26.219 -9.234 1.00 33.43 C ATOM 0 H THR A 779 -3.590 25.557 -10.434 1.00 70.03 H new ATOM 0 HA THR A 779 -4.600 26.906 -8.257 1.00 22.15 H new ATOM 0 HB THR A 779 -2.848 25.227 -8.073 1.00 34.14 H new ATOM 0 HG1 THR A 779 -1.403 26.415 -6.661 1.00 5.43 H new ATOM 0 HG21 THR A 779 -0.527 25.691 -8.764 1.00 33.43 H new ATOM 0 HG22 THR A 779 -1.642 25.704 -10.151 1.00 33.43 H new ATOM 0 HG23 THR A 779 -1.051 27.238 -9.470 1.00 33.43 H new ATOM 484 N ARG A 780 -2.712 28.785 -10.189 1.00 22.43 N ATOM 485 CA ARG A 780 -2.307 30.157 -10.467 1.00 54.40 C ATOM 486 C ARG A 780 -3.524 31.074 -10.560 1.00 5.33 C ATOM 487 O ARG A 780 -3.624 32.064 -9.834 1.00 23.12 O ATOM 488 CB ARG A 780 -1.506 30.222 -11.769 1.00 35.42 C ATOM 489 CG ARG A 780 -0.001 30.221 -11.558 1.00 52.05 C ATOM 490 CD ARG A 780 0.458 31.464 -10.813 1.00 15.34 C ATOM 491 NE ARG A 780 1.913 31.570 -10.768 1.00 44.14 N ATOM 492 CZ ARG A 780 2.662 31.860 -11.827 1.00 73.41 C ATOM 493 NH1 ARG A 780 2.094 32.072 -13.006 1.00 70.53 N ATOM 494 NH2 ARG A 780 3.981 31.938 -11.707 1.00 51.22 N ATOM 0 H ARG A 780 -2.446 28.113 -10.909 1.00 22.43 H new ATOM 0 HA ARG A 780 -1.678 30.497 -9.644 1.00 54.40 H new ATOM 0 HB2 ARG A 780 -1.777 29.372 -12.395 1.00 35.42 H new ATOM 0 HB3 ARG A 780 -1.787 31.123 -12.314 1.00 35.42 H new ATOM 0 HG2 ARG A 780 0.288 29.332 -10.997 1.00 52.05 H new ATOM 0 HG3 ARG A 780 0.503 30.167 -12.523 1.00 52.05 H new ATOM 0 HD2 ARG A 780 0.045 32.349 -11.297 1.00 15.34 H new ATOM 0 HD3 ARG A 780 0.065 31.443 -9.797 1.00 15.34 H new ATOM 0 HE ARG A 780 2.381 31.413 -9.875 1.00 44.14 H new ATOM 0 HH11 ARG A 780 1.080 32.013 -13.102 1.00 70.53 H new ATOM 0 HH12 ARG A 780 2.671 32.294 -13.817 1.00 70.53 H new ATOM 0 HH21 ARG A 780 4.421 31.775 -10.801 1.00 51.22 H new ATOM 0 HH22 ARG A 780 4.555 32.161 -12.520 1.00 51.22 H new ATOM 508 N ILE A 781 -4.444 30.739 -11.457 1.00 71.52 N ATOM 509 CA ILE A 781 -5.653 31.531 -11.644 1.00 0.11 C ATOM 510 C ILE A 781 -6.436 31.655 -10.341 1.00 44.41 C ATOM 511 O ILE A 781 -6.960 32.721 -10.018 1.00 42.54 O ATOM 512 CB ILE A 781 -6.567 30.919 -12.722 1.00 64.12 C ATOM 513 CG1 ILE A 781 -5.828 30.835 -14.060 1.00 12.13 C ATOM 514 CG2 ILE A 781 -7.840 31.738 -12.865 1.00 14.44 C ATOM 515 CD1 ILE A 781 -6.365 29.761 -14.980 1.00 0.21 C ATOM 0 H ILE A 781 -4.375 29.924 -12.066 1.00 71.52 H new ATOM 0 HA ILE A 781 -5.334 32.521 -11.970 1.00 0.11 H new ATOM 0 HB ILE A 781 -6.841 29.910 -12.415 1.00 64.12 H new ATOM 0 HG12 ILE A 781 -5.894 31.800 -14.563 1.00 12.13 H new ATOM 0 HG13 ILE A 781 -4.771 30.645 -13.871 1.00 12.13 H new ATOM 0 HG21 ILE A 781 -8.475 31.292 -13.631 1.00 14.44 H new ATOM 0 HG22 ILE A 781 -8.373 31.751 -11.914 1.00 14.44 H new ATOM 0 HG23 ILE A 781 -7.586 32.758 -13.153 1.00 14.44 H new ATOM 0 HD11 ILE A 781 -5.794 29.759 -15.909 1.00 0.21 H new ATOM 0 HD12 ILE A 781 -6.274 28.789 -14.496 1.00 0.21 H new ATOM 0 HD13 ILE A 781 -7.414 29.961 -15.199 1.00 0.21 H new ATOM 527 N VAL A 782 -6.509 30.558 -9.594 1.00 54.15 N ATOM 528 CA VAL A 782 -7.225 30.544 -8.324 1.00 54.25 C ATOM 529 C VAL A 782 -6.631 31.552 -7.347 1.00 41.24 C ATOM 530 O VAL A 782 -7.356 32.314 -6.709 1.00 52.11 O ATOM 531 CB VAL A 782 -7.200 29.145 -7.681 1.00 4.12 C ATOM 532 CG1 VAL A 782 -7.948 29.152 -6.357 1.00 13.42 C ATOM 533 CG2 VAL A 782 -7.788 28.112 -8.630 1.00 24.34 C ATOM 0 H VAL A 782 -6.081 29.667 -9.847 1.00 54.15 H new ATOM 0 HA VAL A 782 -8.258 30.818 -8.540 1.00 54.25 H new ATOM 0 HB VAL A 782 -6.163 28.874 -7.483 1.00 4.12 H new ATOM 0 HG11 VAL A 782 -7.919 28.155 -5.918 1.00 13.42 H new ATOM 0 HG12 VAL A 782 -7.477 29.862 -5.677 1.00 13.42 H new ATOM 0 HG13 VAL A 782 -8.984 29.444 -6.526 1.00 13.42 H new ATOM 0 HG21 VAL A 782 -7.762 27.129 -8.159 1.00 24.34 H new ATOM 0 HG22 VAL A 782 -8.820 28.376 -8.862 1.00 24.34 H new ATOM 0 HG23 VAL A 782 -7.204 28.089 -9.550 1.00 24.34 H new ATOM 543 N GLU A 783 -5.306 31.550 -7.237 1.00 11.34 N ATOM 544 CA GLU A 783 -4.614 32.465 -6.336 1.00 52.23 C ATOM 545 C GLU A 783 -4.664 33.894 -6.869 1.00 50.32 C ATOM 546 O GLU A 783 -4.731 34.854 -6.100 1.00 25.02 O ATOM 547 CB GLU A 783 -3.159 32.029 -6.149 1.00 54.45 C ATOM 548 CG GLU A 783 -2.569 32.439 -4.811 1.00 25.32 C ATOM 549 CD GLU A 783 -1.479 31.495 -4.341 1.00 21.41 C ATOM 550 OE1 GLU A 783 -0.402 31.470 -4.972 1.00 61.42 O ATOM 551 OE2 GLU A 783 -1.704 30.781 -3.341 1.00 61.20 O ATOM 0 H GLU A 783 -4.691 30.926 -7.760 1.00 11.34 H new ATOM 0 HA GLU A 783 -5.121 32.437 -5.371 1.00 52.23 H new ATOM 0 HB2 GLU A 783 -3.098 30.945 -6.247 1.00 54.45 H new ATOM 0 HB3 GLU A 783 -2.555 32.456 -6.949 1.00 54.45 H new ATOM 0 HG2 GLU A 783 -2.162 33.447 -4.891 1.00 25.32 H new ATOM 0 HG3 GLU A 783 -3.362 32.474 -4.064 1.00 25.32 H new ATOM 850 N LEU A 800 -24.352 48.737 -3.912 1.00 31.13 N ATOM 851 CA LEU A 800 -25.298 48.756 -2.801 1.00 24.31 C ATOM 852 C LEU A 800 -25.729 50.182 -2.477 1.00 52.43 C ATOM 853 O LEU A 800 -26.914 50.511 -2.539 1.00 45.21 O ATOM 854 CB LEU A 800 -24.674 48.106 -1.564 1.00 15.30 C ATOM 855 CG LEU A 800 -24.901 46.602 -1.409 1.00 54.13 C ATOM 856 CD1 LEU A 800 -24.081 46.055 -0.251 1.00 72.25 C ATOM 857 CD2 LEU A 800 -26.380 46.304 -1.206 1.00 63.10 C ATOM 0 HA LEU A 800 -26.180 48.188 -3.097 1.00 24.31 H new ATOM 0 HB2 LEU A 800 -23.600 48.291 -1.584 1.00 15.30 H new ATOM 0 HB3 LEU A 800 -25.067 48.606 -0.679 1.00 15.30 H new ATOM 0 HG LEU A 800 -24.574 46.108 -2.324 1.00 54.13 H new ATOM 0 HD11 LEU A 800 -24.255 44.983 -0.156 1.00 72.25 H new ATOM 0 HD12 LEU A 800 -23.022 46.235 -0.438 1.00 72.25 H new ATOM 0 HD13 LEU A 800 -24.377 46.554 0.672 1.00 72.25 H new ATOM 0 HD21 LEU A 800 -26.523 45.229 -1.098 1.00 63.10 H new ATOM 0 HD22 LEU A 800 -26.733 46.810 -0.307 1.00 63.10 H new ATOM 0 HD23 LEU A 800 -26.945 46.660 -2.068 1.00 63.10 H new ATOM 869 N GLN A 801 -24.760 51.025 -2.135 1.00 12.03 N ATOM 870 CA GLN A 801 -25.041 52.417 -1.803 1.00 43.02 C ATOM 871 C GLN A 801 -25.614 53.158 -3.007 1.00 5.44 C ATOM 872 O GLN A 801 -26.449 54.050 -2.859 1.00 13.34 O ATOM 873 CB GLN A 801 -23.768 53.114 -1.318 1.00 54.10 C ATOM 874 CG GLN A 801 -23.236 52.563 -0.005 1.00 65.03 C ATOM 875 CD GLN A 801 -24.143 52.873 1.169 1.00 60.31 C ATOM 876 OE1 GLN A 801 -25.159 53.552 1.021 1.00 73.23 O ATOM 877 NE2 GLN A 801 -23.780 52.375 2.345 1.00 31.22 N ATOM 0 H GLN A 801 -23.774 50.769 -2.081 1.00 12.03 H new ATOM 0 HA GLN A 801 -25.782 52.432 -1.004 1.00 43.02 H new ATOM 0 HB2 GLN A 801 -22.997 53.017 -2.082 1.00 54.10 H new ATOM 0 HB3 GLN A 801 -23.969 54.179 -1.201 1.00 54.10 H new ATOM 0 HG2 GLN A 801 -23.116 51.483 -0.091 1.00 65.03 H new ATOM 0 HG3 GLN A 801 -22.247 52.980 0.185 1.00 65.03 H new ATOM 0 HE21 GLN A 801 -22.929 51.817 2.422 1.00 31.22 H new ATOM 0 HE22 GLN A 801 -24.352 52.550 3.171 1.00 31.22 H new ATOM 886 N TYR A 802 -25.159 52.784 -4.197 1.00 64.01 N ATOM 887 CA TYR A 802 -25.624 53.415 -5.426 1.00 42.52 C ATOM 888 C TYR A 802 -27.122 53.198 -5.617 1.00 43.03 C ATOM 889 O TYR A 802 -27.895 54.153 -5.688 1.00 43.41 O ATOM 890 CB TYR A 802 -24.859 52.862 -6.630 1.00 32.12 C ATOM 891 CG TYR A 802 -25.477 53.228 -7.960 1.00 72.13 C ATOM 892 CD1 TYR A 802 -25.965 54.508 -8.193 1.00 31.00 C ATOM 893 CD2 TYR A 802 -25.574 52.294 -8.984 1.00 71.12 C ATOM 894 CE1 TYR A 802 -26.531 54.847 -9.407 1.00 33.13 C ATOM 895 CE2 TYR A 802 -26.137 52.624 -10.202 1.00 13.34 C ATOM 896 CZ TYR A 802 -26.615 53.902 -10.408 1.00 24.11 C ATOM 897 OH TYR A 802 -27.178 54.235 -11.619 1.00 24.43 O ATOM 0 H TYR A 802 -24.468 52.047 -4.337 1.00 64.01 H new ATOM 0 HA TYR A 802 -25.438 54.486 -5.347 1.00 42.52 H new ATOM 0 HB2 TYR A 802 -23.835 53.233 -6.601 1.00 32.12 H new ATOM 0 HB3 TYR A 802 -24.807 51.776 -6.549 1.00 32.12 H new ATOM 0 HD1 TYR A 802 -25.901 55.251 -7.412 1.00 31.00 H new ATOM 0 HD2 TYR A 802 -25.203 51.292 -8.825 1.00 71.12 H new ATOM 0 HE1 TYR A 802 -26.906 55.847 -9.571 1.00 33.13 H new ATOM 0 HE2 TYR A 802 -26.203 51.886 -10.988 1.00 13.34 H new ATOM 0 HH TYR A 802 -27.159 53.456 -12.214 1.00 24.43 H new ATOM 907 N TRP A 803 -27.523 51.935 -5.699 1.00 74.12 N ATOM 908 CA TRP A 803 -28.929 51.590 -5.881 1.00 41.34 C ATOM 909 C TRP A 803 -29.777 52.144 -4.742 1.00 32.11 C ATOM 910 O TRP A 803 -30.823 52.750 -4.972 1.00 53.35 O ATOM 911 CB TRP A 803 -29.096 50.072 -5.967 1.00 51.33 C ATOM 912 CG TRP A 803 -28.351 49.456 -7.112 1.00 44.54 C ATOM 913 CD1 TRP A 803 -27.477 48.408 -7.053 1.00 15.11 C ATOM 914 CD2 TRP A 803 -28.412 49.853 -8.487 1.00 23.21 C ATOM 915 NE1 TRP A 803 -26.992 48.129 -8.308 1.00 20.24 N ATOM 916 CE2 TRP A 803 -27.550 49.000 -9.205 1.00 13.31 C ATOM 917 CE3 TRP A 803 -29.112 50.843 -9.181 1.00 44.12 C ATOM 918 CZ2 TRP A 803 -27.371 49.111 -10.581 1.00 72.02 C ATOM 919 CZ3 TRP A 803 -28.932 50.952 -10.547 1.00 75.11 C ATOM 920 CH2 TRP A 803 -28.069 50.090 -11.236 1.00 22.44 C ATOM 0 H TRP A 803 -26.896 51.133 -5.642 1.00 74.12 H new ATOM 0 HA TRP A 803 -29.270 52.039 -6.814 1.00 41.34 H new ATOM 0 HB2 TRP A 803 -28.752 49.623 -5.035 1.00 51.33 H new ATOM 0 HB3 TRP A 803 -30.156 49.835 -6.063 1.00 51.33 H new ATOM 0 HD1 TRP A 803 -27.207 47.877 -6.152 1.00 15.11 H new ATOM 0 HE1 TRP A 803 -26.324 47.392 -8.535 1.00 20.24 H new ATOM 0 HE3 TRP A 803 -29.782 51.511 -8.660 1.00 44.12 H new ATOM 0 HZ2 TRP A 803 -26.705 48.448 -11.113 1.00 72.02 H new ATOM 0 HZ3 TRP A 803 -29.466 51.715 -11.093 1.00 75.11 H new ATOM 0 HH2 TRP A 803 -27.952 50.200 -12.304 1.00 22.44 H new ATOM 931 N SER A 804 -29.320 51.932 -3.512 1.00 62.30 N ATOM 932 CA SER A 804 -30.039 52.407 -2.336 1.00 75.12 C ATOM 933 C SER A 804 -30.363 53.893 -2.461 1.00 72.41 C ATOM 934 O SER A 804 -31.529 54.286 -2.464 1.00 73.23 O ATOM 935 CB SER A 804 -29.215 52.158 -1.072 1.00 63.40 C ATOM 936 OG SER A 804 -30.019 52.260 0.090 1.00 10.12 O ATOM 0 H SER A 804 -28.454 51.434 -3.304 1.00 62.30 H new ATOM 0 HA SER A 804 -30.975 51.853 -2.265 1.00 75.12 H new ATOM 0 HB2 SER A 804 -28.762 51.168 -1.119 1.00 63.40 H new ATOM 0 HB3 SER A 804 -28.399 52.879 -1.018 1.00 63.40 H new ATOM 0 HG SER A 804 -29.469 52.095 0.884 1.00 10.12 H new ATOM 942 N GLN A 805 -29.322 54.712 -2.564 1.00 2.13 N ATOM 943 CA GLN A 805 -29.495 56.155 -2.688 1.00 62.51 C ATOM 944 C GLN A 805 -30.344 56.498 -3.907 1.00 73.23 C ATOM 945 O GLN A 805 -31.110 57.461 -3.890 1.00 71.20 O ATOM 946 CB GLN A 805 -28.134 56.846 -2.789 1.00 20.21 C ATOM 947 CG GLN A 805 -27.460 57.062 -1.443 1.00 53.14 C ATOM 948 CD GLN A 805 -26.074 57.661 -1.574 1.00 62.15 C ATOM 949 OE1 GLN A 805 -25.077 57.030 -1.224 1.00 24.43 O ATOM 950 NE2 GLN A 805 -26.003 58.886 -2.082 1.00 74.00 N ATOM 0 H GLN A 805 -28.350 54.402 -2.564 1.00 2.13 H new ATOM 0 HA GLN A 805 -30.011 56.512 -1.796 1.00 62.51 H new ATOM 0 HB2 GLN A 805 -27.479 56.248 -3.423 1.00 20.21 H new ATOM 0 HB3 GLN A 805 -28.261 57.810 -3.281 1.00 20.21 H new ATOM 0 HG2 GLN A 805 -28.079 57.719 -0.832 1.00 53.14 H new ATOM 0 HG3 GLN A 805 -27.392 56.109 -0.918 1.00 53.14 H new ATOM 0 HE21 GLN A 805 -26.855 59.373 -2.359 1.00 74.00 H new ATOM 0 HE22 GLN A 805 -25.096 59.340 -2.195 1.00 74.00 H new ATOM 959 N GLU A 806 -30.203 55.704 -4.964 1.00 24.51 N ATOM 960 CA GLU A 806 -30.957 55.925 -6.192 1.00 2.30 C ATOM 961 C GLU A 806 -32.458 55.861 -5.927 1.00 73.25 C ATOM 962 O GLU A 806 -33.208 56.757 -6.317 1.00 1.43 O ATOM 963 CB GLU A 806 -30.569 54.889 -7.249 1.00 51.10 C ATOM 964 CG GLU A 806 -29.876 55.487 -8.462 1.00 25.24 C ATOM 965 CD GLU A 806 -30.854 56.017 -9.491 1.00 54.11 C ATOM 966 OE1 GLU A 806 -31.938 55.416 -9.645 1.00 11.31 O ATOM 967 OE2 GLU A 806 -30.536 57.034 -10.143 1.00 30.21 O ATOM 0 H GLU A 806 -29.573 54.902 -4.994 1.00 24.51 H new ATOM 0 HA GLU A 806 -30.713 56.920 -6.564 1.00 2.30 H new ATOM 0 HB2 GLU A 806 -29.912 54.147 -6.795 1.00 51.10 H new ATOM 0 HB3 GLU A 806 -31.466 54.363 -7.576 1.00 51.10 H new ATOM 0 HG2 GLU A 806 -29.221 56.296 -8.139 1.00 25.24 H new ATOM 0 HG3 GLU A 806 -29.243 54.729 -8.924 1.00 25.24 H new ATOM 974 N LEU A 807 -32.891 54.794 -5.264 1.00 3.41 N ATOM 975 CA LEU A 807 -34.303 54.611 -4.947 1.00 1.21 C ATOM 976 C LEU A 807 -34.772 55.649 -3.933 1.00 15.22 C ATOM 977 O LEU A 807 -35.909 56.120 -3.990 1.00 63.04 O ATOM 978 CB LEU A 807 -34.545 53.203 -4.401 1.00 62.34 C ATOM 979 CG LEU A 807 -34.973 52.151 -5.425 1.00 72.22 C ATOM 980 CD1 LEU A 807 -36.290 52.545 -6.077 1.00 5.22 C ATOM 981 CD2 LEU A 807 -33.891 51.959 -6.478 1.00 12.41 C ATOM 0 H LEU A 807 -32.284 54.043 -4.936 1.00 3.41 H new ATOM 0 HA LEU A 807 -34.876 54.742 -5.865 1.00 1.21 H new ATOM 0 HB2 LEU A 807 -33.630 52.860 -3.918 1.00 62.34 H new ATOM 0 HB3 LEU A 807 -35.311 53.261 -3.628 1.00 62.34 H new ATOM 0 HG LEU A 807 -35.117 51.204 -4.905 1.00 72.22 H new ATOM 0 HD11 LEU A 807 -36.579 51.785 -6.803 1.00 5.22 H new ATOM 0 HD12 LEU A 807 -37.063 52.630 -5.313 1.00 5.22 H new ATOM 0 HD13 LEU A 807 -36.173 53.503 -6.583 1.00 5.22 H new ATOM 0 HD21 LEU A 807 -34.213 51.207 -7.198 1.00 12.41 H new ATOM 0 HD22 LEU A 807 -33.714 52.903 -6.994 1.00 12.41 H new ATOM 0 HD23 LEU A 807 -32.970 51.630 -5.997 1.00 12.41 H new ATOM 993 N LYS A 808 -33.890 56.004 -3.005 1.00 61.11 N ATOM 994 CA LYS A 808 -34.211 56.989 -1.979 1.00 54.14 C ATOM 995 C LYS A 808 -34.415 58.369 -2.596 1.00 13.43 C ATOM 996 O LYS A 808 -35.488 58.959 -2.478 1.00 54.32 O ATOM 997 CB LYS A 808 -33.098 57.046 -0.931 1.00 42.32 C ATOM 998 CG LYS A 808 -33.449 57.888 0.284 1.00 64.05 C ATOM 999 CD LYS A 808 -32.711 57.412 1.524 1.00 43.04 C ATOM 1000 CE LYS A 808 -33.341 56.153 2.098 1.00 21.42 C ATOM 1001 NZ LYS A 808 -33.075 56.015 3.557 1.00 42.11 N ATOM 0 H LYS A 808 -32.946 55.623 -2.942 1.00 61.11 H new ATOM 0 HA LYS A 808 -35.140 56.685 -1.496 1.00 54.14 H new ATOM 0 HB2 LYS A 808 -32.865 56.032 -0.605 1.00 42.32 H new ATOM 0 HB3 LYS A 808 -32.196 57.448 -1.393 1.00 42.32 H new ATOM 0 HG2 LYS A 808 -33.200 58.931 0.089 1.00 64.05 H new ATOM 0 HG3 LYS A 808 -34.524 57.844 0.460 1.00 64.05 H new ATOM 0 HD2 LYS A 808 -31.668 57.217 1.276 1.00 43.04 H new ATOM 0 HD3 LYS A 808 -32.718 58.200 2.278 1.00 43.04 H new ATOM 0 HE2 LYS A 808 -34.417 56.174 1.925 1.00 21.42 H new ATOM 0 HE3 LYS A 808 -32.951 55.280 1.574 1.00 21.42 H new ATOM 0 HZ1 LYS A 808 -33.521 55.144 3.910 1.00 42.11 H new ATOM 0 HZ2 LYS A 808 -32.049 55.969 3.720 1.00 42.11 H new ATOM 0 HZ3 LYS A 808 -33.469 56.835 4.061 1.00 42.11 H new ATOM 1015 N ASN A 809 -33.378 58.878 -3.254 1.00 35.32 N ATOM 1016 CA ASN A 809 -33.445 60.189 -3.890 1.00 21.45 C ATOM 1017 C ASN A 809 -34.596 60.251 -4.889 1.00 33.15 C ATOM 1018 O ASN A 809 -35.343 61.228 -4.930 1.00 54.42 O ATOM 1019 CB ASN A 809 -32.125 60.504 -4.596 1.00 24.53 C ATOM 1020 CG ASN A 809 -32.010 61.966 -4.982 1.00 21.52 C ATOM 1021 OD1 ASN A 809 -31.892 62.839 -4.122 1.00 63.30 O ATOM 1022 ND2 ASN A 809 -32.045 62.239 -6.281 1.00 24.31 N ATOM 0 H ASN A 809 -32.482 58.403 -3.361 1.00 35.32 H new ATOM 0 HA ASN A 809 -33.621 60.933 -3.113 1.00 21.45 H new ATOM 0 HB2 ASN A 809 -31.294 60.237 -3.943 1.00 24.53 H new ATOM 0 HB3 ASN A 809 -32.038 59.887 -5.490 1.00 24.53 H new ATOM 0 HD21 ASN A 809 -31.973 63.205 -6.601 1.00 24.31 H new ATOM 0 HD22 ASN A 809 -32.144 61.483 -6.959 1.00 24.31 H new ATOM 1029 N SER A 810 -34.734 59.201 -5.691 1.00 65.54 N ATOM 1030 CA SER A 810 -35.792 59.137 -6.693 1.00 23.34 C ATOM 1031 C SER A 810 -37.166 59.137 -6.031 1.00 34.41 C ATOM 1032 O SER A 810 -38.037 59.932 -6.383 1.00 61.10 O ATOM 1033 CB SER A 810 -35.630 57.885 -7.558 1.00 4.42 C ATOM 1034 OG SER A 810 -36.507 57.917 -8.670 1.00 35.13 O ATOM 0 H SER A 810 -34.126 58.382 -5.667 1.00 65.54 H new ATOM 0 HA SER A 810 -35.713 60.020 -7.327 1.00 23.34 H new ATOM 0 HB2 SER A 810 -34.600 57.810 -7.906 1.00 4.42 H new ATOM 0 HB3 SER A 810 -35.830 56.997 -6.959 1.00 4.42 H new ATOM 0 HG SER A 810 -36.383 57.107 -9.208 1.00 35.13 H new ATOM 1040 N ALA A 811 -37.353 58.238 -5.070 1.00 34.02 N ATOM 1041 CA ALA A 811 -38.620 58.135 -4.357 1.00 34.54 C ATOM 1042 C ALA A 811 -39.062 59.493 -3.823 1.00 35.10 C ATOM 1043 O ALA A 811 -40.186 59.932 -4.068 1.00 72.24 O ATOM 1044 CB ALA A 811 -38.505 57.130 -3.219 1.00 54.43 C ATOM 0 H ALA A 811 -36.643 57.571 -4.768 1.00 34.02 H new ATOM 0 HA ALA A 811 -39.377 57.787 -5.060 1.00 34.54 H new ATOM 0 HB1 ALA A 811 -39.458 57.063 -2.695 1.00 54.43 H new ATOM 0 HB2 ALA A 811 -38.243 56.152 -3.622 1.00 54.43 H new ATOM 0 HB3 ALA A 811 -37.731 57.455 -2.524 1.00 54.43 H new ATOM 1050 N VAL A 812 -38.172 60.154 -3.091 1.00 3.41 N ATOM 1051 CA VAL A 812 -38.470 61.463 -2.523 1.00 12.54 C ATOM 1052 C VAL A 812 -38.729 62.492 -3.618 1.00 32.03 C ATOM 1053 O VAL A 812 -39.589 63.360 -3.477 1.00 12.21 O ATOM 1054 CB VAL A 812 -37.320 61.962 -1.627 1.00 74.10 C ATOM 1055 CG1 VAL A 812 -37.639 63.340 -1.066 1.00 62.44 C ATOM 1056 CG2 VAL A 812 -37.051 60.970 -0.505 1.00 41.15 C ATOM 0 H VAL A 812 -37.238 59.804 -2.877 1.00 3.41 H new ATOM 0 HA VAL A 812 -39.369 61.347 -1.917 1.00 12.54 H new ATOM 0 HB VAL A 812 -36.418 62.043 -2.234 1.00 74.10 H new ATOM 0 HG11 VAL A 812 -36.815 63.676 -0.436 1.00 62.44 H new ATOM 0 HG12 VAL A 812 -37.778 64.044 -1.887 1.00 62.44 H new ATOM 0 HG13 VAL A 812 -38.552 63.289 -0.473 1.00 62.44 H new ATOM 0 HG21 VAL A 812 -36.236 61.338 0.118 1.00 41.15 H new ATOM 0 HG22 VAL A 812 -37.949 60.855 0.102 1.00 41.15 H new ATOM 0 HG23 VAL A 812 -36.775 60.005 -0.931 1.00 41.15 H new ATOM 1066 N ASN A 813 -37.979 62.387 -4.710 1.00 1.12 N ATOM 1067 CA ASN A 813 -38.127 63.309 -5.830 1.00 72.33 C ATOM 1068 C ASN A 813 -39.484 63.130 -6.506 1.00 25.02 C ATOM 1069 O ASN A 813 -40.096 64.098 -6.959 1.00 34.25 O ATOM 1070 CB ASN A 813 -37.006 63.092 -6.848 1.00 64.40 C ATOM 1071 CG ASN A 813 -36.911 64.223 -7.854 1.00 23.41 C ATOM 1072 OD1 ASN A 813 -37.109 65.389 -7.514 1.00 30.03 O ATOM 1073 ND2 ASN A 813 -36.606 63.881 -9.101 1.00 13.34 N ATOM 0 H ASN A 813 -37.263 61.673 -4.843 1.00 1.12 H new ATOM 0 HA ASN A 813 -38.065 64.326 -5.442 1.00 72.33 H new ATOM 0 HB2 ASN A 813 -36.056 62.996 -6.323 1.00 64.40 H new ATOM 0 HB3 ASN A 813 -37.175 62.153 -7.376 1.00 64.40 H new ATOM 0 HD21 ASN A 813 -36.528 64.598 -9.822 1.00 13.34 H new ATOM 0 HD22 ASN A 813 -36.450 62.901 -9.337 1.00 13.34 H new ATOM 1080 N LEU A 814 -39.947 61.887 -6.570 1.00 31.34 N ATOM 1081 CA LEU A 814 -41.232 61.580 -7.189 1.00 43.01 C ATOM 1082 C LEU A 814 -42.385 62.090 -6.332 1.00 14.24 C ATOM 1083 O LEU A 814 -43.345 62.669 -6.843 1.00 71.43 O ATOM 1084 CB LEU A 814 -41.369 60.072 -7.404 1.00 74.22 C ATOM 1085 CG LEU A 814 -42.330 59.637 -8.512 1.00 24.43 C ATOM 1086 CD1 LEU A 814 -41.683 59.809 -9.877 1.00 41.53 C ATOM 1087 CD2 LEU A 814 -42.764 58.193 -8.304 1.00 51.12 C ATOM 0 H LEU A 814 -39.452 61.075 -6.201 1.00 31.34 H new ATOM 0 HA LEU A 814 -41.272 62.084 -8.155 1.00 43.01 H new ATOM 0 HB2 LEU A 814 -40.382 59.666 -7.626 1.00 74.22 H new ATOM 0 HB3 LEU A 814 -41.697 59.620 -6.468 1.00 74.22 H new ATOM 0 HG LEU A 814 -43.215 60.272 -8.469 1.00 24.43 H new ATOM 0 HD11 LEU A 814 -42.381 59.495 -10.653 1.00 41.53 H new ATOM 0 HD12 LEU A 814 -41.422 60.857 -10.027 1.00 41.53 H new ATOM 0 HD13 LEU A 814 -40.781 59.199 -9.932 1.00 41.53 H new ATOM 0 HD21 LEU A 814 -43.447 57.900 -9.101 1.00 51.12 H new ATOM 0 HD22 LEU A 814 -41.888 57.544 -8.320 1.00 51.12 H new ATOM 0 HD23 LEU A 814 -43.268 58.099 -7.342 1.00 51.12 H new ATOM 1099 N LEU A 815 -42.285 61.874 -5.025 1.00 4.53 N ATOM 1100 CA LEU A 815 -43.319 62.315 -4.095 1.00 22.44 C ATOM 1101 C LEU A 815 -43.445 63.835 -4.100 1.00 24.34 C ATOM 1102 O LEU A 815 -44.538 64.376 -4.258 1.00 2.23 O ATOM 1103 CB LEU A 815 -43.004 61.822 -2.681 1.00 0.21 C ATOM 1104 CG LEU A 815 -43.147 60.318 -2.447 1.00 21.12 C ATOM 1105 CD1 LEU A 815 -42.506 59.920 -1.126 1.00 53.11 C ATOM 1106 CD2 LEU A 815 -44.613 59.911 -2.475 1.00 22.33 C ATOM 0 H LEU A 815 -41.498 61.396 -4.585 1.00 4.53 H new ATOM 0 HA LEU A 815 -44.269 61.890 -4.419 1.00 22.44 H new ATOM 0 HB2 LEU A 815 -41.982 62.112 -2.436 1.00 0.21 H new ATOM 0 HB3 LEU A 815 -43.659 62.342 -1.982 1.00 0.21 H new ATOM 0 HG LEU A 815 -42.630 59.794 -3.251 1.00 21.12 H new ATOM 0 HD11 LEU A 815 -42.618 58.846 -0.976 1.00 53.11 H new ATOM 0 HD12 LEU A 815 -41.447 60.176 -1.144 1.00 53.11 H new ATOM 0 HD13 LEU A 815 -42.994 60.453 -0.310 1.00 53.11 H new ATOM 0 HD21 LEU A 815 -44.696 58.837 -2.307 1.00 22.33 H new ATOM 0 HD22 LEU A 815 -45.153 60.444 -1.693 1.00 22.33 H new ATOM 0 HD23 LEU A 815 -45.041 60.160 -3.446 1.00 22.33 H new ATOM 1118 N ASN A 816 -42.317 64.517 -3.928 1.00 11.25 N ATOM 1119 CA ASN A 816 -42.301 65.975 -3.914 1.00 0.50 C ATOM 1120 C ASN A 816 -42.828 66.538 -5.231 1.00 20.42 C ATOM 1121 O ASN A 816 -43.804 67.286 -5.251 1.00 54.32 O ATOM 1122 CB ASN A 816 -40.882 66.488 -3.659 1.00 51.21 C ATOM 1123 CG ASN A 816 -40.484 66.387 -2.199 1.00 72.33 C ATOM 1124 OD1 ASN A 816 -41.040 65.587 -1.447 1.00 35.41 O ATOM 1125 ND2 ASN A 816 -39.517 67.200 -1.792 1.00 43.10 N ATOM 0 H ASN A 816 -41.403 64.084 -3.797 1.00 11.25 H new ATOM 0 HA ASN A 816 -42.953 66.313 -3.108 1.00 0.50 H new ATOM 0 HB2 ASN A 816 -40.178 65.918 -4.265 1.00 51.21 H new ATOM 0 HB3 ASN A 816 -40.811 67.527 -3.981 1.00 51.21 H new ATOM 0 HD21 ASN A 816 -39.207 67.177 -0.821 1.00 43.10 H new ATOM 0 HD22 ASN A 816 -39.084 67.847 -2.451 1.00 43.10 H new ATOM 1132 N ALA A 817 -42.175 66.170 -6.328 1.00 44.43 N ATOM 1133 CA ALA A 817 -42.578 66.635 -7.649 1.00 55.53 C ATOM 1134 C ALA A 817 -44.073 66.427 -7.872 1.00 3.25 C ATOM 1135 O ALA A 817 -44.761 67.303 -8.396 1.00 75.13 O ATOM 1136 CB ALA A 817 -41.778 65.921 -8.728 1.00 21.11 C ATOM 0 H ALA A 817 -41.364 65.551 -6.328 1.00 44.43 H new ATOM 0 HA ALA A 817 -42.373 67.704 -7.708 1.00 55.53 H new ATOM 0 HB1 ALA A 817 -42.090 66.279 -9.709 1.00 21.11 H new ATOM 0 HB2 ALA A 817 -40.716 66.125 -8.588 1.00 21.11 H new ATOM 0 HB3 ALA A 817 -41.954 64.847 -8.661 1.00 21.11 H new ATOM 1142 N THR A 818 -44.569 65.261 -7.470 1.00 13.34 N ATOM 1143 CA THR A 818 -45.982 64.937 -7.627 1.00 5.24 C ATOM 1144 C THR A 818 -46.857 65.893 -6.825 1.00 14.11 C ATOM 1145 O THR A 818 -47.910 66.326 -7.293 1.00 42.21 O ATOM 1146 CB THR A 818 -46.279 63.492 -7.183 1.00 40.34 C ATOM 1147 OG1 THR A 818 -45.626 62.567 -8.060 1.00 31.14 O ATOM 1148 CG2 THR A 818 -47.777 63.225 -7.180 1.00 25.23 C ATOM 0 H THR A 818 -44.013 64.525 -7.033 1.00 13.34 H new ATOM 0 HA THR A 818 -46.214 65.039 -8.687 1.00 5.24 H new ATOM 0 HB THR A 818 -45.900 63.360 -6.169 1.00 40.34 H new ATOM 0 HG1 THR A 818 -44.684 62.483 -7.804 1.00 31.14 H new ATOM 0 HG21 THR A 818 -47.963 62.199 -6.863 1.00 25.23 H new ATOM 0 HG22 THR A 818 -48.268 63.912 -6.491 1.00 25.23 H new ATOM 0 HG23 THR A 818 -48.175 63.373 -8.184 1.00 25.23 H new ATOM 1156 N ALA A 819 -46.416 66.219 -5.614 1.00 63.15 N ATOM 1157 CA ALA A 819 -47.159 67.126 -4.749 1.00 3.22 C ATOM 1158 C ALA A 819 -47.154 68.545 -5.308 1.00 0.15 C ATOM 1159 O ALA A 819 -48.123 69.288 -5.148 1.00 41.10 O ATOM 1160 CB ALA A 819 -46.577 67.109 -3.343 1.00 34.42 C ATOM 0 H ALA A 819 -45.548 65.868 -5.210 1.00 63.15 H new ATOM 0 HA ALA A 819 -48.193 66.783 -4.707 1.00 3.22 H new ATOM 0 HB1 ALA A 819 -47.142 67.791 -2.707 1.00 34.42 H new ATOM 0 HB2 ALA A 819 -46.638 66.100 -2.936 1.00 34.42 H new ATOM 0 HB3 ALA A 819 -45.534 67.424 -3.377 1.00 34.42 H new ATOM 1166 N ILE A 820 -46.058 68.915 -5.962 1.00 31.34 N ATOM 1167 CA ILE A 820 -45.929 70.245 -6.544 1.00 24.31 C ATOM 1168 C ILE A 820 -46.814 70.394 -7.776 1.00 74.12 C ATOM 1169 O ILE A 820 -47.351 71.469 -8.041 1.00 10.22 O ATOM 1170 CB ILE A 820 -44.470 70.549 -6.934 1.00 71.10 C ATOM 1171 CG1 ILE A 820 -43.574 70.534 -5.694 1.00 1.50 C ATOM 1172 CG2 ILE A 820 -44.381 71.892 -7.643 1.00 63.13 C ATOM 1173 CD1 ILE A 820 -43.993 71.529 -4.634 1.00 33.42 C ATOM 0 H ILE A 820 -45.247 68.313 -6.102 1.00 31.34 H new ATOM 0 HA ILE A 820 -46.249 70.956 -5.782 1.00 24.31 H new ATOM 0 HB ILE A 820 -44.123 69.775 -7.619 1.00 71.10 H new ATOM 0 HG12 ILE A 820 -43.580 69.533 -5.264 1.00 1.50 H new ATOM 0 HG13 ILE A 820 -42.548 70.746 -5.994 1.00 1.50 H new ATOM 0 HG21 ILE A 820 -43.344 72.093 -7.912 1.00 63.13 H new ATOM 0 HG22 ILE A 820 -44.992 71.868 -8.545 1.00 63.13 H new ATOM 0 HG23 ILE A 820 -44.743 72.678 -6.980 1.00 63.13 H new ATOM 0 HD11 ILE A 820 -43.314 71.463 -3.784 1.00 33.42 H new ATOM 0 HD12 ILE A 820 -43.960 72.537 -5.048 1.00 33.42 H new ATOM 0 HD13 ILE A 820 -45.008 71.305 -4.305 1.00 33.42 H new ATOM 1185 N ALA A 821 -46.964 69.307 -8.526 1.00 31.33 N ATOM 1186 CA ALA A 821 -47.788 69.315 -9.728 1.00 51.20 C ATOM 1187 C ALA A 821 -49.257 69.084 -9.389 1.00 3.33 C ATOM 1188 O ALA A 821 -50.148 69.505 -10.126 1.00 13.31 O ATOM 1189 CB ALA A 821 -47.299 68.261 -10.710 1.00 52.13 C ATOM 0 H ALA A 821 -46.525 68.409 -8.322 1.00 31.33 H new ATOM 0 HA ALA A 821 -47.700 70.297 -10.192 1.00 51.20 H new ATOM 0 HB1 ALA A 821 -47.924 68.278 -11.603 1.00 52.13 H new ATOM 0 HB2 ALA A 821 -46.266 68.472 -10.986 1.00 52.13 H new ATOM 0 HB3 ALA A 821 -47.357 67.277 -10.246 1.00 52.13 H new ATOM 1195 N VAL A 822 -49.502 68.412 -8.268 1.00 41.05 N ATOM 1196 CA VAL A 822 -50.863 68.125 -7.831 1.00 40.33 C ATOM 1197 C VAL A 822 -51.430 69.277 -7.008 1.00 62.42 C ATOM 1198 O VAL A 822 -52.643 69.475 -6.952 1.00 70.25 O ATOM 1199 CB VAL A 822 -50.924 66.833 -6.996 1.00 24.23 C ATOM 1200 CG1 VAL A 822 -50.609 67.125 -5.536 1.00 74.14 C ATOM 1201 CG2 VAL A 822 -52.287 66.173 -7.134 1.00 71.23 C ATOM 0 H VAL A 822 -48.776 68.056 -7.646 1.00 41.05 H new ATOM 0 HA VAL A 822 -51.464 67.995 -8.731 1.00 40.33 H new ATOM 0 HB VAL A 822 -50.171 66.141 -7.374 1.00 24.23 H new ATOM 0 HG11 VAL A 822 -50.657 66.200 -4.961 1.00 74.14 H new ATOM 0 HG12 VAL A 822 -49.608 67.549 -5.458 1.00 74.14 H new ATOM 0 HG13 VAL A 822 -51.336 67.835 -5.142 1.00 74.14 H new ATOM 0 HG21 VAL A 822 -52.312 65.261 -6.537 1.00 71.23 H new ATOM 0 HG22 VAL A 822 -53.060 66.857 -6.784 1.00 71.23 H new ATOM 0 HG23 VAL A 822 -52.468 65.927 -8.180 1.00 71.23 H new ATOM 1211 N ALA A 823 -50.543 70.034 -6.371 1.00 21.45 N ATOM 1212 CA ALA A 823 -50.954 71.167 -5.552 1.00 55.41 C ATOM 1213 C ALA A 823 -51.600 72.255 -6.405 1.00 22.52 C ATOM 1214 O ALA A 823 -52.392 73.055 -5.910 1.00 0.35 O ATOM 1215 CB ALA A 823 -49.763 71.729 -4.791 1.00 22.12 C ATOM 0 H ALA A 823 -49.535 69.883 -6.407 1.00 21.45 H new ATOM 0 HA ALA A 823 -51.695 70.815 -4.835 1.00 55.41 H new ATOM 0 HB1 ALA A 823 -50.085 72.575 -4.184 1.00 22.12 H new ATOM 0 HB2 ALA A 823 -49.346 70.956 -4.145 1.00 22.12 H new ATOM 0 HB3 ALA A 823 -49.002 72.059 -5.498 1.00 22.12 H new ATOM 1243 N THR A 826 -56.976 70.530 -7.622 1.00 5.35 N ATOM 1244 CA THR A 826 -57.927 70.495 -6.518 1.00 41.31 C ATOM 1245 C THR A 826 -57.387 69.674 -5.353 1.00 12.45 C ATOM 1246 O THR A 826 -57.875 69.781 -4.227 1.00 42.42 O ATOM 1247 CB THR A 826 -59.280 69.908 -6.962 1.00 12.24 C ATOM 1248 OG1 THR A 826 -59.616 70.384 -8.270 1.00 3.23 O ATOM 1249 CG2 THR A 826 -60.381 70.285 -5.981 1.00 41.15 C ATOM 0 HA THR A 826 -58.075 71.525 -6.194 1.00 41.31 H new ATOM 0 HB THR A 826 -59.190 68.822 -6.984 1.00 12.24 H new ATOM 0 HG1 THR A 826 -58.810 70.724 -8.712 1.00 3.23 H new ATOM 0 HG21 THR A 826 -61.327 69.860 -6.315 1.00 41.15 H new ATOM 0 HG22 THR A 826 -60.137 69.896 -4.993 1.00 41.15 H new ATOM 0 HG23 THR A 826 -60.468 71.370 -5.932 1.00 41.15 H new ATOM 1257 N ASP A 827 -56.378 68.856 -5.629 1.00 30.02 N ATOM 1258 CA ASP A 827 -55.770 68.018 -4.602 1.00 33.41 C ATOM 1259 C ASP A 827 -55.350 68.853 -3.397 1.00 45.30 C ATOM 1260 O ASP A 827 -55.440 68.403 -2.255 1.00 32.02 O ATOM 1261 CB ASP A 827 -54.561 67.274 -5.170 1.00 45.22 C ATOM 1262 CG ASP A 827 -54.036 66.212 -4.224 1.00 15.33 C ATOM 1263 OD1 ASP A 827 -54.375 65.026 -4.418 1.00 3.14 O ATOM 1264 OD2 ASP A 827 -53.289 66.567 -3.288 1.00 43.43 O ATOM 0 H ASP A 827 -55.963 68.755 -6.555 1.00 30.02 H new ATOM 0 HA ASP A 827 -56.513 67.291 -4.275 1.00 33.41 H new ATOM 0 HB2 ASP A 827 -54.836 66.809 -6.116 1.00 45.22 H new ATOM 0 HB3 ASP A 827 -53.767 67.989 -5.385 1.00 45.22 H new ATOM 1269 N ARG A 828 -54.888 70.072 -3.660 1.00 73.53 N ATOM 1270 CA ARG A 828 -54.451 70.969 -2.598 1.00 12.12 C ATOM 1271 C ARG A 828 -55.619 71.349 -1.692 1.00 70.30 C ATOM 1272 O ARG A 828 -55.599 71.082 -0.490 1.00 63.04 O ATOM 1273 CB ARG A 828 -53.823 72.230 -3.193 1.00 44.40 C ATOM 1274 CG ARG A 828 -52.844 72.923 -2.258 1.00 71.53 C ATOM 1275 CD ARG A 828 -53.552 73.904 -1.338 1.00 14.30 C ATOM 1276 NE ARG A 828 -54.037 75.078 -2.059 1.00 10.31 N ATOM 1277 CZ ARG A 828 -53.243 76.043 -2.511 1.00 32.23 C ATOM 1278 NH1 ARG A 828 -51.933 75.973 -2.317 1.00 74.23 N ATOM 1279 NH2 ARG A 828 -53.759 77.080 -3.158 1.00 32.20 N ATOM 0 H ARG A 828 -54.807 70.460 -4.600 1.00 73.53 H new ATOM 0 HA ARG A 828 -53.704 70.447 -2.000 1.00 12.12 H new ATOM 0 HB2 ARG A 828 -53.307 71.967 -4.116 1.00 44.40 H new ATOM 0 HB3 ARG A 828 -54.615 72.930 -3.459 1.00 44.40 H new ATOM 0 HG2 ARG A 828 -52.319 72.177 -1.661 1.00 71.53 H new ATOM 0 HG3 ARG A 828 -52.091 73.450 -2.844 1.00 71.53 H new ATOM 0 HD2 ARG A 828 -54.390 73.405 -0.852 1.00 14.30 H new ATOM 0 HD3 ARG A 828 -52.869 74.219 -0.550 1.00 14.30 H new ATOM 0 HE ARG A 828 -55.040 75.162 -2.225 1.00 10.31 H new ATOM 0 HH11 ARG A 828 -51.533 75.177 -1.820 1.00 74.23 H new ATOM 0 HH12 ARG A 828 -51.326 76.715 -2.665 1.00 74.23 H new ATOM 0 HH21 ARG A 828 -54.766 77.137 -3.309 1.00 32.20 H new ATOM 0 HH22 ARG A 828 -53.149 77.820 -3.504 1.00 32.20 H new ATOM 1293 N VAL A 829 -56.636 71.973 -2.277 1.00 12.51 N ATOM 1294 CA VAL A 829 -57.813 72.389 -1.523 1.00 51.54 C ATOM 1295 C VAL A 829 -58.399 71.225 -0.732 1.00 4.51 C ATOM 1296 O VAL A 829 -58.826 71.392 0.411 1.00 23.50 O ATOM 1297 CB VAL A 829 -58.900 72.963 -2.452 1.00 31.02 C ATOM 1298 CG1 VAL A 829 -60.130 73.362 -1.651 1.00 50.51 C ATOM 1299 CG2 VAL A 829 -58.358 74.147 -3.238 1.00 70.13 C ATOM 0 H VAL A 829 -56.669 72.202 -3.270 1.00 12.51 H new ATOM 0 HA VAL A 829 -57.488 73.167 -0.832 1.00 51.54 H new ATOM 0 HB VAL A 829 -59.193 72.189 -3.162 1.00 31.02 H new ATOM 0 HG11 VAL A 829 -60.887 73.765 -2.324 1.00 50.51 H new ATOM 0 HG12 VAL A 829 -60.529 72.487 -1.138 1.00 50.51 H new ATOM 0 HG13 VAL A 829 -59.856 74.120 -0.917 1.00 50.51 H new ATOM 0 HG21 VAL A 829 -59.139 74.540 -3.889 1.00 70.13 H new ATOM 0 HG22 VAL A 829 -58.036 74.926 -2.547 1.00 70.13 H new ATOM 0 HG23 VAL A 829 -57.510 73.825 -3.842 1.00 70.13 H new ATOM 1309 N ILE A 830 -58.415 70.048 -1.347 1.00 23.21 N ATOM 1310 CA ILE A 830 -58.946 68.855 -0.699 1.00 14.33 C ATOM 1311 C ILE A 830 -58.048 68.406 0.449 1.00 40.52 C ATOM 1312 O ILE A 830 -58.498 68.274 1.586 1.00 30.33 O ATOM 1313 CB ILE A 830 -59.103 67.694 -1.698 1.00 23.21 C ATOM 1314 CG1 ILE A 830 -60.027 68.102 -2.847 1.00 35.53 C ATOM 1315 CG2 ILE A 830 -59.639 66.457 -0.993 1.00 1.04 C ATOM 1316 CD1 ILE A 830 -59.897 67.220 -4.069 1.00 53.11 C ATOM 0 H ILE A 830 -58.066 69.894 -2.293 1.00 23.21 H new ATOM 0 HA ILE A 830 -59.928 69.120 -0.306 1.00 14.33 H new ATOM 0 HB ILE A 830 -58.123 67.456 -2.112 1.00 23.21 H new ATOM 0 HG12 ILE A 830 -61.060 68.077 -2.499 1.00 35.53 H new ATOM 0 HG13 ILE A 830 -59.811 69.133 -3.128 1.00 35.53 H new ATOM 0 HG21 ILE A 830 -59.744 65.645 -1.713 1.00 1.04 H new ATOM 0 HG22 ILE A 830 -58.946 66.157 -0.207 1.00 1.04 H new ATOM 0 HG23 ILE A 830 -60.611 66.681 -0.554 1.00 1.04 H new ATOM 0 HD11 ILE A 830 -60.581 67.568 -4.843 1.00 53.11 H new ATOM 0 HD12 ILE A 830 -58.874 67.264 -4.442 1.00 53.11 H new ATOM 0 HD13 ILE A 830 -60.142 66.192 -3.803 1.00 53.11 H new ATOM 1328 N GLU A 831 -56.775 68.176 0.142 1.00 52.24 N ATOM 1329 CA GLU A 831 -55.813 67.743 1.148 1.00 14.24 C ATOM 1330 C GLU A 831 -55.839 68.671 2.359 1.00 5.35 C ATOM 1331 O GLU A 831 -55.741 68.223 3.502 1.00 74.43 O ATOM 1332 CB GLU A 831 -54.404 67.700 0.554 1.00 10.32 C ATOM 1333 CG GLU A 831 -53.335 67.285 1.551 1.00 34.04 C ATOM 1334 CD GLU A 831 -53.372 65.801 1.861 1.00 3.01 C ATOM 1335 OE1 GLU A 831 -53.178 65.437 3.040 1.00 62.21 O ATOM 1336 OE2 GLU A 831 -53.594 65.004 0.926 1.00 45.34 O ATOM 0 H GLU A 831 -56.386 68.282 -0.795 1.00 52.24 H new ATOM 0 HA GLU A 831 -56.092 66.741 1.473 1.00 14.24 H new ATOM 0 HB2 GLU A 831 -54.394 67.006 -0.286 1.00 10.32 H new ATOM 0 HB3 GLU A 831 -54.156 68.684 0.157 1.00 10.32 H new ATOM 0 HG2 GLU A 831 -52.353 67.545 1.155 1.00 34.04 H new ATOM 0 HG3 GLU A 831 -53.466 67.849 2.475 1.00 34.04 H new ATOM 1343 N VAL A 832 -55.969 69.969 2.101 1.00 70.32 N ATOM 1344 CA VAL A 832 -56.008 70.961 3.168 1.00 25.14 C ATOM 1345 C VAL A 832 -57.303 70.860 3.966 1.00 41.11 C ATOM 1346 O VAL A 832 -57.285 70.800 5.196 1.00 24.21 O ATOM 1347 CB VAL A 832 -55.870 72.390 2.611 1.00 14.43 C ATOM 1348 CG1 VAL A 832 -55.967 73.413 3.734 1.00 60.44 C ATOM 1349 CG2 VAL A 832 -54.561 72.542 1.852 1.00 52.43 C ATOM 0 H VAL A 832 -56.049 70.358 1.161 1.00 70.32 H new ATOM 0 HA VAL A 832 -55.164 70.752 3.825 1.00 25.14 H new ATOM 0 HB VAL A 832 -56.690 72.571 1.915 1.00 14.43 H new ATOM 0 HG11 VAL A 832 -55.867 74.417 3.321 1.00 60.44 H new ATOM 0 HG12 VAL A 832 -56.933 73.319 4.230 1.00 60.44 H new ATOM 0 HG13 VAL A 832 -55.170 73.237 4.456 1.00 60.44 H new ATOM 0 HG21 VAL A 832 -54.480 73.558 1.465 1.00 52.43 H new ATOM 0 HG22 VAL A 832 -53.726 72.342 2.523 1.00 52.43 H new ATOM 0 HG23 VAL A 832 -54.537 71.835 1.023 1.00 52.43 H new ATOM 1359 N LEU A 833 -58.427 70.842 3.258 1.00 21.11 N ATOM 1360 CA LEU A 833 -59.734 70.748 3.900 1.00 63.43 C ATOM 1361 C LEU A 833 -59.779 69.574 4.873 1.00 71.22 C ATOM 1362 O LEU A 833 -60.114 69.741 6.045 1.00 20.32 O ATOM 1363 CB LEU A 833 -60.831 70.594 2.846 1.00 74.45 C ATOM 1364 CG LEU A 833 -62.238 71.012 3.275 1.00 30.42 C ATOM 1365 CD1 LEU A 833 -62.253 72.470 3.706 1.00 54.14 C ATOM 1366 CD2 LEU A 833 -63.232 70.776 2.148 1.00 73.24 C ATOM 0 H LEU A 833 -58.460 70.891 2.240 1.00 21.11 H new ATOM 0 HA LEU A 833 -59.904 71.667 4.461 1.00 63.43 H new ATOM 0 HB2 LEU A 833 -60.551 71.180 1.971 1.00 74.45 H new ATOM 0 HB3 LEU A 833 -60.863 69.550 2.534 1.00 74.45 H new ATOM 0 HG LEU A 833 -62.534 70.400 4.127 1.00 30.42 H new ATOM 0 HD11 LEU A 833 -63.262 72.750 4.008 1.00 54.14 H new ATOM 0 HD12 LEU A 833 -61.572 72.608 4.546 1.00 54.14 H new ATOM 0 HD13 LEU A 833 -61.936 73.099 2.874 1.00 54.14 H new ATOM 0 HD21 LEU A 833 -64.228 71.079 2.472 1.00 73.24 H new ATOM 0 HD22 LEU A 833 -62.940 71.362 1.276 1.00 73.24 H new ATOM 0 HD23 LEU A 833 -63.242 69.718 1.887 1.00 73.24 H new ATOM 1378 N GLN A 834 -59.438 68.388 4.378 1.00 0.32 N ATOM 1379 CA GLN A 834 -59.439 67.187 5.205 1.00 3.32 C ATOM 1380 C GLN A 834 -58.388 67.284 6.306 1.00 10.15 C ATOM 1381 O GLN A 834 -58.630 66.884 7.445 1.00 45.11 O ATOM 1382 CB GLN A 834 -59.180 65.950 4.344 1.00 22.33 C ATOM 1383 CG GLN A 834 -57.832 65.969 3.641 1.00 20.44 C ATOM 1384 CD GLN A 834 -57.768 65.002 2.475 1.00 14.12 C ATOM 1385 OE1 GLN A 834 -58.737 64.843 1.732 1.00 14.12 O ATOM 1386 NE2 GLN A 834 -56.624 64.350 2.308 1.00 3.11 N ATOM 0 H GLN A 834 -59.158 68.233 3.409 1.00 0.32 H new ATOM 0 HA GLN A 834 -60.420 67.098 5.671 1.00 3.32 H new ATOM 0 HB2 GLN A 834 -59.240 65.061 4.972 1.00 22.33 H new ATOM 0 HB3 GLN A 834 -59.969 65.866 3.597 1.00 22.33 H new ATOM 0 HG2 GLN A 834 -57.628 66.978 3.283 1.00 20.44 H new ATOM 0 HG3 GLN A 834 -57.049 65.720 4.358 1.00 20.44 H new ATOM 0 HE21 GLN A 834 -55.846 64.513 2.948 1.00 3.11 H new ATOM 0 HE22 GLN A 834 -56.523 63.686 1.540 1.00 3.11 H new ATOM 1395 N ALA A 835 -57.221 67.817 5.959 1.00 13.42 N ATOM 1396 CA ALA A 835 -56.134 67.968 6.919 1.00 55.13 C ATOM 1397 C ALA A 835 -56.573 68.802 8.118 1.00 23.41 C ATOM 1398 O ALA A 835 -56.420 68.383 9.265 1.00 11.44 O ATOM 1399 CB ALA A 835 -54.923 68.600 6.249 1.00 70.30 C ATOM 0 H ALA A 835 -57.004 68.151 5.020 1.00 13.42 H new ATOM 0 HA ALA A 835 -55.860 66.977 7.280 1.00 55.13 H new ATOM 0 HB1 ALA A 835 -54.119 68.707 6.977 1.00 70.30 H new ATOM 0 HB2 ALA A 835 -54.588 67.965 5.429 1.00 70.30 H new ATOM 0 HB3 ALA A 835 -55.193 69.582 5.860 1.00 70.30 H new ATOM 1405 N ALA A 836 -57.117 69.983 7.845 1.00 71.21 N ATOM 1406 CA ALA A 836 -57.578 70.874 8.902 1.00 55.11 C ATOM 1407 C ALA A 836 -58.711 70.238 9.700 1.00 15.54 C ATOM 1408 O ALA A 836 -58.617 70.089 10.919 1.00 73.31 O ATOM 1409 CB ALA A 836 -58.026 72.204 8.313 1.00 34.40 C ATOM 0 H ALA A 836 -57.249 70.345 6.901 1.00 71.21 H new ATOM 0 HA ALA A 836 -56.745 71.053 9.582 1.00 55.11 H new ATOM 0 HB1 ALA A 836 -58.368 72.860 9.114 1.00 34.40 H new ATOM 0 HB2 ALA A 836 -57.190 72.672 7.793 1.00 34.40 H new ATOM 0 HB3 ALA A 836 -58.841 72.034 7.610 1.00 34.40 H new ATOM 1415 N TYR A 837 -59.782 69.867 9.007 1.00 43.22 N ATOM 1416 CA TYR A 837 -60.935 69.250 9.652 1.00 4.42 C ATOM 1417 C TYR A 837 -60.509 68.059 10.505 1.00 1.31 C ATOM 1418 O TYR A 837 -60.709 68.048 11.720 1.00 43.42 O ATOM 1419 CB TYR A 837 -61.954 68.803 8.603 1.00 23.51 C ATOM 1420 CG TYR A 837 -63.379 68.796 9.108 1.00 50.14 C ATOM 1421 CD1 TYR A 837 -63.719 68.131 10.279 1.00 21.32 C ATOM 1422 CD2 TYR A 837 -64.386 69.454 8.413 1.00 40.35 C ATOM 1423 CE1 TYR A 837 -65.020 68.122 10.744 1.00 61.53 C ATOM 1424 CE2 TYR A 837 -65.689 69.452 8.870 1.00 33.33 C ATOM 1425 CZ TYR A 837 -66.001 68.784 10.036 1.00 33.21 C ATOM 1426 OH TYR A 837 -67.299 68.778 10.495 1.00 63.44 O ATOM 0 H TYR A 837 -59.876 69.983 7.998 1.00 43.22 H new ATOM 0 HA TYR A 837 -61.396 69.993 10.303 1.00 4.42 H new ATOM 0 HB2 TYR A 837 -61.887 69.464 7.739 1.00 23.51 H new ATOM 0 HB3 TYR A 837 -61.694 67.802 8.260 1.00 23.51 H new ATOM 0 HD1 TYR A 837 -62.953 67.612 10.836 1.00 21.32 H new ATOM 0 HD2 TYR A 837 -64.145 69.976 7.499 1.00 40.35 H new ATOM 0 HE1 TYR A 837 -65.267 67.600 11.656 1.00 61.53 H new ATOM 0 HE2 TYR A 837 -66.459 69.970 8.318 1.00 33.33 H new ATOM 0 HH TYR A 837 -67.865 69.291 9.881 1.00 63.44 H new ATOM 1436 N ARG A 838 -59.920 67.058 9.859 1.00 34.23 N ATOM 1437 CA ARG A 838 -59.466 65.861 10.557 1.00 33.10 C ATOM 1438 C ARG A 838 -58.633 66.228 11.781 1.00 11.54 C ATOM 1439 O ARG A 838 -58.858 65.712 12.875 1.00 30.24 O ATOM 1440 CB ARG A 838 -58.647 64.976 9.616 1.00 44.21 C ATOM 1441 CG ARG A 838 -58.136 63.702 10.269 1.00 43.24 C ATOM 1442 CD ARG A 838 -56.699 63.408 9.866 1.00 32.51 C ATOM 1443 NE ARG A 838 -56.522 62.020 9.445 1.00 53.54 N ATOM 1444 CZ ARG A 838 -56.415 61.003 10.292 1.00 63.02 C ATOM 1445 NH1 ARG A 838 -56.466 61.216 11.599 1.00 10.43 N ATOM 1446 NH2 ARG A 838 -56.256 59.769 9.831 1.00 22.33 N ATOM 0 H ARG A 838 -59.746 67.052 8.854 1.00 34.23 H new ATOM 0 HA ARG A 838 -60.345 65.310 10.890 1.00 33.10 H new ATOM 0 HB2 ARG A 838 -59.260 64.712 8.754 1.00 44.21 H new ATOM 0 HB3 ARG A 838 -57.798 65.547 9.240 1.00 44.21 H new ATOM 0 HG2 ARG A 838 -58.199 63.797 11.353 1.00 43.24 H new ATOM 0 HG3 ARG A 838 -58.774 62.865 9.985 1.00 43.24 H new ATOM 0 HD2 ARG A 838 -56.407 64.073 9.054 1.00 32.51 H new ATOM 0 HD3 ARG A 838 -56.036 63.620 10.705 1.00 32.51 H new ATOM 0 HE ARG A 838 -56.478 61.821 8.445 1.00 53.54 H new ATOM 0 HH11 ARG A 838 -56.588 62.163 11.957 1.00 10.43 H new ATOM 0 HH12 ARG A 838 -56.384 60.433 12.247 1.00 10.43 H new ATOM 0 HH21 ARG A 838 -56.216 59.601 8.826 1.00 22.33 H new ATOM 0 HH22 ARG A 838 -56.174 58.988 10.482 1.00 22.33 H new ATOM 1460 N ALA A 839 -57.670 67.124 11.588 1.00 31.33 N ATOM 1461 CA ALA A 839 -56.805 67.561 12.676 1.00 5.43 C ATOM 1462 C ALA A 839 -57.623 68.001 13.886 1.00 63.12 C ATOM 1463 O ALA A 839 -57.506 67.426 14.968 1.00 24.42 O ATOM 1464 CB ALA A 839 -55.900 68.692 12.209 1.00 13.31 C ATOM 0 H ALA A 839 -57.470 67.561 10.688 1.00 31.33 H new ATOM 0 HA ALA A 839 -56.186 66.715 12.977 1.00 5.43 H new ATOM 0 HB1 ALA A 839 -55.259 69.009 13.032 1.00 13.31 H new ATOM 0 HB2 ALA A 839 -55.282 68.345 11.381 1.00 13.31 H new ATOM 0 HB3 ALA A 839 -56.510 69.533 11.879 1.00 13.31 H new ATOM 1470 N ILE A 840 -58.450 69.023 13.695 1.00 43.21 N ATOM 1471 CA ILE A 840 -59.287 69.539 14.771 1.00 71.22 C ATOM 1472 C ILE A 840 -60.311 68.500 15.216 1.00 53.40 C ATOM 1473 O ILE A 840 -60.922 68.631 16.277 1.00 54.54 O ATOM 1474 CB ILE A 840 -60.025 70.821 14.344 1.00 13.42 C ATOM 1475 CG1 ILE A 840 -60.771 71.427 15.535 1.00 3.03 C ATOM 1476 CG2 ILE A 840 -60.989 70.524 13.205 1.00 21.01 C ATOM 1477 CD1 ILE A 840 -61.212 72.856 15.309 1.00 75.25 C ATOM 0 H ILE A 840 -58.558 69.510 12.805 1.00 43.21 H new ATOM 0 HA ILE A 840 -58.624 69.772 15.604 1.00 71.22 H new ATOM 0 HB ILE A 840 -59.290 71.545 13.992 1.00 13.42 H new ATOM 0 HG12 ILE A 840 -61.646 70.816 15.754 1.00 3.03 H new ATOM 0 HG13 ILE A 840 -60.127 71.389 16.414 1.00 3.03 H new ATOM 0 HG21 ILE A 840 -61.503 71.440 12.915 1.00 21.01 H new ATOM 0 HG22 ILE A 840 -60.435 70.133 12.352 1.00 21.01 H new ATOM 0 HG23 ILE A 840 -61.721 69.785 13.531 1.00 21.01 H new ATOM 0 HD11 ILE A 840 -61.734 73.220 16.194 1.00 75.25 H new ATOM 0 HD12 ILE A 840 -60.339 73.481 15.120 1.00 75.25 H new ATOM 0 HD13 ILE A 840 -61.882 72.899 14.450 1.00 75.25 H new ATOM 1489 N ARG A 841 -60.492 67.468 14.399 1.00 34.21 N ATOM 1490 CA ARG A 841 -61.442 66.406 14.709 1.00 71.01 C ATOM 1491 C ARG A 841 -60.904 65.500 15.812 1.00 3.05 C ATOM 1492 O ARG A 841 -61.591 65.229 16.798 1.00 64.10 O ATOM 1493 CB ARG A 841 -61.742 65.580 13.457 1.00 70.40 C ATOM 1494 CG ARG A 841 -63.054 64.815 13.532 1.00 45.04 C ATOM 1495 CD ARG A 841 -64.239 65.709 13.202 1.00 21.22 C ATOM 1496 NE ARG A 841 -65.485 65.195 13.764 1.00 21.34 N ATOM 1497 CZ ARG A 841 -66.124 64.133 13.286 1.00 22.44 C ATOM 1498 NH1 ARG A 841 -65.636 63.475 12.243 1.00 11.42 N ATOM 1499 NH2 ARG A 841 -67.253 63.726 13.852 1.00 22.34 N ATOM 0 H ARG A 841 -59.994 67.344 13.518 1.00 34.21 H new ATOM 0 HA ARG A 841 -62.364 66.869 15.060 1.00 71.01 H new ATOM 0 HB2 ARG A 841 -61.767 66.243 12.592 1.00 70.40 H new ATOM 0 HB3 ARG A 841 -60.928 64.874 13.294 1.00 70.40 H new ATOM 0 HG2 ARG A 841 -63.027 63.974 12.839 1.00 45.04 H new ATOM 0 HG3 ARG A 841 -63.178 64.399 14.532 1.00 45.04 H new ATOM 0 HD2 ARG A 841 -64.055 66.712 13.586 1.00 21.22 H new ATOM 0 HD3 ARG A 841 -64.338 65.795 12.120 1.00 21.22 H new ATOM 0 HE ARG A 841 -65.887 65.678 14.568 1.00 21.34 H new ATOM 0 HH11 ARG A 841 -64.768 63.784 11.806 1.00 11.42 H new ATOM 0 HH12 ARG A 841 -66.129 62.660 11.878 1.00 11.42 H new ATOM 0 HH21 ARG A 841 -67.631 64.229 14.655 1.00 22.34 H new ATOM 0 HH22 ARG A 841 -67.743 62.910 13.484 1.00 22.34 H new ATOM 1513 N HIS A 842 -59.671 65.034 15.640 1.00 42.22 N ATOM 1514 CA HIS A 842 -59.040 64.159 16.621 1.00 20.41 C ATOM 1515 C HIS A 842 -58.069 64.940 17.502 1.00 74.32 C ATOM 1516 O HIS A 842 -57.368 64.362 18.332 1.00 24.24 O ATOM 1517 CB HIS A 842 -58.304 63.017 15.919 1.00 40.22 C ATOM 1518 CG HIS A 842 -56.946 63.400 15.417 1.00 63.43 C ATOM 1519 ND1 HIS A 842 -55.817 62.642 15.649 1.00 41.35 N ATOM 1520 CD2 HIS A 842 -56.539 64.466 14.689 1.00 3.13 C ATOM 1521 CE1 HIS A 842 -54.774 63.227 15.087 1.00 0.41 C ATOM 1522 NE2 HIS A 842 -55.185 64.336 14.498 1.00 31.20 N ATOM 0 H HIS A 842 -59.089 65.248 14.830 1.00 42.22 H new ATOM 0 HA HIS A 842 -59.823 63.742 17.255 1.00 20.41 H new ATOM 0 HB2 HIS A 842 -58.204 62.180 16.611 1.00 40.22 H new ATOM 0 HB3 HIS A 842 -58.907 62.668 15.081 1.00 40.22 H new ATOM 0 HD2 HIS A 842 -57.163 65.269 14.326 1.00 3.13 H new ATOM 0 HE1 HIS A 842 -53.758 62.861 15.106 1.00 0.41 H new ATOM 0 HE2 HIS A 842 -54.593 64.989 13.985 1.00 31.20 H new ATOM 1630 N ARG A 848 -51.514 70.110 22.465 1.00 71.34 N ATOM 1631 CA ARG A 848 -51.492 71.352 21.701 1.00 34.41 C ATOM 1632 C ARG A 848 -50.447 72.314 22.258 1.00 72.12 C ATOM 1633 O ARG A 848 -49.764 73.006 21.504 1.00 65.31 O ATOM 1634 CB ARG A 848 -52.872 72.012 21.722 1.00 0.32 C ATOM 1635 CG ARG A 848 -53.808 71.502 20.639 1.00 33.00 C ATOM 1636 CD ARG A 848 -53.396 72.004 19.264 1.00 24.02 C ATOM 1637 NE ARG A 848 -53.929 73.335 18.985 1.00 62.55 N ATOM 1638 CZ ARG A 848 -53.893 73.903 17.785 1.00 52.24 C ATOM 1639 NH1 ARG A 848 -53.353 73.261 16.758 1.00 31.55 N ATOM 1640 NH2 ARG A 848 -54.399 75.117 17.609 1.00 13.32 N ATOM 0 HA ARG A 848 -51.227 71.112 20.671 1.00 34.41 H new ATOM 0 HB2 ARG A 848 -53.331 71.843 22.696 1.00 0.32 H new ATOM 0 HB3 ARG A 848 -52.752 73.089 21.609 1.00 0.32 H new ATOM 0 HG2 ARG A 848 -53.811 70.412 20.643 1.00 33.00 H new ATOM 0 HG3 ARG A 848 -54.826 71.825 20.855 1.00 33.00 H new ATOM 0 HD2 ARG A 848 -52.308 72.028 19.198 1.00 24.02 H new ATOM 0 HD3 ARG A 848 -53.746 71.306 18.503 1.00 24.02 H new ATOM 0 HE ARG A 848 -54.352 73.856 19.753 1.00 62.55 H new ATOM 0 HH11 ARG A 848 -52.963 72.327 16.888 1.00 31.55 H new ATOM 0 HH12 ARG A 848 -53.327 73.701 15.838 1.00 31.55 H new ATOM 0 HH21 ARG A 848 -54.816 75.615 18.396 1.00 13.32 H new ATOM 0 HH22 ARG A 848 -54.371 75.552 16.687 1.00 13.32 H new ATOM 1654 N GLN A 849 -50.331 72.352 23.581 1.00 25.32 N ATOM 1655 CA GLN A 849 -49.370 73.230 24.238 1.00 3.11 C ATOM 1656 C GLN A 849 -47.973 73.041 23.656 1.00 22.22 C ATOM 1657 O GLN A 849 -47.300 74.009 23.304 1.00 25.45 O ATOM 1658 CB GLN A 849 -49.348 72.962 25.744 1.00 55.20 C ATOM 1659 CG GLN A 849 -48.496 73.949 26.525 1.00 14.25 C ATOM 1660 CD GLN A 849 -48.209 73.481 27.939 1.00 54.34 C ATOM 1661 OE1 GLN A 849 -47.121 72.985 28.232 1.00 51.33 O ATOM 1662 NE2 GLN A 849 -49.187 73.637 28.824 1.00 3.10 N ATOM 0 H GLN A 849 -50.890 71.785 24.219 1.00 25.32 H new ATOM 0 HA GLN A 849 -49.680 74.260 24.064 1.00 3.11 H new ATOM 0 HB2 GLN A 849 -50.369 72.995 26.125 1.00 55.20 H new ATOM 0 HB3 GLN A 849 -48.974 71.953 25.920 1.00 55.20 H new ATOM 0 HG2 GLN A 849 -47.554 74.105 26.000 1.00 14.25 H new ATOM 0 HG3 GLN A 849 -49.004 74.913 26.561 1.00 14.25 H new ATOM 0 HE21 GLN A 849 -50.073 74.053 28.537 1.00 3.10 H new ATOM 0 HE22 GLN A 849 -49.052 73.341 29.791 1.00 3.10 H new ATOM 1671 N GLY A 850 -47.543 71.786 23.558 1.00 4.40 N ATOM 1672 CA GLY A 850 -46.228 71.493 23.019 1.00 43.23 C ATOM 1673 C GLY A 850 -46.103 71.873 21.557 1.00 43.43 C ATOM 1674 O GLY A 850 -45.118 72.492 21.150 1.00 12.43 O ATOM 0 H GLY A 850 -48.082 70.968 23.842 1.00 4.40 H new ATOM 0 HA2 GLY A 850 -45.474 72.029 23.596 1.00 43.23 H new ATOM 0 HA3 GLY A 850 -46.020 70.429 23.134 1.00 43.23 H new ATOM 1678 N LEU A 851 -47.101 71.502 20.763 1.00 20.30 N ATOM 1679 CA LEU A 851 -47.098 71.806 19.336 1.00 12.23 C ATOM 1680 C LEU A 851 -46.890 73.298 19.098 1.00 5.34 C ATOM 1681 O LEU A 851 -46.136 73.695 18.210 1.00 22.03 O ATOM 1682 CB LEU A 851 -48.412 71.355 18.696 1.00 70.11 C ATOM 1683 CG LEU A 851 -48.395 71.187 17.176 1.00 30.12 C ATOM 1684 CD1 LEU A 851 -47.741 69.869 16.792 1.00 32.42 C ATOM 1685 CD2 LEU A 851 -49.807 71.267 16.615 1.00 52.41 C ATOM 0 H LEU A 851 -47.923 70.990 21.083 1.00 20.30 H new ATOM 0 HA LEU A 851 -46.272 71.264 18.876 1.00 12.23 H new ATOM 0 HB2 LEU A 851 -48.704 70.405 19.143 1.00 70.11 H new ATOM 0 HB3 LEU A 851 -49.185 72.079 18.953 1.00 70.11 H new ATOM 0 HG LEU A 851 -47.808 71.999 16.746 1.00 30.12 H new ATOM 0 HD11 LEU A 851 -47.738 69.767 15.707 1.00 32.42 H new ATOM 0 HD12 LEU A 851 -46.716 69.851 17.161 1.00 32.42 H new ATOM 0 HD13 LEU A 851 -48.300 69.043 17.233 1.00 32.42 H new ATOM 0 HD21 LEU A 851 -49.776 71.145 15.532 1.00 52.41 H new ATOM 0 HD22 LEU A 851 -50.417 70.476 17.051 1.00 52.41 H new ATOM 0 HD23 LEU A 851 -50.241 72.237 16.859 1.00 52.41 H new ATOM 1697 N GLU A 852 -47.561 74.120 19.899 1.00 21.25 N ATOM 1698 CA GLU A 852 -47.447 75.568 19.776 1.00 12.30 C ATOM 1699 C GLU A 852 -46.178 76.074 20.456 1.00 40.24 C ATOM 1700 O GLU A 852 -45.616 77.096 20.062 1.00 2.41 O ATOM 1701 CB GLU A 852 -48.673 76.252 20.386 1.00 44.23 C ATOM 1702 CG GLU A 852 -48.763 76.107 21.896 1.00 63.45 C ATOM 1703 CD GLU A 852 -49.837 76.988 22.504 1.00 64.34 C ATOM 1704 OE1 GLU A 852 -49.962 77.000 23.746 1.00 62.12 O ATOM 1705 OE2 GLU A 852 -50.552 77.665 21.736 1.00 2.51 O ATOM 0 H GLU A 852 -48.189 73.808 20.640 1.00 21.25 H new ATOM 0 HA GLU A 852 -47.393 75.814 18.715 1.00 12.30 H new ATOM 0 HB2 GLU A 852 -48.651 77.312 20.132 1.00 44.23 H new ATOM 0 HB3 GLU A 852 -49.573 75.835 19.935 1.00 44.23 H new ATOM 0 HG2 GLU A 852 -48.968 75.066 22.146 1.00 63.45 H new ATOM 0 HG3 GLU A 852 -47.799 76.357 22.339 1.00 63.45 H new ATOM 1712 N ARG A 853 -45.733 75.351 21.478 1.00 10.42 N ATOM 1713 CA ARG A 853 -44.532 75.727 22.214 1.00 1.21 C ATOM 1714 C ARG A 853 -43.293 75.601 21.333 1.00 44.22 C ATOM 1715 O ARG A 853 -42.349 76.382 21.457 1.00 3.12 O ATOM 1716 CB ARG A 853 -44.376 74.852 23.459 1.00 14.34 C ATOM 1717 CG ARG A 853 -45.135 75.374 24.669 1.00 41.01 C ATOM 1718 CD ARG A 853 -44.414 76.547 25.315 1.00 55.23 C ATOM 1719 NE ARG A 853 -44.932 76.840 26.649 1.00 63.13 N ATOM 1720 CZ ARG A 853 -44.574 76.171 27.739 1.00 64.31 C ATOM 1721 NH1 ARG A 853 -43.701 75.176 27.654 1.00 51.15 N ATOM 1722 NH2 ARG A 853 -45.088 76.496 28.918 1.00 52.42 N ATOM 0 H ARG A 853 -46.186 74.502 21.815 1.00 10.42 H new ATOM 0 HA ARG A 853 -44.635 76.768 22.520 1.00 1.21 H new ATOM 0 HB2 ARG A 853 -44.723 73.844 23.230 1.00 14.34 H new ATOM 0 HB3 ARG A 853 -43.318 74.776 23.709 1.00 14.34 H new ATOM 0 HG2 ARG A 853 -46.136 75.682 24.367 1.00 41.01 H new ATOM 0 HG3 ARG A 853 -45.255 74.573 25.398 1.00 41.01 H new ATOM 0 HD2 ARG A 853 -43.349 76.326 25.380 1.00 55.23 H new ATOM 0 HD3 ARG A 853 -44.519 77.429 24.684 1.00 55.23 H new ATOM 0 HE ARG A 853 -45.605 77.600 26.749 1.00 63.13 H new ATOM 0 HH11 ARG A 853 -43.303 74.923 26.750 1.00 51.15 H new ATOM 0 HH12 ARG A 853 -43.428 74.664 28.493 1.00 51.15 H new ATOM 0 HH21 ARG A 853 -45.759 77.261 28.988 1.00 52.42 H new ATOM 0 HH22 ARG A 853 -44.812 75.981 29.754 1.00 52.42 H new ATOM 1736 N ILE A 854 -43.303 74.614 20.444 1.00 30.41 N ATOM 1737 CA ILE A 854 -42.181 74.386 19.542 1.00 4.24 C ATOM 1738 C ILE A 854 -42.378 75.124 18.222 1.00 21.52 C ATOM 1739 O ILE A 854 -41.695 74.846 17.235 1.00 3.45 O ATOM 1740 CB ILE A 854 -41.984 72.886 19.255 1.00 32.11 C ATOM 1741 CG1 ILE A 854 -43.169 72.338 18.457 1.00 62.14 C ATOM 1742 CG2 ILE A 854 -41.814 72.116 20.556 1.00 65.52 C ATOM 1743 CD1 ILE A 854 -43.042 70.869 18.119 1.00 71.11 C ATOM 0 H ILE A 854 -44.076 73.959 20.329 1.00 30.41 H new ATOM 0 HA ILE A 854 -41.292 74.771 20.041 1.00 4.24 H new ATOM 0 HB ILE A 854 -41.079 72.760 18.660 1.00 32.11 H new ATOM 0 HG12 ILE A 854 -44.084 72.493 19.028 1.00 62.14 H new ATOM 0 HG13 ILE A 854 -43.269 72.908 17.533 1.00 62.14 H new ATOM 0 HG21 ILE A 854 -41.676 71.057 20.337 1.00 65.52 H new ATOM 0 HG22 ILE A 854 -40.942 72.493 21.091 1.00 65.52 H new ATOM 0 HG23 ILE A 854 -42.702 72.246 21.174 1.00 65.52 H new ATOM 0 HD11 ILE A 854 -43.917 70.549 17.553 1.00 71.11 H new ATOM 0 HD12 ILE A 854 -42.145 70.710 17.521 1.00 71.11 H new ATOM 0 HD13 ILE A 854 -42.973 70.289 19.039 1.00 71.11 H new ATOM 1755 N LEU A 855 -43.315 76.065 18.211 1.00 10.02 N ATOM 1756 CA LEU A 855 -43.602 76.845 17.012 1.00 3.24 C ATOM 1757 C LEU A 855 -43.115 78.282 17.169 1.00 41.35 C ATOM 1758 O LEU A 855 -42.653 78.900 16.209 1.00 45.34 O ATOM 1759 CB LEU A 855 -45.103 76.832 16.718 1.00 1.25 C ATOM 1760 CG LEU A 855 -45.641 78.021 15.921 1.00 30.22 C ATOM 1761 CD1 LEU A 855 -44.939 78.123 14.576 1.00 71.11 C ATOM 1762 CD2 LEU A 855 -47.146 77.898 15.732 1.00 41.43 C ATOM 0 H LEU A 855 -43.889 76.307 19.019 1.00 10.02 H new ATOM 0 HA LEU A 855 -43.071 76.390 16.176 1.00 3.24 H new ATOM 0 HB2 LEU A 855 -45.338 75.918 16.172 1.00 1.25 H new ATOM 0 HB3 LEU A 855 -45.638 76.784 17.666 1.00 1.25 H new ATOM 0 HG LEU A 855 -45.439 78.933 16.483 1.00 30.22 H new ATOM 0 HD11 LEU A 855 -45.335 78.975 14.023 1.00 71.11 H new ATOM 0 HD12 LEU A 855 -43.869 78.258 14.733 1.00 71.11 H new ATOM 0 HD13 LEU A 855 -45.109 77.209 14.006 1.00 71.11 H new ATOM 0 HD21 LEU A 855 -47.512 78.752 15.163 1.00 41.43 H new ATOM 0 HD22 LEU A 855 -47.371 76.979 15.191 1.00 41.43 H new ATOM 0 HD23 LEU A 855 -47.634 77.875 16.706 1.00 41.43 H new