USER MOD reduce.3.24.130724 H: found=0, std=0, add=563, rem=0, adj=9 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= -0.153 X(o=-0.15,f=-0.061) USER MOD Single : A 779 THR OG1 : rot -63:sc= 1.28 USER MOD Single : A 801 GLN : amide:sc= 0 X(o=0,f=0) 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+ -152:sc= -0.16 (180deg=-0.686) 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 X(o=0,f=-0.035) USER MOD Single : A 816 ASN : amide:sc= -0.137 K(o=-0.14,f=-0.7) USER MOD Single : A 818 THR OG1 : rot 103:sc= 1.26 USER MOD Single : A 826 THR OG1 : rot 27:sc= 0.424 USER MOD Single : A 834 GLN : amide:sc= -1.7 K(o=-1.7,f=-2.9!) USER MOD Single : A 837 TYR OH : rot 180:sc= 0 USER MOD Single : A 842 HIS : no HD1:sc= -0.508 K(o=-0.51,f=-1.8) USER MOD Single : A 849 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 261 N TYR A 768 6.598 18.663 -15.625 1.00 31.33 N ATOM 262 CA TYR A 768 7.162 19.988 -15.395 1.00 73.35 C ATOM 263 C TYR A 768 7.182 20.802 -16.686 1.00 32.24 C ATOM 264 O TYR A 768 6.563 21.863 -16.774 1.00 21.13 O ATOM 265 CB TYR A 768 8.578 19.871 -14.831 1.00 5.34 C ATOM 266 CG TYR A 768 9.236 21.207 -14.565 1.00 61.34 C ATOM 267 CD1 TYR A 768 10.553 21.442 -14.941 1.00 53.14 C ATOM 268 CD2 TYR A 768 8.540 22.234 -13.939 1.00 62.43 C ATOM 269 CE1 TYR A 768 11.158 22.660 -14.700 1.00 54.33 C ATOM 270 CE2 TYR A 768 9.137 23.456 -13.695 1.00 74.34 C ATOM 271 CZ TYR A 768 10.445 23.664 -14.077 1.00 65.03 C ATOM 272 OH TYR A 768 11.044 24.879 -13.837 1.00 0.44 O ATOM 0 HA TYR A 768 6.531 20.504 -14.671 1.00 73.35 H new ATOM 0 HB2 TYR A 768 8.544 19.301 -13.903 1.00 5.34 H new ATOM 0 HB3 TYR A 768 9.193 19.305 -15.531 1.00 5.34 H new ATOM 0 HD1 TYR A 768 11.113 20.659 -15.430 1.00 53.14 H new ATOM 0 HD2 TYR A 768 7.515 22.074 -13.638 1.00 62.43 H new ATOM 0 HE1 TYR A 768 12.183 22.826 -14.997 1.00 54.33 H new ATOM 0 HE2 TYR A 768 8.582 24.244 -13.208 1.00 74.34 H new ATOM 0 HH TYR A 768 10.406 25.476 -13.393 1.00 0.44 H new ATOM 282 N HIS A 769 7.897 20.297 -17.685 1.00 63.54 N ATOM 283 CA HIS A 769 7.998 20.975 -18.973 1.00 1.14 C ATOM 284 C HIS A 769 6.614 21.238 -19.558 1.00 71.11 C ATOM 285 O HIS A 769 6.355 22.309 -20.107 1.00 34.02 O ATOM 286 CB HIS A 769 8.828 20.141 -19.949 1.00 73.12 C ATOM 287 CG HIS A 769 9.547 20.960 -20.976 1.00 11.40 C ATOM 288 ND1 HIS A 769 10.211 20.407 -22.050 1.00 63.01 N ATOM 289 CD2 HIS A 769 9.702 22.300 -21.089 1.00 42.32 C ATOM 290 CE1 HIS A 769 10.745 21.371 -22.779 1.00 25.23 C ATOM 291 NE2 HIS A 769 10.451 22.530 -22.217 1.00 72.54 N ATOM 0 H HIS A 769 8.415 19.420 -17.628 1.00 63.54 H new ATOM 0 HA HIS A 769 8.494 21.933 -18.814 1.00 1.14 H new ATOM 0 HB2 HIS A 769 9.557 19.557 -19.387 1.00 73.12 H new ATOM 0 HB3 HIS A 769 8.174 19.431 -20.455 1.00 73.12 H new ATOM 0 HD2 HIS A 769 9.310 23.049 -20.417 1.00 42.32 H new ATOM 0 HE1 HIS A 769 11.323 21.235 -23.681 1.00 25.23 H new ATOM 0 HE2 HIS A 769 10.734 23.446 -22.564 1.00 72.54 H new ATOM 299 N ARG A 770 5.729 20.253 -19.438 1.00 3.30 N ATOM 300 CA ARG A 770 4.373 20.378 -19.957 1.00 74.31 C ATOM 301 C ARG A 770 3.624 21.507 -19.256 1.00 35.04 C ATOM 302 O ARG A 770 3.149 22.445 -19.898 1.00 24.10 O ATOM 303 CB ARG A 770 3.614 19.061 -19.781 1.00 14.22 C ATOM 304 CG ARG A 770 2.106 19.235 -19.689 1.00 64.32 C ATOM 305 CD ARG A 770 1.398 17.895 -19.565 1.00 71.13 C ATOM 306 NE ARG A 770 1.200 17.258 -20.865 1.00 0.24 N ATOM 307 CZ ARG A 770 0.332 16.276 -21.077 1.00 34.41 C ATOM 308 NH1 ARG A 770 -0.415 15.820 -20.081 1.00 34.02 N ATOM 309 NH2 ARG A 770 0.209 15.747 -22.288 1.00 11.12 N ATOM 0 H ARG A 770 5.927 19.360 -18.986 1.00 3.30 H new ATOM 0 HA ARG A 770 4.438 20.614 -21.019 1.00 74.31 H new ATOM 0 HB2 ARG A 770 3.845 18.403 -20.619 1.00 14.22 H new ATOM 0 HB3 ARG A 770 3.970 18.564 -18.878 1.00 14.22 H new ATOM 0 HG2 ARG A 770 1.862 19.858 -18.828 1.00 64.32 H new ATOM 0 HG3 ARG A 770 1.744 19.759 -20.574 1.00 64.32 H new ATOM 0 HD2 ARG A 770 1.981 17.235 -18.923 1.00 71.13 H new ATOM 0 HD3 ARG A 770 0.432 18.039 -19.081 1.00 71.13 H new ATOM 0 HE ARG A 770 1.759 17.586 -21.653 1.00 0.24 H new ATOM 0 HH11 ARG A 770 -0.324 16.224 -19.149 1.00 34.02 H new ATOM 0 HH12 ARG A 770 -1.081 15.065 -20.247 1.00 34.02 H new ATOM 0 HH21 ARG A 770 0.782 16.095 -23.057 1.00 11.12 H new ATOM 0 HH22 ARG A 770 -0.458 14.993 -22.450 1.00 11.12 H new ATOM 323 N LEU A 771 3.520 21.410 -17.935 1.00 2.23 N ATOM 324 CA LEU A 771 2.828 22.423 -17.145 1.00 43.12 C ATOM 325 C LEU A 771 3.320 23.822 -17.502 1.00 63.05 C ATOM 326 O LEU A 771 2.524 24.718 -17.784 1.00 61.43 O ATOM 327 CB LEU A 771 3.035 22.163 -15.652 1.00 1.20 C ATOM 328 CG LEU A 771 2.045 22.847 -14.708 1.00 61.13 C ATOM 329 CD1 LEU A 771 2.039 22.159 -13.352 1.00 11.32 C ATOM 330 CD2 LEU A 771 2.384 24.323 -14.558 1.00 74.04 C ATOM 0 H LEU A 771 3.906 20.640 -17.388 1.00 2.23 H new ATOM 0 HA LEU A 771 1.764 22.363 -17.374 1.00 43.12 H new ATOM 0 HB2 LEU A 771 2.986 21.088 -15.481 1.00 1.20 H new ATOM 0 HB3 LEU A 771 4.042 22.483 -15.384 1.00 1.20 H new ATOM 0 HG LEU A 771 1.047 22.766 -15.138 1.00 61.13 H new ATOM 0 HD11 LEU A 771 1.329 22.659 -12.693 1.00 11.32 H new ATOM 0 HD12 LEU A 771 1.748 21.116 -13.475 1.00 11.32 H new ATOM 0 HD13 LEU A 771 3.036 22.208 -12.915 1.00 11.32 H new ATOM 0 HD21 LEU A 771 1.669 24.794 -13.883 1.00 74.04 H new ATOM 0 HD22 LEU A 771 3.390 24.426 -14.151 1.00 74.04 H new ATOM 0 HD23 LEU A 771 2.336 24.808 -15.533 1.00 74.04 H new ATOM 342 N ARG A 772 4.637 24.001 -17.491 1.00 1.44 N ATOM 343 CA ARG A 772 5.235 25.291 -17.814 1.00 64.13 C ATOM 344 C ARG A 772 4.950 25.674 -19.263 1.00 52.24 C ATOM 345 O ARG A 772 4.827 26.855 -19.591 1.00 65.42 O ATOM 346 CB ARG A 772 6.746 25.251 -17.574 1.00 53.03 C ATOM 347 CG ARG A 772 7.367 26.624 -17.374 1.00 20.40 C ATOM 348 CD ARG A 772 6.822 27.305 -16.129 1.00 2.44 C ATOM 349 NE ARG A 772 7.692 28.385 -15.671 1.00 3.32 N ATOM 350 CZ ARG A 772 7.797 29.556 -16.289 1.00 4.43 C ATOM 351 NH1 ARG A 772 7.090 29.798 -17.384 1.00 21.31 N ATOM 352 NH2 ARG A 772 8.611 30.489 -15.811 1.00 11.51 N ATOM 0 H ARG A 772 5.310 23.269 -17.262 1.00 1.44 H new ATOM 0 HA ARG A 772 4.790 26.043 -17.163 1.00 64.13 H new ATOM 0 HB2 ARG A 772 6.950 24.638 -16.696 1.00 53.03 H new ATOM 0 HB3 ARG A 772 7.227 24.764 -18.422 1.00 53.03 H new ATOM 0 HG2 ARG A 772 8.450 26.527 -17.293 1.00 20.40 H new ATOM 0 HG3 ARG A 772 7.168 27.246 -18.247 1.00 20.40 H new ATOM 0 HD2 ARG A 772 5.829 27.703 -16.339 1.00 2.44 H new ATOM 0 HD3 ARG A 772 6.708 26.569 -15.333 1.00 2.44 H new ATOM 0 HE ARG A 772 8.249 28.232 -14.831 1.00 3.32 H new ATOM 0 HH11 ARG A 772 6.463 29.084 -17.754 1.00 21.31 H new ATOM 0 HH12 ARG A 772 7.173 30.698 -17.856 1.00 21.31 H new ATOM 0 HH21 ARG A 772 9.156 30.307 -14.969 1.00 11.51 H new ATOM 0 HH22 ARG A 772 8.691 31.388 -16.286 1.00 11.51 H new ATOM 366 N ASP A 773 4.846 24.669 -20.126 1.00 54.41 N ATOM 367 CA ASP A 773 4.574 24.901 -21.540 1.00 70.21 C ATOM 368 C ASP A 773 3.208 25.553 -21.732 1.00 22.15 C ATOM 369 O ASP A 773 3.103 26.645 -22.292 1.00 73.42 O ATOM 370 CB ASP A 773 4.637 23.584 -22.316 1.00 24.04 C ATOM 371 CG ASP A 773 5.851 23.503 -23.221 1.00 54.31 C ATOM 372 OD1 ASP A 773 5.775 22.804 -24.253 1.00 13.40 O ATOM 373 OD2 ASP A 773 6.876 24.138 -22.897 1.00 43.35 O ATOM 0 H ASP A 773 4.946 23.686 -19.871 1.00 54.41 H new ATOM 0 HA ASP A 773 5.337 25.578 -21.924 1.00 70.21 H new ATOM 0 HB2 ASP A 773 4.656 22.752 -21.613 1.00 24.04 H new ATOM 0 HB3 ASP A 773 3.733 23.475 -22.915 1.00 24.04 H new ATOM 378 N LEU A 774 2.165 24.877 -21.263 1.00 71.15 N ATOM 379 CA LEU A 774 0.804 25.390 -21.384 1.00 25.22 C ATOM 380 C LEU A 774 0.663 26.731 -20.670 1.00 71.54 C ATOM 381 O LEU A 774 0.106 27.682 -21.219 1.00 45.54 O ATOM 382 CB LEU A 774 -0.194 24.384 -20.807 1.00 4.31 C ATOM 383 CG LEU A 774 -1.663 24.622 -21.155 1.00 53.32 C ATOM 384 CD1 LEU A 774 -1.918 24.329 -22.625 1.00 62.45 C ATOM 385 CD2 LEU A 774 -2.565 23.769 -20.275 1.00 61.11 C ATOM 0 H LEU A 774 2.235 23.973 -20.796 1.00 71.15 H new ATOM 0 HA LEU A 774 0.590 25.538 -22.442 1.00 25.22 H new ATOM 0 HB2 LEU A 774 0.084 23.388 -21.152 1.00 4.31 H new ATOM 0 HB3 LEU A 774 -0.094 24.385 -19.722 1.00 4.31 H new ATOM 0 HG LEU A 774 -1.895 25.671 -20.969 1.00 53.32 H new ATOM 0 HD11 LEU A 774 -2.969 24.504 -22.854 1.00 62.45 H new ATOM 0 HD12 LEU A 774 -1.299 24.983 -23.239 1.00 62.45 H new ATOM 0 HD13 LEU A 774 -1.669 23.289 -22.837 1.00 62.45 H new ATOM 0 HD21 LEU A 774 -3.607 23.952 -20.537 1.00 61.11 H new ATOM 0 HD22 LEU A 774 -2.332 22.715 -20.428 1.00 61.11 H new ATOM 0 HD23 LEU A 774 -2.403 24.028 -19.229 1.00 61.11 H new ATOM 397 N LEU A 775 1.171 26.799 -19.445 1.00 45.31 N ATOM 398 CA LEU A 775 1.104 28.025 -18.656 1.00 61.34 C ATOM 399 C LEU A 775 1.845 29.162 -19.352 1.00 65.44 C ATOM 400 O LEU A 775 1.467 30.328 -19.234 1.00 62.12 O ATOM 401 CB LEU A 775 1.695 27.792 -17.265 1.00 31.13 C ATOM 402 CG LEU A 775 1.355 28.843 -16.207 1.00 65.21 C ATOM 403 CD1 LEU A 775 -0.142 28.871 -15.944 1.00 52.33 C ATOM 404 CD2 LEU A 775 2.120 28.570 -14.920 1.00 34.03 C ATOM 0 H LEU A 775 1.634 26.020 -18.976 1.00 45.31 H new ATOM 0 HA LEU A 775 0.056 28.307 -18.556 1.00 61.34 H new ATOM 0 HB2 LEU A 775 1.355 26.821 -16.906 1.00 31.13 H new ATOM 0 HB3 LEU A 775 2.780 27.736 -17.358 1.00 31.13 H new ATOM 0 HG LEU A 775 1.655 29.821 -16.584 1.00 65.21 H new ATOM 0 HD11 LEU A 775 -0.365 29.625 -15.189 1.00 52.33 H new ATOM 0 HD12 LEU A 775 -0.669 29.115 -16.866 1.00 52.33 H new ATOM 0 HD13 LEU A 775 -0.467 27.893 -15.588 1.00 52.33 H new ATOM 0 HD21 LEU A 775 1.866 29.327 -14.178 1.00 34.03 H new ATOM 0 HD22 LEU A 775 1.851 27.585 -14.539 1.00 34.03 H new ATOM 0 HD23 LEU A 775 3.191 28.602 -15.120 1.00 34.03 H new ATOM 416 N LEU A 776 2.902 28.814 -20.080 1.00 15.54 N ATOM 417 CA LEU A 776 3.695 29.806 -20.798 1.00 24.35 C ATOM 418 C LEU A 776 2.908 30.392 -21.965 1.00 62.11 C ATOM 419 O LEU A 776 2.664 31.598 -22.018 1.00 74.44 O ATOM 420 CB LEU A 776 4.993 29.177 -21.307 1.00 62.42 C ATOM 421 CG LEU A 776 5.822 30.031 -22.267 1.00 12.41 C ATOM 422 CD1 LEU A 776 6.201 31.351 -21.614 1.00 42.40 C ATOM 423 CD2 LEU A 776 7.066 29.278 -22.713 1.00 62.13 C ATOM 0 H LEU A 776 3.229 27.854 -20.188 1.00 15.54 H new ATOM 0 HA LEU A 776 3.936 30.613 -20.106 1.00 24.35 H new ATOM 0 HB2 LEU A 776 5.614 28.927 -20.447 1.00 62.42 H new ATOM 0 HB3 LEU A 776 4.748 28.240 -21.806 1.00 62.42 H new ATOM 0 HG LEU A 776 5.217 30.245 -23.148 1.00 12.41 H new ATOM 0 HD11 LEU A 776 6.791 31.946 -22.311 1.00 42.40 H new ATOM 0 HD12 LEU A 776 5.297 31.897 -21.346 1.00 42.40 H new ATOM 0 HD13 LEU A 776 6.788 31.157 -20.716 1.00 42.40 H new ATOM 0 HD21 LEU A 776 7.643 29.901 -23.396 1.00 62.13 H new ATOM 0 HD22 LEU A 776 7.675 29.033 -21.843 1.00 62.13 H new ATOM 0 HD23 LEU A 776 6.773 28.359 -23.221 1.00 62.13 H new ATOM 435 N ILE A 777 2.513 29.531 -22.897 1.00 11.11 N ATOM 436 CA ILE A 777 1.750 29.963 -24.062 1.00 5.45 C ATOM 437 C ILE A 777 0.513 30.752 -23.647 1.00 1.14 C ATOM 438 O ILE A 777 0.174 31.764 -24.260 1.00 2.41 O ATOM 439 CB ILE A 777 1.316 28.765 -24.926 1.00 52.53 C ATOM 440 CG1 ILE A 777 0.430 29.237 -26.082 1.00 3.15 C ATOM 441 CG2 ILE A 777 0.584 27.737 -24.077 1.00 24.21 C ATOM 442 CD1 ILE A 777 0.332 28.239 -27.214 1.00 45.32 C ATOM 0 H ILE A 777 2.709 28.530 -22.868 1.00 11.11 H new ATOM 0 HA ILE A 777 2.407 30.605 -24.650 1.00 5.45 H new ATOM 0 HB ILE A 777 2.207 28.295 -25.343 1.00 52.53 H new ATOM 0 HG12 ILE A 777 -0.571 29.442 -25.702 1.00 3.15 H new ATOM 0 HG13 ILE A 777 0.823 30.177 -26.470 1.00 3.15 H new ATOM 0 HG21 ILE A 777 0.284 26.896 -24.702 1.00 24.21 H new ATOM 0 HG22 ILE A 777 1.244 27.383 -23.285 1.00 24.21 H new ATOM 0 HG23 ILE A 777 -0.301 28.194 -23.634 1.00 24.21 H new ATOM 0 HD11 ILE A 777 -0.311 28.640 -27.998 1.00 45.32 H new ATOM 0 HD12 ILE A 777 1.326 28.051 -27.621 1.00 45.32 H new ATOM 0 HD13 ILE A 777 -0.089 27.306 -26.841 1.00 45.32 H new ATOM 454 N VAL A 778 -0.158 30.282 -22.600 1.00 1.44 N ATOM 455 CA VAL A 778 -1.357 30.945 -22.100 1.00 4.11 C ATOM 456 C VAL A 778 -1.032 32.332 -21.558 1.00 0.44 C ATOM 457 O VAL A 778 -1.512 33.342 -22.075 1.00 23.12 O ATOM 458 CB VAL A 778 -2.034 30.118 -20.991 1.00 52.11 C ATOM 459 CG1 VAL A 778 -3.176 30.902 -20.362 1.00 42.11 C ATOM 460 CG2 VAL A 778 -2.529 28.790 -21.545 1.00 15.55 C ATOM 0 H VAL A 778 0.108 29.445 -22.082 1.00 1.44 H new ATOM 0 HA VAL A 778 -2.042 31.039 -22.943 1.00 4.11 H new ATOM 0 HB VAL A 778 -1.297 29.910 -20.215 1.00 52.11 H new ATOM 0 HG11 VAL A 778 -3.642 30.302 -19.581 1.00 42.11 H new ATOM 0 HG12 VAL A 778 -2.789 31.824 -19.929 1.00 42.11 H new ATOM 0 HG13 VAL A 778 -3.916 31.142 -21.125 1.00 42.11 H new ATOM 0 HG21 VAL A 778 -3.005 28.218 -20.748 1.00 15.55 H new ATOM 0 HG22 VAL A 778 -3.251 28.974 -22.340 1.00 15.55 H new ATOM 0 HG23 VAL A 778 -1.686 28.225 -21.944 1.00 15.55 H new ATOM 470 N THR A 779 -0.213 32.376 -20.511 1.00 50.22 N ATOM 471 CA THR A 779 0.176 33.640 -19.897 1.00 70.55 C ATOM 472 C THR A 779 0.733 34.607 -20.936 1.00 21.33 C ATOM 473 O THR A 779 0.631 35.824 -20.782 1.00 75.10 O ATOM 474 CB THR A 779 1.229 33.427 -18.793 1.00 51.04 C ATOM 475 OG1 THR A 779 2.376 32.760 -19.332 1.00 34.41 O ATOM 476 CG2 THR A 779 0.653 32.611 -17.646 1.00 71.33 C ATOM 0 H THR A 779 0.194 31.551 -20.071 1.00 50.22 H new ATOM 0 HA THR A 779 -0.724 34.067 -19.453 1.00 70.55 H new ATOM 0 HB THR A 779 1.524 34.404 -18.410 1.00 51.04 H new ATOM 0 HG1 THR A 779 2.117 31.870 -19.651 1.00 34.41 H new ATOM 0 HG21 THR A 779 1.415 32.474 -16.879 1.00 71.33 H new ATOM 0 HG22 THR A 779 -0.201 33.136 -17.219 1.00 71.33 H new ATOM 0 HG23 THR A 779 0.332 31.638 -18.017 1.00 71.33 H new ATOM 484 N ARG A 780 1.322 34.058 -21.993 1.00 62.30 N ATOM 485 CA ARG A 780 1.896 34.873 -23.057 1.00 20.11 C ATOM 486 C ARG A 780 0.800 35.554 -23.871 1.00 1.30 C ATOM 487 O ARG A 780 0.751 36.782 -23.959 1.00 63.44 O ATOM 488 CB ARG A 780 2.767 34.013 -23.974 1.00 63.40 C ATOM 489 CG ARG A 780 3.353 34.777 -25.150 1.00 74.44 C ATOM 490 CD ARG A 780 4.240 35.920 -24.686 1.00 4.43 C ATOM 491 NE ARG A 780 5.384 35.446 -23.911 1.00 71.21 N ATOM 492 CZ ARG A 780 6.412 34.794 -24.443 1.00 1.12 C ATOM 493 NH1 ARG A 780 6.440 34.541 -25.744 1.00 51.40 N ATOM 494 NH2 ARG A 780 7.416 34.394 -23.672 1.00 52.34 N ATOM 0 H ARG A 780 1.414 33.052 -22.136 1.00 62.30 H new ATOM 0 HA ARG A 780 2.515 35.643 -22.597 1.00 20.11 H new ATOM 0 HB2 ARG A 780 3.580 33.583 -23.390 1.00 63.40 H new ATOM 0 HB3 ARG A 780 2.172 33.182 -24.352 1.00 63.40 H new ATOM 0 HG2 ARG A 780 3.932 34.097 -25.775 1.00 74.44 H new ATOM 0 HG3 ARG A 780 2.546 35.170 -25.769 1.00 74.44 H new ATOM 0 HD2 ARG A 780 4.595 36.478 -25.552 1.00 4.43 H new ATOM 0 HD3 ARG A 780 3.654 36.611 -24.081 1.00 4.43 H new ATOM 0 HE ARG A 780 5.394 35.625 -22.907 1.00 71.21 H new ATOM 0 HH11 ARG A 780 5.671 34.847 -26.340 1.00 51.40 H new ATOM 0 HH12 ARG A 780 7.231 34.040 -26.149 1.00 51.40 H new ATOM 0 HH21 ARG A 780 7.398 34.587 -22.671 1.00 52.34 H new ATOM 0 HH22 ARG A 780 8.205 33.893 -24.081 1.00 52.34 H new ATOM 508 N ILE A 781 -0.076 34.750 -24.464 1.00 11.34 N ATOM 509 CA ILE A 781 -1.171 35.276 -25.270 1.00 30.15 C ATOM 510 C ILE A 781 -2.060 36.205 -24.450 1.00 42.51 C ATOM 511 O ILE A 781 -2.636 37.157 -24.978 1.00 61.44 O ATOM 512 CB ILE A 781 -2.034 34.142 -25.854 1.00 52.44 C ATOM 513 CG1 ILE A 781 -1.189 33.242 -26.757 1.00 43.04 C ATOM 514 CG2 ILE A 781 -3.213 34.718 -26.625 1.00 42.02 C ATOM 515 CD1 ILE A 781 -0.662 33.945 -27.989 1.00 1.01 C ATOM 0 H ILE A 781 -0.049 33.732 -24.402 1.00 11.34 H new ATOM 0 HA ILE A 781 -0.720 35.837 -26.088 1.00 30.15 H new ATOM 0 HB ILE A 781 -2.421 33.539 -25.032 1.00 52.44 H new ATOM 0 HG12 ILE A 781 -0.348 32.852 -26.183 1.00 43.04 H new ATOM 0 HG13 ILE A 781 -1.788 32.386 -27.066 1.00 43.04 H new ATOM 0 HG21 ILE A 781 -3.814 33.905 -27.032 1.00 42.02 H new ATOM 0 HG22 ILE A 781 -3.826 35.322 -25.955 1.00 42.02 H new ATOM 0 HG23 ILE A 781 -2.845 35.341 -27.441 1.00 42.02 H new ATOM 0 HD11 ILE A 781 -0.072 33.246 -28.582 1.00 1.01 H new ATOM 0 HD12 ILE A 781 -1.498 34.311 -28.585 1.00 1.01 H new ATOM 0 HD13 ILE A 781 -0.036 34.785 -27.689 1.00 1.01 H new ATOM 527 N VAL A 782 -2.165 35.925 -23.155 1.00 73.21 N ATOM 528 CA VAL A 782 -2.981 36.737 -22.261 1.00 14.32 C ATOM 529 C VAL A 782 -2.333 38.093 -22.005 1.00 1.03 C ATOM 530 O VAL A 782 -2.976 39.134 -22.137 1.00 23.10 O ATOM 531 CB VAL A 782 -3.213 36.029 -20.913 1.00 61.51 C ATOM 532 CG1 VAL A 782 -4.030 36.909 -19.980 1.00 1.01 C ATOM 533 CG2 VAL A 782 -3.896 34.687 -21.128 1.00 34.42 C ATOM 0 H VAL A 782 -1.695 35.142 -22.702 1.00 73.21 H new ATOM 0 HA VAL A 782 -3.941 36.884 -22.756 1.00 14.32 H new ATOM 0 HB VAL A 782 -2.245 35.848 -20.446 1.00 61.51 H new ATOM 0 HG11 VAL A 782 -4.183 36.391 -19.033 1.00 1.01 H new ATOM 0 HG12 VAL A 782 -3.497 37.843 -19.801 1.00 1.01 H new ATOM 0 HG13 VAL A 782 -4.996 37.124 -20.436 1.00 1.01 H new ATOM 0 HG21 VAL A 782 -4.052 34.200 -20.165 1.00 34.42 H new ATOM 0 HG22 VAL A 782 -4.858 34.842 -21.617 1.00 34.42 H new ATOM 0 HG23 VAL A 782 -3.268 34.056 -21.756 1.00 34.42 H new ATOM 543 N GLU A 783 -1.055 38.072 -21.638 1.00 52.11 N ATOM 544 CA GLU A 783 -0.320 39.301 -21.363 1.00 62.22 C ATOM 545 C GLU A 783 -0.198 40.155 -22.622 1.00 13.33 C ATOM 546 O GLU A 783 -0.190 41.385 -22.553 1.00 5.15 O ATOM 547 CB GLU A 783 1.072 38.977 -20.817 1.00 23.01 C ATOM 548 CG GLU A 783 1.087 38.678 -19.327 1.00 43.42 C ATOM 549 CD GLU A 783 1.051 39.935 -18.480 1.00 1.51 C ATOM 550 OE1 GLU A 783 0.124 40.066 -17.653 1.00 42.20 O ATOM 551 OE2 GLU A 783 1.949 40.788 -18.644 1.00 15.15 O ATOM 0 H GLU A 783 -0.508 37.219 -21.524 1.00 52.11 H new ATOM 0 HA GLU A 783 -0.874 39.866 -20.614 1.00 62.22 H new ATOM 0 HB2 GLU A 783 1.473 38.118 -21.355 1.00 23.01 H new ATOM 0 HB3 GLU A 783 1.736 39.818 -21.017 1.00 23.01 H new ATOM 0 HG2 GLU A 783 0.231 38.051 -19.077 1.00 43.42 H new ATOM 0 HG3 GLU A 783 1.982 38.106 -19.084 1.00 43.42 H new ATOM 850 N LEU A 800 -21.366 44.829 -14.559 1.00 64.11 N ATOM 851 CA LEU A 800 -21.583 44.028 -13.359 1.00 51.13 C ATOM 852 C LEU A 800 -21.745 44.919 -12.132 1.00 0.01 C ATOM 853 O LEU A 800 -22.773 44.880 -11.457 1.00 20.45 O ATOM 854 CB LEU A 800 -20.418 43.060 -13.151 1.00 25.45 C ATOM 855 CG LEU A 800 -20.593 41.661 -13.743 1.00 23.11 C ATOM 856 CD1 LEU A 800 -20.987 41.748 -15.209 1.00 72.31 C ATOM 857 CD2 LEU A 800 -19.316 40.849 -13.579 1.00 72.24 C ATOM 0 HA LEU A 800 -22.502 43.457 -13.494 1.00 51.13 H new ATOM 0 HB2 LEU A 800 -19.521 43.505 -13.581 1.00 25.45 H new ATOM 0 HB3 LEU A 800 -20.242 42.960 -12.080 1.00 25.45 H new ATOM 0 HG LEU A 800 -21.393 41.155 -13.202 1.00 23.11 H new ATOM 0 HD11 LEU A 800 -21.107 40.743 -15.614 1.00 72.31 H new ATOM 0 HD12 LEU A 800 -21.927 42.291 -15.301 1.00 72.31 H new ATOM 0 HD13 LEU A 800 -20.209 42.272 -15.764 1.00 72.31 H new ATOM 0 HD21 LEU A 800 -19.459 39.856 -14.006 1.00 72.24 H new ATOM 0 HD22 LEU A 800 -18.497 41.351 -14.094 1.00 72.24 H new ATOM 0 HD23 LEU A 800 -19.077 40.757 -12.520 1.00 72.24 H new ATOM 869 N GLN A 801 -20.724 45.722 -11.851 1.00 40.43 N ATOM 870 CA GLN A 801 -20.755 46.624 -10.706 1.00 45.20 C ATOM 871 C GLN A 801 -21.991 47.516 -10.748 1.00 32.31 C ATOM 872 O GLN A 801 -22.552 47.866 -9.709 1.00 70.42 O ATOM 873 CB GLN A 801 -19.491 47.486 -10.675 1.00 20.23 C ATOM 874 CG GLN A 801 -18.263 46.747 -10.169 1.00 21.53 C ATOM 875 CD GLN A 801 -17.155 47.685 -9.734 1.00 45.11 C ATOM 876 OE1 GLN A 801 -16.843 47.790 -8.547 1.00 75.43 O ATOM 877 NE2 GLN A 801 -16.551 48.375 -10.695 1.00 73.54 N ATOM 0 H GLN A 801 -19.866 45.766 -12.400 1.00 40.43 H new ATOM 0 HA GLN A 801 -20.797 46.019 -9.800 1.00 45.20 H new ATOM 0 HB2 GLN A 801 -19.292 47.860 -11.679 1.00 20.23 H new ATOM 0 HB3 GLN A 801 -19.669 48.355 -10.041 1.00 20.23 H new ATOM 0 HG2 GLN A 801 -18.546 46.112 -9.330 1.00 21.53 H new ATOM 0 HG3 GLN A 801 -17.890 46.090 -10.955 1.00 21.53 H new ATOM 0 HE21 GLN A 801 -16.841 48.258 -11.666 1.00 73.54 H new ATOM 0 HE22 GLN A 801 -15.798 49.022 -10.462 1.00 73.54 H new ATOM 886 N TYR A 802 -22.411 47.880 -11.954 1.00 41.14 N ATOM 887 CA TYR A 802 -23.580 48.733 -12.132 1.00 1.45 C ATOM 888 C TYR A 802 -24.836 48.056 -11.591 1.00 4.31 C ATOM 889 O TYR A 802 -25.501 48.580 -10.698 1.00 10.43 O ATOM 890 CB TYR A 802 -23.768 49.076 -13.610 1.00 70.24 C ATOM 891 CG TYR A 802 -23.455 50.517 -13.943 1.00 14.43 C ATOM 892 CD1 TYR A 802 -24.063 51.558 -13.251 1.00 71.03 C ATOM 893 CD2 TYR A 802 -22.551 50.839 -14.948 1.00 33.42 C ATOM 894 CE1 TYR A 802 -23.781 52.876 -13.552 1.00 40.32 C ATOM 895 CE2 TYR A 802 -22.262 52.154 -15.255 1.00 0.24 C ATOM 896 CZ TYR A 802 -22.880 53.169 -14.554 1.00 43.44 C ATOM 897 OH TYR A 802 -22.595 54.481 -14.856 1.00 41.42 O ATOM 0 H TYR A 802 -21.959 47.598 -12.824 1.00 41.14 H new ATOM 0 HA TYR A 802 -23.415 49.653 -11.571 1.00 1.45 H new ATOM 0 HB2 TYR A 802 -23.129 48.427 -14.209 1.00 70.24 H new ATOM 0 HB3 TYR A 802 -24.798 48.862 -13.896 1.00 70.24 H new ATOM 0 HD1 TYR A 802 -24.768 51.332 -12.465 1.00 71.03 H new ATOM 0 HD2 TYR A 802 -22.066 50.047 -15.499 1.00 33.42 H new ATOM 0 HE1 TYR A 802 -24.263 53.673 -13.006 1.00 40.32 H new ATOM 0 HE2 TYR A 802 -21.557 52.386 -16.039 1.00 0.24 H new ATOM 0 HH TYR A 802 -21.940 54.514 -15.584 1.00 41.42 H new ATOM 907 N TRP A 803 -25.152 46.889 -12.139 1.00 33.22 N ATOM 908 CA TRP A 803 -26.328 46.138 -11.712 1.00 42.20 C ATOM 909 C TRP A 803 -26.260 45.822 -10.222 1.00 72.10 C ATOM 910 O TRP A 803 -27.230 46.022 -9.491 1.00 74.41 O ATOM 911 CB TRP A 803 -26.451 44.843 -12.516 1.00 23.21 C ATOM 912 CG TRP A 803 -26.264 45.039 -13.990 1.00 70.41 C ATOM 913 CD1 TRP A 803 -25.479 44.294 -14.823 1.00 24.32 C ATOM 914 CD2 TRP A 803 -26.873 46.046 -14.805 1.00 12.23 C ATOM 915 NE1 TRP A 803 -25.563 44.778 -16.106 1.00 62.31 N ATOM 916 CE2 TRP A 803 -26.413 45.852 -16.122 1.00 24.14 C ATOM 917 CE3 TRP A 803 -27.764 47.092 -14.550 1.00 53.13 C ATOM 918 CZ2 TRP A 803 -26.813 46.666 -17.178 1.00 12.03 C ATOM 919 CZ3 TRP A 803 -28.161 47.899 -15.599 1.00 44.55 C ATOM 920 CH2 TRP A 803 -27.686 47.683 -16.900 1.00 31.40 C ATOM 0 H TRP A 803 -24.611 46.442 -12.879 1.00 33.22 H new ATOM 0 HA TRP A 803 -27.208 46.755 -11.894 1.00 42.20 H new ATOM 0 HB2 TRP A 803 -25.712 44.128 -12.155 1.00 23.21 H new ATOM 0 HB3 TRP A 803 -27.433 44.404 -12.337 1.00 23.21 H new ATOM 0 HD1 TRP A 803 -24.880 43.449 -14.518 1.00 24.32 H new ATOM 0 HE1 TRP A 803 -25.072 44.399 -16.916 1.00 62.31 H new ATOM 0 HE3 TRP A 803 -28.136 47.266 -13.551 1.00 53.13 H new ATOM 0 HZ2 TRP A 803 -26.448 46.501 -18.181 1.00 12.03 H new ATOM 0 HZ3 TRP A 803 -28.849 48.710 -15.413 1.00 44.55 H new ATOM 0 HH2 TRP A 803 -28.015 48.331 -17.698 1.00 31.40 H new ATOM 931 N SER A 804 -25.109 45.328 -9.778 1.00 20.12 N ATOM 932 CA SER A 804 -24.917 44.981 -8.375 1.00 22.34 C ATOM 933 C SER A 804 -25.293 46.150 -7.469 1.00 62.24 C ATOM 934 O SER A 804 -26.198 46.042 -6.643 1.00 31.41 O ATOM 935 CB SER A 804 -23.464 44.572 -8.123 1.00 11.43 C ATOM 936 OG SER A 804 -23.326 43.927 -6.869 1.00 1.03 O ATOM 0 H SER A 804 -24.295 45.159 -10.369 1.00 20.12 H new ATOM 0 HA SER A 804 -25.570 44.140 -8.142 1.00 22.34 H new ATOM 0 HB2 SER A 804 -23.128 43.906 -8.917 1.00 11.43 H new ATOM 0 HB3 SER A 804 -22.824 45.454 -8.154 1.00 11.43 H new ATOM 0 HG SER A 804 -22.389 43.674 -6.733 1.00 1.03 H new ATOM 942 N GLN A 805 -24.590 47.266 -7.633 1.00 11.14 N ATOM 943 CA GLN A 805 -24.849 48.455 -6.830 1.00 12.51 C ATOM 944 C GLN A 805 -26.295 48.915 -6.988 1.00 62.14 C ATOM 945 O GLN A 805 -26.895 49.438 -6.051 1.00 14.44 O ATOM 946 CB GLN A 805 -23.896 49.584 -7.229 1.00 74.42 C ATOM 947 CG GLN A 805 -24.224 50.916 -6.575 1.00 45.32 C ATOM 948 CD GLN A 805 -23.111 51.934 -6.735 1.00 71.35 C ATOM 949 OE1 GLN A 805 -22.640 52.186 -7.845 1.00 14.41 O ATOM 950 NE2 GLN A 805 -22.684 52.524 -5.625 1.00 52.24 N ATOM 0 H GLN A 805 -23.838 47.372 -8.314 1.00 11.14 H new ATOM 0 HA GLN A 805 -24.680 48.199 -5.784 1.00 12.51 H new ATOM 0 HB2 GLN A 805 -22.878 49.299 -6.964 1.00 74.42 H new ATOM 0 HB3 GLN A 805 -23.922 49.704 -8.312 1.00 74.42 H new ATOM 0 HG2 GLN A 805 -25.141 51.314 -7.010 1.00 45.32 H new ATOM 0 HG3 GLN A 805 -24.417 50.758 -5.514 1.00 45.32 H new ATOM 0 HE21 GLN A 805 -23.103 52.285 -4.726 1.00 52.24 H new ATOM 0 HE22 GLN A 805 -21.937 53.217 -5.671 1.00 52.24 H new ATOM 959 N GLU A 806 -26.847 48.715 -8.181 1.00 43.43 N ATOM 960 CA GLU A 806 -28.222 49.111 -8.462 1.00 21.03 C ATOM 961 C GLU A 806 -29.196 48.386 -7.537 1.00 42.12 C ATOM 962 O GLU A 806 -30.053 49.009 -6.909 1.00 31.53 O ATOM 963 CB GLU A 806 -28.573 48.817 -9.922 1.00 1.12 C ATOM 964 CG GLU A 806 -28.842 50.065 -10.746 1.00 60.21 C ATOM 965 CD GLU A 806 -30.293 50.501 -10.687 1.00 41.31 C ATOM 966 OE1 GLU A 806 -31.160 49.744 -11.172 1.00 2.01 O ATOM 967 OE2 GLU A 806 -30.562 51.599 -10.157 1.00 3.32 O ATOM 0 H GLU A 806 -26.363 48.282 -8.968 1.00 43.43 H new ATOM 0 HA GLU A 806 -28.308 50.183 -8.284 1.00 21.03 H new ATOM 0 HB2 GLU A 806 -27.755 48.260 -10.378 1.00 1.12 H new ATOM 0 HB3 GLU A 806 -29.453 48.174 -9.953 1.00 1.12 H new ATOM 0 HG2 GLU A 806 -28.208 50.876 -10.388 1.00 60.21 H new ATOM 0 HG3 GLU A 806 -28.565 49.878 -11.783 1.00 60.21 H new ATOM 974 N LEU A 807 -29.058 47.067 -7.460 1.00 12.12 N ATOM 975 CA LEU A 807 -29.926 46.256 -6.613 1.00 24.32 C ATOM 976 C LEU A 807 -29.665 46.539 -5.137 1.00 22.41 C ATOM 977 O LEU A 807 -30.585 46.526 -4.319 1.00 21.12 O ATOM 978 CB LEU A 807 -29.711 44.770 -6.905 1.00 31.43 C ATOM 979 CG LEU A 807 -30.546 44.182 -8.043 1.00 20.31 C ATOM 980 CD1 LEU A 807 -30.090 44.740 -9.382 1.00 74.43 C ATOM 981 CD2 LEU A 807 -30.459 42.662 -8.039 1.00 11.55 C ATOM 0 H LEU A 807 -28.354 46.537 -7.973 1.00 12.12 H new ATOM 0 HA LEU A 807 -30.960 46.518 -6.837 1.00 24.32 H new ATOM 0 HB2 LEU A 807 -28.657 44.614 -7.136 1.00 31.43 H new ATOM 0 HB3 LEU A 807 -29.924 44.207 -5.996 1.00 31.43 H new ATOM 0 HG LEU A 807 -31.587 44.467 -7.889 1.00 20.31 H new ATOM 0 HD11 LEU A 807 -30.695 44.311 -10.180 1.00 74.43 H new ATOM 0 HD12 LEU A 807 -30.205 45.824 -9.383 1.00 74.43 H new ATOM 0 HD13 LEU A 807 -29.042 44.486 -9.544 1.00 74.43 H new ATOM 0 HD21 LEU A 807 -31.059 42.261 -8.856 1.00 11.55 H new ATOM 0 HD22 LEU A 807 -29.421 42.357 -8.168 1.00 11.55 H new ATOM 0 HD23 LEU A 807 -30.835 42.279 -7.090 1.00 11.55 H new ATOM 993 N LYS A 808 -28.405 46.796 -4.803 1.00 2.02 N ATOM 994 CA LYS A 808 -28.022 47.086 -3.426 1.00 43.12 C ATOM 995 C LYS A 808 -28.612 48.415 -2.966 1.00 4.22 C ATOM 996 O LYS A 808 -29.373 48.466 -2.001 1.00 20.22 O ATOM 997 CB LYS A 808 -26.497 47.120 -3.296 1.00 13.03 C ATOM 998 CG LYS A 808 -26.013 47.619 -1.945 1.00 54.33 C ATOM 999 CD LYS A 808 -24.497 47.704 -1.893 1.00 12.22 C ATOM 1000 CE LYS A 808 -24.032 48.742 -0.883 1.00 43.54 C ATOM 1001 NZ LYS A 808 -24.471 50.115 -1.257 1.00 54.30 N ATOM 0 H LYS A 808 -27.631 46.809 -5.467 1.00 2.02 H new ATOM 0 HA LYS A 808 -28.417 46.294 -2.790 1.00 43.12 H new ATOM 0 HB2 LYS A 808 -26.104 46.118 -3.466 1.00 13.03 H new ATOM 0 HB3 LYS A 808 -26.088 47.760 -4.078 1.00 13.03 H new ATOM 0 HG2 LYS A 808 -26.441 48.601 -1.744 1.00 54.33 H new ATOM 0 HG3 LYS A 808 -26.368 46.951 -1.161 1.00 54.33 H new ATOM 0 HD2 LYS A 808 -24.086 46.729 -1.631 1.00 12.22 H new ATOM 0 HD3 LYS A 808 -24.111 47.957 -2.881 1.00 12.22 H new ATOM 0 HE2 LYS A 808 -24.424 48.491 0.103 1.00 43.54 H new ATOM 0 HE3 LYS A 808 -22.945 48.716 -0.809 1.00 43.54 H new ATOM 0 HZ1 LYS A 808 -23.797 50.810 -0.877 1.00 54.30 H new ATOM 0 HZ2 LYS A 808 -24.507 50.198 -2.293 1.00 54.30 H new ATOM 0 HZ3 LYS A 808 -25.416 50.297 -0.862 1.00 54.30 H new ATOM 1015 N ASN A 809 -28.256 49.489 -3.664 1.00 24.14 N ATOM 1016 CA ASN A 809 -28.751 50.818 -3.326 1.00 40.53 C ATOM 1017 C ASN A 809 -30.276 50.849 -3.335 1.00 53.12 C ATOM 1018 O ASN A 809 -30.902 51.405 -2.432 1.00 25.51 O ATOM 1019 CB ASN A 809 -28.203 51.854 -4.310 1.00 52.32 C ATOM 1020 CG ASN A 809 -28.698 53.256 -4.009 1.00 24.11 C ATOM 1021 OD1 ASN A 809 -28.371 53.832 -2.971 1.00 20.41 O ATOM 1022 ND2 ASN A 809 -29.490 53.812 -4.918 1.00 61.11 N ATOM 0 H ASN A 809 -27.627 49.465 -4.467 1.00 24.14 H new ATOM 0 HA ASN A 809 -28.406 51.062 -2.321 1.00 40.53 H new ATOM 0 HB2 ASN A 809 -27.114 51.841 -4.277 1.00 52.32 H new ATOM 0 HB3 ASN A 809 -28.495 51.578 -5.323 1.00 52.32 H new ATOM 0 HD21 ASN A 809 -29.853 54.754 -4.770 1.00 61.11 H new ATOM 0 HD22 ASN A 809 -29.735 53.298 -5.764 1.00 61.11 H new ATOM 1029 N SER A 810 -30.869 50.248 -4.362 1.00 21.32 N ATOM 1030 CA SER A 810 -32.321 50.209 -4.490 1.00 61.54 C ATOM 1031 C SER A 810 -32.948 49.434 -3.335 1.00 61.44 C ATOM 1032 O SER A 810 -33.862 49.920 -2.671 1.00 53.21 O ATOM 1033 CB SER A 810 -32.719 49.571 -5.823 1.00 30.11 C ATOM 1034 OG SER A 810 -34.123 49.402 -5.908 1.00 34.52 O ATOM 0 H SER A 810 -30.366 49.782 -5.117 1.00 21.32 H new ATOM 0 HA SER A 810 -32.692 51.234 -4.460 1.00 61.54 H new ATOM 0 HB2 SER A 810 -32.374 50.196 -6.646 1.00 30.11 H new ATOM 0 HB3 SER A 810 -32.226 48.605 -5.929 1.00 30.11 H new ATOM 0 HG SER A 810 -34.352 48.994 -6.769 1.00 34.52 H new ATOM 1040 N ALA A 811 -32.449 48.224 -3.103 1.00 4.14 N ATOM 1041 CA ALA A 811 -32.957 47.382 -2.027 1.00 73.34 C ATOM 1042 C ALA A 811 -32.990 48.140 -0.705 1.00 31.23 C ATOM 1043 O ALA A 811 -34.020 48.192 -0.033 1.00 32.24 O ATOM 1044 CB ALA A 811 -32.111 46.124 -1.896 1.00 43.35 C ATOM 0 H ALA A 811 -31.694 47.805 -3.646 1.00 4.14 H new ATOM 0 HA ALA A 811 -33.979 47.095 -2.276 1.00 73.34 H new ATOM 0 HB1 ALA A 811 -32.502 45.505 -1.089 1.00 43.35 H new ATOM 0 HB2 ALA A 811 -32.144 45.564 -2.831 1.00 43.35 H new ATOM 0 HB3 ALA A 811 -31.080 46.400 -1.675 1.00 43.35 H new ATOM 1050 N VAL A 812 -31.856 48.726 -0.336 1.00 4.32 N ATOM 1051 CA VAL A 812 -31.755 49.482 0.907 1.00 43.21 C ATOM 1052 C VAL A 812 -32.686 50.689 0.893 1.00 2.31 C ATOM 1053 O VAL A 812 -33.278 51.041 1.913 1.00 63.14 O ATOM 1054 CB VAL A 812 -30.313 49.963 1.156 1.00 63.11 C ATOM 1055 CG1 VAL A 812 -30.232 50.764 2.446 1.00 11.04 C ATOM 1056 CG2 VAL A 812 -29.356 48.781 1.192 1.00 32.51 C ATOM 0 H VAL A 812 -30.994 48.692 -0.880 1.00 4.32 H new ATOM 0 HA VAL A 812 -32.050 48.809 1.712 1.00 43.21 H new ATOM 0 HB VAL A 812 -30.019 50.615 0.333 1.00 63.11 H new ATOM 0 HG11 VAL A 812 -29.206 51.095 2.605 1.00 11.04 H new ATOM 0 HG12 VAL A 812 -30.887 51.633 2.377 1.00 11.04 H new ATOM 0 HG13 VAL A 812 -30.545 50.139 3.282 1.00 11.04 H new ATOM 0 HG21 VAL A 812 -28.342 49.139 1.369 1.00 32.51 H new ATOM 0 HG22 VAL A 812 -29.646 48.102 1.994 1.00 32.51 H new ATOM 0 HG23 VAL A 812 -29.393 48.253 0.239 1.00 32.51 H new ATOM 1066 N ASN A 813 -32.811 51.320 -0.270 1.00 61.01 N ATOM 1067 CA ASN A 813 -33.671 52.489 -0.417 1.00 64.23 C ATOM 1068 C ASN A 813 -35.138 52.111 -0.240 1.00 21.45 C ATOM 1069 O ASN A 813 -35.925 52.877 0.319 1.00 62.44 O ATOM 1070 CB ASN A 813 -33.461 53.133 -1.789 1.00 61.44 C ATOM 1071 CG ASN A 813 -34.194 54.453 -1.927 1.00 1.05 C ATOM 1072 OD1 ASN A 813 -34.046 55.347 -1.093 1.00 52.23 O ATOM 1073 ND2 ASN A 813 -34.990 54.581 -2.982 1.00 22.11 N ATOM 0 H ASN A 813 -32.328 51.042 -1.124 1.00 61.01 H new ATOM 0 HA ASN A 813 -33.403 53.206 0.359 1.00 64.23 H new ATOM 0 HB2 ASN A 813 -32.395 53.294 -1.953 1.00 61.44 H new ATOM 0 HB3 ASN A 813 -33.803 52.448 -2.565 1.00 61.44 H new ATOM 0 HD21 ASN A 813 -35.509 55.447 -3.127 1.00 22.11 H new ATOM 0 HD22 ASN A 813 -35.082 53.814 -3.648 1.00 22.11 H new ATOM 1080 N LEU A 814 -35.499 50.925 -0.717 1.00 34.20 N ATOM 1081 CA LEU A 814 -36.872 50.443 -0.611 1.00 14.44 C ATOM 1082 C LEU A 814 -37.218 50.097 0.834 1.00 3.43 C ATOM 1083 O LEU A 814 -38.298 50.432 1.323 1.00 4.32 O ATOM 1084 CB LEU A 814 -37.074 49.218 -1.503 1.00 35.51 C ATOM 1085 CG LEU A 814 -38.510 48.945 -1.955 1.00 3.52 C ATOM 1086 CD1 LEU A 814 -38.891 49.866 -3.104 1.00 61.41 C ATOM 1087 CD2 LEU A 814 -38.674 47.488 -2.359 1.00 73.32 C ATOM 0 H LEU A 814 -34.860 50.279 -1.181 1.00 34.20 H new ATOM 0 HA LEU A 814 -37.537 51.240 -0.943 1.00 14.44 H new ATOM 0 HB2 LEU A 814 -36.451 49.333 -2.390 1.00 35.51 H new ATOM 0 HB3 LEU A 814 -36.710 48.341 -0.969 1.00 35.51 H new ATOM 0 HG LEU A 814 -39.179 49.146 -1.118 1.00 3.52 H new ATOM 0 HD11 LEU A 814 -39.915 49.658 -3.413 1.00 61.41 H new ATOM 0 HD12 LEU A 814 -38.813 50.904 -2.780 1.00 61.41 H new ATOM 0 HD13 LEU A 814 -38.218 49.697 -3.944 1.00 61.41 H new ATOM 0 HD21 LEU A 814 -39.701 47.312 -2.678 1.00 73.32 H new ATOM 0 HD22 LEU A 814 -37.995 47.260 -3.181 1.00 73.32 H new ATOM 0 HD23 LEU A 814 -38.443 46.846 -1.509 1.00 73.32 H new ATOM 1099 N LEU A 815 -36.294 49.427 1.514 1.00 44.14 N ATOM 1100 CA LEU A 815 -36.499 49.037 2.904 1.00 3.43 C ATOM 1101 C LEU A 815 -36.641 50.265 3.799 1.00 73.15 C ATOM 1102 O LEU A 815 -37.595 50.377 4.568 1.00 42.14 O ATOM 1103 CB LEU A 815 -35.334 48.172 3.389 1.00 73.30 C ATOM 1104 CG LEU A 815 -35.344 46.714 2.928 1.00 73.05 C ATOM 1105 CD1 LEU A 815 -33.938 46.135 2.958 1.00 35.35 C ATOM 1106 CD2 LEU A 815 -36.283 45.887 3.794 1.00 71.24 C ATOM 0 H LEU A 815 -35.395 49.143 1.125 1.00 44.14 H new ATOM 0 HA LEU A 815 -37.422 48.459 2.961 1.00 3.43 H new ATOM 0 HB2 LEU A 815 -34.403 48.631 3.056 1.00 73.30 H new ATOM 0 HB3 LEU A 815 -35.325 48.188 4.479 1.00 73.30 H new ATOM 0 HG LEU A 815 -35.706 46.680 1.901 1.00 73.05 H new ATOM 0 HD11 LEU A 815 -33.965 45.097 2.627 1.00 35.35 H new ATOM 0 HD12 LEU A 815 -33.293 46.711 2.294 1.00 35.35 H new ATOM 0 HD13 LEU A 815 -33.547 46.182 3.974 1.00 35.35 H new ATOM 0 HD21 LEU A 815 -36.277 44.852 3.451 1.00 71.24 H new ATOM 0 HD22 LEU A 815 -35.951 45.928 4.832 1.00 71.24 H new ATOM 0 HD23 LEU A 815 -37.294 46.288 3.720 1.00 71.24 H new ATOM 1118 N ASN A 816 -35.687 51.184 3.690 1.00 73.13 N ATOM 1119 CA ASN A 816 -35.708 52.405 4.487 1.00 25.44 C ATOM 1120 C ASN A 816 -36.974 53.211 4.215 1.00 5.42 C ATOM 1121 O ASN A 816 -37.755 53.485 5.126 1.00 41.34 O ATOM 1122 CB ASN A 816 -34.472 53.256 4.186 1.00 33.14 C ATOM 1123 CG ASN A 816 -33.233 52.749 4.899 1.00 72.02 C ATOM 1124 OD1 ASN A 816 -32.320 52.211 4.272 1.00 1.35 O ATOM 1125 ND2 ASN A 816 -33.197 52.918 6.215 1.00 1.44 N ATOM 0 H ASN A 816 -34.890 51.106 3.058 1.00 73.13 H new ATOM 0 HA ASN A 816 -35.699 52.123 5.540 1.00 25.44 H new ATOM 0 HB2 ASN A 816 -34.292 53.263 3.111 1.00 33.14 H new ATOM 0 HB3 ASN A 816 -34.663 54.287 4.484 1.00 33.14 H new ATOM 0 HD21 ASN A 816 -32.389 52.596 6.749 1.00 1.44 H new ATOM 0 HD22 ASN A 816 -33.977 53.369 6.693 1.00 1.44 H new ATOM 1132 N ALA A 817 -37.169 53.588 2.956 1.00 51.31 N ATOM 1133 CA ALA A 817 -38.341 54.361 2.563 1.00 61.00 C ATOM 1134 C ALA A 817 -39.621 53.723 3.091 1.00 14.33 C ATOM 1135 O ALA A 817 -40.511 54.413 3.591 1.00 30.01 O ATOM 1136 CB ALA A 817 -38.402 54.495 1.049 1.00 65.44 C ATOM 0 H ALA A 817 -36.531 53.371 2.191 1.00 51.31 H new ATOM 0 HA ALA A 817 -38.253 55.355 3.001 1.00 61.00 H new ATOM 0 HB1 ALA A 817 -39.282 55.074 0.770 1.00 65.44 H new ATOM 0 HB2 ALA A 817 -37.506 55.002 0.692 1.00 65.44 H new ATOM 0 HB3 ALA A 817 -38.462 53.504 0.598 1.00 65.44 H new ATOM 1142 N THR A 818 -39.710 52.402 2.977 1.00 22.33 N ATOM 1143 CA THR A 818 -40.882 51.671 3.442 1.00 53.23 C ATOM 1144 C THR A 818 -41.064 51.823 4.948 1.00 61.04 C ATOM 1145 O THR A 818 -42.183 51.984 5.434 1.00 4.22 O ATOM 1146 CB THR A 818 -40.784 50.173 3.096 1.00 11.33 C ATOM 1147 OG1 THR A 818 -40.823 49.994 1.676 1.00 5.41 O ATOM 1148 CG2 THR A 818 -41.920 49.394 3.742 1.00 63.44 C ATOM 0 H THR A 818 -38.983 51.816 2.566 1.00 22.33 H new ATOM 0 HA THR A 818 -41.744 52.099 2.930 1.00 53.23 H new ATOM 0 HB THR A 818 -39.838 49.794 3.483 1.00 11.33 H new ATOM 0 HG1 THR A 818 -39.918 49.819 1.343 1.00 5.41 H new ATOM 0 HG21 THR A 818 -41.830 48.339 3.484 1.00 63.44 H new ATOM 0 HG22 THR A 818 -41.870 49.508 4.825 1.00 63.44 H new ATOM 0 HG23 THR A 818 -42.875 49.776 3.381 1.00 63.44 H new ATOM 1156 N ALA A 819 -39.957 51.771 5.681 1.00 65.04 N ATOM 1157 CA ALA A 819 -39.994 51.906 7.132 1.00 61.45 C ATOM 1158 C ALA A 819 -40.392 53.319 7.542 1.00 41.44 C ATOM 1159 O ALA A 819 -41.053 53.517 8.562 1.00 63.13 O ATOM 1160 CB ALA A 819 -38.644 51.541 7.730 1.00 23.44 C ATOM 0 H ALA A 819 -39.023 51.636 5.294 1.00 65.04 H new ATOM 0 HA ALA A 819 -40.747 51.219 7.517 1.00 61.45 H new ATOM 0 HB1 ALA A 819 -38.686 51.646 8.814 1.00 23.44 H new ATOM 0 HB2 ALA A 819 -38.400 50.510 7.475 1.00 23.44 H new ATOM 0 HB3 ALA A 819 -37.878 52.205 7.330 1.00 23.44 H new ATOM 1166 N ILE A 820 -39.985 54.299 6.741 1.00 11.15 N ATOM 1167 CA ILE A 820 -40.300 55.694 7.022 1.00 51.30 C ATOM 1168 C ILE A 820 -41.775 55.987 6.766 1.00 4.12 C ATOM 1169 O ILE A 820 -42.387 56.795 7.463 1.00 14.22 O ATOM 1170 CB ILE A 820 -39.443 56.648 6.168 1.00 74.50 C ATOM 1171 CG1 ILE A 820 -37.960 56.467 6.496 1.00 62.44 C ATOM 1172 CG2 ILE A 820 -39.870 58.090 6.396 1.00 44.25 C ATOM 1173 CD1 ILE A 820 -37.628 56.711 7.951 1.00 32.31 C ATOM 0 H ILE A 820 -39.437 54.152 5.893 1.00 11.15 H new ATOM 0 HA ILE A 820 -40.076 55.862 8.075 1.00 51.30 H new ATOM 0 HB ILE A 820 -39.595 56.407 5.116 1.00 74.50 H new ATOM 0 HG12 ILE A 820 -37.658 55.455 6.228 1.00 62.44 H new ATOM 0 HG13 ILE A 820 -37.374 57.148 5.879 1.00 62.44 H new ATOM 0 HG21 ILE A 820 -39.256 58.752 5.786 1.00 44.25 H new ATOM 0 HG22 ILE A 820 -40.917 58.208 6.117 1.00 44.25 H new ATOM 0 HG23 ILE A 820 -39.744 58.345 7.448 1.00 44.25 H new ATOM 0 HD11 ILE A 820 -36.560 56.565 8.110 1.00 32.31 H new ATOM 0 HD12 ILE A 820 -37.898 57.732 8.220 1.00 32.31 H new ATOM 0 HD13 ILE A 820 -38.187 56.012 8.574 1.00 32.31 H new ATOM 1185 N ALA A 821 -42.339 55.323 5.763 1.00 43.03 N ATOM 1186 CA ALA A 821 -43.743 55.509 5.417 1.00 25.11 C ATOM 1187 C ALA A 821 -44.642 54.634 6.284 1.00 2.42 C ATOM 1188 O ALA A 821 -45.811 54.952 6.502 1.00 51.42 O ATOM 1189 CB ALA A 821 -43.968 55.204 3.944 1.00 72.33 C ATOM 0 H ALA A 821 -41.845 54.651 5.175 1.00 43.03 H new ATOM 0 HA ALA A 821 -44.004 56.551 5.605 1.00 25.11 H new ATOM 0 HB1 ALA A 821 -45.021 55.347 3.699 1.00 72.33 H new ATOM 0 HB2 ALA A 821 -43.360 55.875 3.337 1.00 72.33 H new ATOM 0 HB3 ALA A 821 -43.685 54.172 3.739 1.00 72.33 H new ATOM 1195 N VAL A 822 -44.089 53.530 6.777 1.00 50.41 N ATOM 1196 CA VAL A 822 -44.841 52.610 7.621 1.00 73.21 C ATOM 1197 C VAL A 822 -44.782 53.033 9.084 1.00 32.14 C ATOM 1198 O VAL A 822 -45.682 52.727 9.866 1.00 23.34 O ATOM 1199 CB VAL A 822 -44.311 51.170 7.492 1.00 22.44 C ATOM 1200 CG1 VAL A 822 -43.141 50.945 8.438 1.00 32.25 C ATOM 1201 CG2 VAL A 822 -45.423 50.167 7.759 1.00 72.30 C ATOM 0 H VAL A 822 -43.123 53.251 6.606 1.00 50.41 H new ATOM 0 HA VAL A 822 -45.876 52.640 7.279 1.00 73.21 H new ATOM 0 HB VAL A 822 -43.957 51.022 6.472 1.00 22.44 H new ATOM 0 HG11 VAL A 822 -42.780 49.922 8.333 1.00 32.25 H new ATOM 0 HG12 VAL A 822 -42.338 51.640 8.195 1.00 32.25 H new ATOM 0 HG13 VAL A 822 -43.466 51.111 9.465 1.00 32.25 H new ATOM 0 HG21 VAL A 822 -45.030 49.155 7.663 1.00 72.30 H new ATOM 0 HG22 VAL A 822 -45.810 50.313 8.768 1.00 72.30 H new ATOM 0 HG23 VAL A 822 -46.227 50.314 7.037 1.00 72.30 H new ATOM 1211 N ALA A 823 -43.717 53.739 9.448 1.00 43.22 N ATOM 1212 CA ALA A 823 -43.541 54.207 10.817 1.00 31.01 C ATOM 1213 C ALA A 823 -44.380 55.452 11.084 1.00 52.02 C ATOM 1214 O ALA A 823 -44.742 55.734 12.226 1.00 42.45 O ATOM 1215 CB ALA A 823 -42.072 54.489 11.094 1.00 2.11 C ATOM 0 H ALA A 823 -42.962 54.000 8.813 1.00 43.22 H new ATOM 0 HA ALA A 823 -43.882 53.420 11.490 1.00 31.01 H new ATOM 0 HB1 ALA A 823 -41.956 54.838 12.120 1.00 2.11 H new ATOM 0 HB2 ALA A 823 -41.493 53.576 10.953 1.00 2.11 H new ATOM 0 HB3 ALA A 823 -41.713 55.256 10.407 1.00 2.11 H new ATOM 1243 N THR A 826 -49.916 55.740 11.813 1.00 43.03 N ATOM 1244 CA THR A 826 -50.830 56.394 12.740 1.00 33.10 C ATOM 1245 C THR A 826 -50.339 57.790 13.104 1.00 53.54 C ATOM 1246 O THR A 826 -51.103 58.617 13.602 1.00 14.22 O ATOM 1247 CB THR A 826 -51.005 55.571 14.031 1.00 40.34 C ATOM 1248 OG1 THR A 826 -51.005 54.173 13.724 1.00 73.42 O ATOM 1249 CG2 THR A 826 -52.301 55.941 14.737 1.00 44.12 C ATOM 0 HA THR A 826 -51.792 56.471 12.233 1.00 33.10 H new ATOM 0 HB THR A 826 -50.171 55.796 14.696 1.00 40.34 H new ATOM 0 HG1 THR A 826 -50.486 54.017 12.908 1.00 73.42 H new ATOM 0 HG21 THR A 826 -52.403 55.347 15.645 1.00 44.12 H new ATOM 0 HG22 THR A 826 -52.285 57.000 14.995 1.00 44.12 H new ATOM 0 HG23 THR A 826 -53.145 55.741 14.077 1.00 44.12 H new ATOM 1257 N ASP A 827 -49.061 58.047 12.851 1.00 42.44 N ATOM 1258 CA ASP A 827 -48.468 59.346 13.150 1.00 71.21 C ATOM 1259 C ASP A 827 -49.301 60.475 12.550 1.00 23.51 C ATOM 1260 O ASP A 827 -49.430 61.546 13.142 1.00 1.14 O ATOM 1261 CB ASP A 827 -47.036 59.412 12.616 1.00 54.12 C ATOM 1262 CG ASP A 827 -46.053 58.676 13.504 1.00 64.34 C ATOM 1263 OD1 ASP A 827 -46.375 57.551 13.940 1.00 43.00 O ATOM 1264 OD2 ASP A 827 -44.961 59.224 13.763 1.00 41.42 O ATOM 0 H ASP A 827 -48.415 57.373 12.440 1.00 42.44 H new ATOM 0 HA ASP A 827 -48.449 59.469 14.233 1.00 71.21 H new ATOM 0 HB2 ASP A 827 -47.005 58.986 11.613 1.00 54.12 H new ATOM 0 HB3 ASP A 827 -46.732 60.455 12.528 1.00 54.12 H new ATOM 1269 N ARG A 828 -49.862 60.227 11.371 1.00 34.34 N ATOM 1270 CA ARG A 828 -50.681 61.223 10.690 1.00 24.24 C ATOM 1271 C ARG A 828 -51.934 61.542 11.500 1.00 40.52 C ATOM 1272 O ARG A 828 -52.164 62.690 11.880 1.00 11.53 O ATOM 1273 CB ARG A 828 -51.073 60.726 9.298 1.00 42.03 C ATOM 1274 CG ARG A 828 -49.886 60.319 8.440 1.00 51.35 C ATOM 1275 CD ARG A 828 -50.320 59.471 7.255 1.00 72.33 C ATOM 1276 NE ARG A 828 -49.235 59.269 6.299 1.00 65.10 N ATOM 1277 CZ ARG A 828 -48.759 60.229 5.513 1.00 33.31 C ATOM 1278 NH1 ARG A 828 -49.271 61.450 5.570 1.00 53.45 N ATOM 1279 NH2 ARG A 828 -47.769 59.967 4.669 1.00 55.40 N ATOM 0 H ARG A 828 -49.764 59.345 10.868 1.00 34.34 H new ATOM 0 HA ARG A 828 -50.092 62.135 10.590 1.00 24.24 H new ATOM 0 HB2 ARG A 828 -51.745 59.874 9.402 1.00 42.03 H new ATOM 0 HB3 ARG A 828 -51.630 61.510 8.785 1.00 42.03 H new ATOM 0 HG2 ARG A 828 -49.372 61.211 8.082 1.00 51.35 H new ATOM 0 HG3 ARG A 828 -49.172 59.761 9.046 1.00 51.35 H new ATOM 0 HD2 ARG A 828 -50.673 58.504 7.612 1.00 72.33 H new ATOM 0 HD3 ARG A 828 -51.160 59.952 6.754 1.00 72.33 H new ATOM 0 HE ARG A 828 -48.820 58.340 6.231 1.00 65.10 H new ATOM 0 HH11 ARG A 828 -50.032 61.654 6.218 1.00 53.45 H new ATOM 0 HH12 ARG A 828 -48.904 62.186 4.966 1.00 53.45 H new ATOM 0 HH21 ARG A 828 -47.373 59.028 4.623 1.00 55.40 H new ATOM 0 HH22 ARG A 828 -47.404 60.704 4.066 1.00 55.40 H new ATOM 1293 N VAL A 829 -52.742 60.519 11.759 1.00 2.11 N ATOM 1294 CA VAL A 829 -53.971 60.690 12.523 1.00 15.45 C ATOM 1295 C VAL A 829 -53.696 61.362 13.864 1.00 12.30 C ATOM 1296 O VAL A 829 -54.449 62.234 14.299 1.00 51.32 O ATOM 1297 CB VAL A 829 -54.670 59.341 12.772 1.00 34.41 C ATOM 1298 CG1 VAL A 829 -55.927 59.535 13.607 1.00 1.50 C ATOM 1299 CG2 VAL A 829 -54.998 58.660 11.452 1.00 61.51 C ATOM 0 H VAL A 829 -52.567 59.563 11.451 1.00 2.11 H new ATOM 0 HA VAL A 829 -54.627 61.326 11.928 1.00 15.45 H new ATOM 0 HB VAL A 829 -53.989 58.697 13.329 1.00 34.41 H new ATOM 0 HG11 VAL A 829 -56.407 58.570 13.772 1.00 1.50 H new ATOM 0 HG12 VAL A 829 -55.661 59.977 14.567 1.00 1.50 H new ATOM 0 HG13 VAL A 829 -56.615 60.197 13.081 1.00 1.50 H new ATOM 0 HG21 VAL A 829 -55.492 57.708 11.647 1.00 61.51 H new ATOM 0 HG22 VAL A 829 -55.660 59.299 10.867 1.00 61.51 H new ATOM 0 HG23 VAL A 829 -54.078 58.484 10.895 1.00 61.51 H new ATOM 1309 N ILE A 830 -52.613 60.951 14.514 1.00 2.11 N ATOM 1310 CA ILE A 830 -52.237 61.515 15.805 1.00 72.32 C ATOM 1311 C ILE A 830 -51.795 62.967 15.663 1.00 43.02 C ATOM 1312 O ILE A 830 -52.039 63.789 16.545 1.00 3.12 O ATOM 1313 CB ILE A 830 -51.104 60.707 16.464 1.00 64.54 C ATOM 1314 CG1 ILE A 830 -51.546 59.260 16.692 1.00 24.42 C ATOM 1315 CG2 ILE A 830 -50.686 61.352 17.776 1.00 15.44 C ATOM 1316 CD1 ILE A 830 -52.684 59.124 17.679 1.00 2.33 C ATOM 0 H ILE A 830 -51.980 60.230 14.168 1.00 2.11 H new ATOM 0 HA ILE A 830 -53.122 61.468 16.440 1.00 72.32 H new ATOM 0 HB ILE A 830 -50.244 60.703 15.794 1.00 64.54 H new ATOM 0 HG12 ILE A 830 -51.849 58.827 15.739 1.00 24.42 H new ATOM 0 HG13 ILE A 830 -50.695 58.681 17.049 1.00 24.42 H new ATOM 0 HG21 ILE A 830 -49.884 60.769 18.229 1.00 15.44 H new ATOM 0 HG22 ILE A 830 -50.335 62.366 17.587 1.00 15.44 H new ATOM 0 HG23 ILE A 830 -51.539 61.384 18.454 1.00 15.44 H new ATOM 0 HD11 ILE A 830 -52.945 58.072 17.791 1.00 2.33 H new ATOM 0 HD12 ILE A 830 -52.378 59.527 18.645 1.00 2.33 H new ATOM 0 HD13 ILE A 830 -53.550 59.675 17.314 1.00 2.33 H new ATOM 1328 N GLU A 831 -51.144 63.275 14.545 1.00 13.20 N ATOM 1329 CA GLU A 831 -50.669 64.629 14.287 1.00 1.44 C ATOM 1330 C GLU A 831 -51.839 65.583 14.061 1.00 24.05 C ATOM 1331 O GLU A 831 -51.890 66.668 14.640 1.00 11.33 O ATOM 1332 CB GLU A 831 -49.741 64.645 13.070 1.00 14.25 C ATOM 1333 CG GLU A 831 -49.140 66.010 12.781 1.00 1.33 C ATOM 1334 CD GLU A 831 -47.998 66.355 13.718 1.00 72.12 C ATOM 1335 OE1 GLU A 831 -47.674 67.555 13.840 1.00 20.24 O ATOM 1336 OE2 GLU A 831 -47.429 65.426 14.327 1.00 20.34 O ATOM 0 H GLU A 831 -50.934 62.606 13.805 1.00 13.20 H new ATOM 0 HA GLU A 831 -50.114 64.964 15.163 1.00 1.44 H new ATOM 0 HB2 GLU A 831 -48.935 63.929 13.229 1.00 14.25 H new ATOM 0 HB3 GLU A 831 -50.298 64.310 12.195 1.00 14.25 H new ATOM 0 HG2 GLU A 831 -48.781 66.034 11.752 1.00 1.33 H new ATOM 0 HG3 GLU A 831 -49.917 66.770 12.866 1.00 1.33 H new ATOM 1343 N VAL A 832 -52.776 65.170 13.215 1.00 75.40 N ATOM 1344 CA VAL A 832 -53.946 65.986 12.912 1.00 32.40 C ATOM 1345 C VAL A 832 -54.850 66.124 14.132 1.00 52.43 C ATOM 1346 O VAL A 832 -55.415 67.190 14.382 1.00 51.14 O ATOM 1347 CB VAL A 832 -54.760 65.389 11.748 1.00 14.25 C ATOM 1348 CG1 VAL A 832 -55.181 63.963 12.067 1.00 71.41 C ATOM 1349 CG2 VAL A 832 -55.973 66.257 11.448 1.00 72.13 C ATOM 0 H VAL A 832 -52.748 64.275 12.727 1.00 75.40 H new ATOM 0 HA VAL A 832 -53.579 66.971 12.622 1.00 32.40 H new ATOM 0 HB VAL A 832 -54.129 65.366 10.860 1.00 14.25 H new ATOM 0 HG11 VAL A 832 -55.755 63.558 11.233 1.00 71.41 H new ATOM 0 HG12 VAL A 832 -54.295 63.350 12.229 1.00 71.41 H new ATOM 0 HG13 VAL A 832 -55.796 63.958 12.967 1.00 71.41 H new ATOM 0 HG21 VAL A 832 -56.537 65.821 10.623 1.00 72.13 H new ATOM 0 HG22 VAL A 832 -56.608 66.313 12.332 1.00 72.13 H new ATOM 0 HG23 VAL A 832 -55.644 67.259 11.173 1.00 72.13 H new ATOM 1359 N LEU A 833 -54.983 65.041 14.889 1.00 1.11 N ATOM 1360 CA LEU A 833 -55.818 65.041 16.085 1.00 55.30 C ATOM 1361 C LEU A 833 -55.222 65.937 17.166 1.00 51.21 C ATOM 1362 O LEU A 833 -55.942 66.668 17.846 1.00 40.14 O ATOM 1363 CB LEU A 833 -55.980 63.617 16.619 1.00 65.23 C ATOM 1364 CG LEU A 833 -57.198 63.367 17.508 1.00 10.11 C ATOM 1365 CD1 LEU A 833 -58.480 63.704 16.764 1.00 55.35 C ATOM 1366 CD2 LEU A 833 -57.221 61.923 17.987 1.00 14.05 C ATOM 0 H LEU A 833 -54.523 64.151 14.696 1.00 1.11 H new ATOM 0 HA LEU A 833 -56.798 65.434 15.813 1.00 55.30 H new ATOM 0 HB2 LEU A 833 -56.029 62.936 15.770 1.00 65.23 H new ATOM 0 HB3 LEU A 833 -55.084 63.358 17.184 1.00 65.23 H new ATOM 0 HG LEU A 833 -57.127 64.017 18.380 1.00 10.11 H new ATOM 0 HD11 LEU A 833 -59.336 63.520 17.413 1.00 55.35 H new ATOM 0 HD12 LEU A 833 -58.466 64.754 16.471 1.00 55.35 H new ATOM 0 HD13 LEU A 833 -58.559 63.080 15.874 1.00 55.35 H new ATOM 0 HD21 LEU A 833 -58.095 61.763 18.619 1.00 14.05 H new ATOM 0 HD22 LEU A 833 -57.268 61.255 17.127 1.00 14.05 H new ATOM 0 HD23 LEU A 833 -56.317 61.715 18.559 1.00 14.05 H new ATOM 1378 N GLN A 834 -53.903 65.876 17.317 1.00 70.13 N ATOM 1379 CA GLN A 834 -53.210 66.683 18.314 1.00 14.10 C ATOM 1380 C GLN A 834 -53.318 68.168 17.983 1.00 63.14 C ATOM 1381 O GLN A 834 -53.736 68.971 18.816 1.00 44.20 O ATOM 1382 CB GLN A 834 -51.739 66.273 18.401 1.00 73.22 C ATOM 1383 CG GLN A 834 -51.447 65.290 19.523 1.00 10.12 C ATOM 1384 CD GLN A 834 -52.570 64.293 19.733 1.00 4.10 C ATOM 1385 OE1 GLN A 834 -52.676 63.300 19.013 1.00 70.10 O ATOM 1386 NE2 GLN A 834 -53.415 64.553 20.724 1.00 60.15 N ATOM 0 H GLN A 834 -53.293 65.276 16.762 1.00 70.13 H new ATOM 0 HA GLN A 834 -53.685 66.509 19.279 1.00 14.10 H new ATOM 0 HB2 GLN A 834 -51.438 65.829 17.452 1.00 73.22 H new ATOM 0 HB3 GLN A 834 -51.129 67.165 18.543 1.00 73.22 H new ATOM 0 HG2 GLN A 834 -50.526 64.752 19.299 1.00 10.12 H new ATOM 0 HG3 GLN A 834 -51.277 65.841 20.448 1.00 10.12 H new ATOM 0 HE21 GLN A 834 -53.289 65.388 21.296 1.00 60.15 H new ATOM 0 HE22 GLN A 834 -54.190 63.917 20.913 1.00 60.15 H new ATOM 1395 N ALA A 835 -52.937 68.525 16.761 1.00 50.45 N ATOM 1396 CA ALA A 835 -52.992 69.913 16.319 1.00 51.34 C ATOM 1397 C ALA A 835 -54.412 70.462 16.407 1.00 73.43 C ATOM 1398 O ALA A 835 -54.641 71.530 16.973 1.00 33.44 O ATOM 1399 CB ALA A 835 -52.464 70.036 14.897 1.00 72.11 C ATOM 0 H ALA A 835 -52.587 67.872 16.060 1.00 50.45 H new ATOM 0 HA ALA A 835 -52.360 70.504 16.982 1.00 51.34 H new ATOM 0 HB1 ALA A 835 -52.511 71.078 14.580 1.00 72.11 H new ATOM 0 HB2 ALA A 835 -51.430 69.692 14.862 1.00 72.11 H new ATOM 0 HB3 ALA A 835 -53.072 69.426 14.229 1.00 72.11 H new ATOM 1405 N ALA A 836 -55.363 69.724 15.842 1.00 65.21 N ATOM 1406 CA ALA A 836 -56.761 70.136 15.858 1.00 24.12 C ATOM 1407 C ALA A 836 -57.246 70.373 17.284 1.00 15.00 C ATOM 1408 O ALA A 836 -57.676 71.474 17.629 1.00 42.32 O ATOM 1409 CB ALA A 836 -57.627 69.091 15.170 1.00 2.22 C ATOM 0 H ALA A 836 -55.190 68.838 15.368 1.00 65.21 H new ATOM 0 HA ALA A 836 -56.844 71.076 15.313 1.00 24.12 H new ATOM 0 HB1 ALA A 836 -58.669 69.412 15.189 1.00 2.22 H new ATOM 0 HB2 ALA A 836 -57.303 68.973 14.136 1.00 2.22 H new ATOM 0 HB3 ALA A 836 -57.531 68.138 15.691 1.00 2.22 H new ATOM 1415 N TYR A 837 -57.177 69.334 18.108 1.00 23.33 N ATOM 1416 CA TYR A 837 -57.613 69.428 19.496 1.00 4.44 C ATOM 1417 C TYR A 837 -56.873 70.547 20.225 1.00 71.34 C ATOM 1418 O TYR A 837 -57.462 71.282 21.017 1.00 0.10 O ATOM 1419 CB TYR A 837 -57.385 68.098 20.216 1.00 0.23 C ATOM 1420 CG TYR A 837 -57.879 68.091 21.645 1.00 31.33 C ATOM 1421 CD1 TYR A 837 -57.134 67.494 22.655 1.00 12.33 C ATOM 1422 CD2 TYR A 837 -59.091 68.679 21.985 1.00 20.14 C ATOM 1423 CE1 TYR A 837 -57.582 67.484 23.962 1.00 2.33 C ATOM 1424 CE2 TYR A 837 -59.546 68.675 23.290 1.00 63.03 C ATOM 1425 CZ TYR A 837 -58.788 68.076 24.274 1.00 2.45 C ATOM 1426 OH TYR A 837 -59.238 68.069 25.575 1.00 50.12 O ATOM 0 H TYR A 837 -56.823 68.416 17.839 1.00 23.33 H new ATOM 0 HA TYR A 837 -58.678 69.658 19.500 1.00 4.44 H new ATOM 0 HB2 TYR A 837 -57.887 67.304 19.663 1.00 0.23 H new ATOM 0 HB3 TYR A 837 -56.320 67.868 20.207 1.00 0.23 H new ATOM 0 HD1 TYR A 837 -56.189 67.030 22.414 1.00 12.33 H new ATOM 0 HD2 TYR A 837 -59.688 69.147 21.216 1.00 20.14 H new ATOM 0 HE1 TYR A 837 -56.991 67.015 24.735 1.00 2.33 H new ATOM 0 HE2 TYR A 837 -60.490 69.138 23.538 1.00 63.03 H new ATOM 0 HH TYR A 837 -60.102 68.528 25.625 1.00 50.12 H new ATOM 1436 N ARG A 838 -55.579 70.668 19.949 1.00 43.51 N ATOM 1437 CA ARG A 838 -54.757 71.696 20.577 1.00 12.02 C ATOM 1438 C ARG A 838 -55.344 73.084 20.336 1.00 64.13 C ATOM 1439 O ARG A 838 -55.526 73.863 21.271 1.00 63.12 O ATOM 1440 CB ARG A 838 -53.326 71.635 20.039 1.00 34.55 C ATOM 1441 CG ARG A 838 -52.395 70.780 20.883 1.00 3.14 C ATOM 1442 CD ARG A 838 -50.987 71.355 20.915 1.00 13.01 C ATOM 1443 NE ARG A 838 -50.751 72.157 22.112 1.00 4.14 N ATOM 1444 CZ ARG A 838 -49.639 72.853 22.323 1.00 62.11 C ATOM 1445 NH1 ARG A 838 -48.667 72.845 21.421 1.00 51.12 N ATOM 1446 NH2 ARG A 838 -49.497 73.559 23.438 1.00 74.25 N ATOM 0 H ARG A 838 -55.077 70.067 19.295 1.00 43.51 H new ATOM 0 HA ARG A 838 -54.742 71.508 21.651 1.00 12.02 H new ATOM 0 HB2 ARG A 838 -53.345 71.242 19.023 1.00 34.55 H new ATOM 0 HB3 ARG A 838 -52.925 72.647 19.982 1.00 34.55 H new ATOM 0 HG2 ARG A 838 -52.784 70.710 21.899 1.00 3.14 H new ATOM 0 HG3 ARG A 838 -52.366 69.767 20.482 1.00 3.14 H new ATOM 0 HD2 ARG A 838 -50.262 70.542 20.875 1.00 13.01 H new ATOM 0 HD3 ARG A 838 -50.826 71.970 20.029 1.00 13.01 H new ATOM 0 HE ARG A 838 -51.480 72.185 22.825 1.00 4.14 H new ATOM 0 HH11 ARG A 838 -48.772 72.304 20.563 1.00 51.12 H new ATOM 0 HH12 ARG A 838 -47.814 73.380 21.585 1.00 51.12 H new ATOM 0 HH21 ARG A 838 -50.242 73.568 24.134 1.00 74.25 H new ATOM 0 HH22 ARG A 838 -48.643 74.093 23.598 1.00 74.25 H new ATOM 1460 N ALA A 839 -55.636 73.386 19.075 1.00 34.30 N ATOM 1461 CA ALA A 839 -56.203 74.678 18.711 1.00 52.32 C ATOM 1462 C ALA A 839 -57.589 74.861 19.320 1.00 1.54 C ATOM 1463 O ALA A 839 -57.934 75.948 19.786 1.00 45.10 O ATOM 1464 CB ALA A 839 -56.268 74.819 17.197 1.00 24.32 C ATOM 0 H ALA A 839 -55.489 72.753 18.289 1.00 34.30 H new ATOM 0 HA ALA A 839 -55.553 75.457 19.110 1.00 52.32 H new ATOM 0 HB1 ALA A 839 -56.694 75.789 16.940 1.00 24.32 H new ATOM 0 HB2 ALA A 839 -55.264 74.742 16.781 1.00 24.32 H new ATOM 0 HB3 ALA A 839 -56.893 74.027 16.784 1.00 24.32 H new ATOM 1470 N ILE A 840 -58.379 73.793 19.314 1.00 51.34 N ATOM 1471 CA ILE A 840 -59.727 73.837 19.866 1.00 10.35 C ATOM 1472 C ILE A 840 -59.703 74.211 21.345 1.00 40.34 C ATOM 1473 O ILE A 840 -60.551 74.968 21.818 1.00 43.44 O ATOM 1474 CB ILE A 840 -60.447 72.486 19.702 1.00 33.00 C ATOM 1475 CG1 ILE A 840 -60.560 72.120 18.221 1.00 42.24 C ATOM 1476 CG2 ILE A 840 -61.825 72.538 20.346 1.00 5.04 C ATOM 1477 CD1 ILE A 840 -60.585 70.629 17.967 1.00 44.24 C ATOM 0 H ILE A 840 -58.109 72.886 18.933 1.00 51.34 H new ATOM 0 HA ILE A 840 -60.271 74.599 19.309 1.00 10.35 H new ATOM 0 HB ILE A 840 -59.861 71.716 20.204 1.00 33.00 H new ATOM 0 HG12 ILE A 840 -61.468 72.565 17.813 1.00 42.24 H new ATOM 0 HG13 ILE A 840 -59.720 72.558 17.682 1.00 42.24 H new ATOM 0 HG21 ILE A 840 -62.321 71.576 20.222 1.00 5.04 H new ATOM 0 HG22 ILE A 840 -61.722 72.759 21.408 1.00 5.04 H new ATOM 0 HG23 ILE A 840 -62.420 73.317 19.870 1.00 5.04 H new ATOM 0 HD11 ILE A 840 -60.666 70.444 16.896 1.00 44.24 H new ATOM 0 HD12 ILE A 840 -59.666 70.180 18.344 1.00 44.24 H new ATOM 0 HD13 ILE A 840 -61.441 70.187 18.478 1.00 44.24 H new ATOM 1489 N ARG A 841 -58.725 73.677 22.069 1.00 71.13 N ATOM 1490 CA ARG A 841 -58.590 73.955 23.493 1.00 22.14 C ATOM 1491 C ARG A 841 -57.848 75.268 23.723 1.00 42.40 C ATOM 1492 O ARG A 841 -58.023 75.921 24.752 1.00 14.14 O ATOM 1493 CB ARG A 841 -57.851 72.811 24.190 1.00 22.11 C ATOM 1494 CG ARG A 841 -56.396 72.681 23.770 1.00 21.52 C ATOM 1495 CD ARG A 841 -55.627 71.760 24.704 1.00 22.35 C ATOM 1496 NE ARG A 841 -55.204 72.445 25.923 1.00 40.02 N ATOM 1497 CZ ARG A 841 -54.594 71.837 26.934 1.00 34.13 C ATOM 1498 NH1 ARG A 841 -54.337 70.538 26.873 1.00 33.42 N ATOM 1499 NH2 ARG A 841 -54.240 72.529 28.010 1.00 72.22 N ATOM 0 H ARG A 841 -58.015 73.049 21.692 1.00 71.13 H new ATOM 0 HA ARG A 841 -59.591 74.044 23.916 1.00 22.14 H new ATOM 0 HB2 ARG A 841 -57.897 72.964 25.268 1.00 22.11 H new ATOM 0 HB3 ARG A 841 -58.367 71.874 23.978 1.00 22.11 H new ATOM 0 HG2 ARG A 841 -56.343 72.295 22.752 1.00 21.52 H new ATOM 0 HG3 ARG A 841 -55.929 73.666 23.762 1.00 21.52 H new ATOM 0 HD2 ARG A 841 -56.252 70.906 24.966 1.00 22.35 H new ATOM 0 HD3 ARG A 841 -54.752 71.368 24.186 1.00 22.35 H new ATOM 0 HE ARG A 841 -55.387 73.445 26.002 1.00 40.02 H new ATOM 0 HH11 ARG A 841 -54.608 70.003 26.048 1.00 33.42 H new ATOM 0 HH12 ARG A 841 -53.868 70.074 27.651 1.00 33.42 H new ATOM 0 HH21 ARG A 841 -54.436 73.529 28.061 1.00 72.22 H new ATOM 0 HH22 ARG A 841 -53.772 72.061 28.786 1.00 72.22 H new ATOM 1513 N HIS A 842 -57.018 75.650 22.757 1.00 23.23 N ATOM 1514 CA HIS A 842 -56.249 76.886 22.854 1.00 62.50 C ATOM 1515 C HIS A 842 -57.148 78.102 22.653 1.00 64.24 C ATOM 1516 O HIS A 842 -56.910 79.163 23.230 1.00 11.21 O ATOM 1517 CB HIS A 842 -55.122 76.892 21.820 1.00 14.31 C ATOM 1518 CG HIS A 842 -53.884 76.186 22.279 1.00 70.22 C ATOM 1519 ND1 HIS A 842 -53.863 75.328 23.358 1.00 72.30 N ATOM 1520 CD2 HIS A 842 -52.619 76.213 21.797 1.00 75.31 C ATOM 1521 CE1 HIS A 842 -52.639 74.859 23.521 1.00 20.31 C ATOM 1522 NE2 HIS A 842 -51.865 75.380 22.586 1.00 31.12 N ATOM 0 H HIS A 842 -56.861 75.122 21.899 1.00 23.23 H new ATOM 0 HA HIS A 842 -55.815 76.939 23.853 1.00 62.50 H new ATOM 0 HB2 HIS A 842 -55.479 76.423 20.903 1.00 14.31 H new ATOM 0 HB3 HIS A 842 -54.872 77.924 21.574 1.00 14.31 H new ATOM 0 HD2 HIS A 842 -52.268 76.784 20.950 1.00 75.31 H new ATOM 0 HE1 HIS A 842 -52.325 74.167 24.288 1.00 20.31 H new ATOM 0 HE2 HIS A 842 -50.869 75.194 22.469 1.00 31.12 H new ATOM 1630 N ARG A 848 -69.698 80.899 19.691 1.00 22.00 N ATOM 1631 CA ARG A 848 -70.686 81.951 19.895 1.00 41.30 C ATOM 1632 C ARG A 848 -70.966 82.694 18.592 1.00 74.33 C ATOM 1633 O ARG A 848 -72.088 82.676 18.086 1.00 71.22 O ATOM 1634 CB ARG A 848 -70.201 82.936 20.961 1.00 73.30 C ATOM 1635 CG ARG A 848 -69.865 82.278 22.289 1.00 13.15 C ATOM 1636 CD ARG A 848 -71.121 81.942 23.078 1.00 13.02 C ATOM 1637 NE ARG A 848 -71.772 80.732 22.582 1.00 5.03 N ATOM 1638 CZ ARG A 848 -72.885 80.230 23.104 1.00 31.30 C ATOM 1639 NH1 ARG A 848 -73.469 80.830 24.132 1.00 53.24 N ATOM 1640 NH2 ARG A 848 -73.417 79.125 22.597 1.00 22.44 N ATOM 0 HA ARG A 848 -71.611 81.485 20.234 1.00 41.30 H new ATOM 0 HB2 ARG A 848 -69.318 83.456 20.589 1.00 73.30 H new ATOM 0 HB3 ARG A 848 -70.970 83.691 21.123 1.00 73.30 H new ATOM 0 HG2 ARG A 848 -69.292 81.368 22.111 1.00 13.15 H new ATOM 0 HG3 ARG A 848 -69.232 82.944 22.876 1.00 13.15 H new ATOM 0 HD2 ARG A 848 -70.864 81.811 24.129 1.00 13.02 H new ATOM 0 HD3 ARG A 848 -71.819 82.778 23.022 1.00 13.02 H new ATOM 0 HE ARG A 848 -71.348 80.246 21.791 1.00 5.03 H new ATOM 0 HH11 ARG A 848 -73.063 81.680 24.524 1.00 53.24 H new ATOM 0 HH12 ARG A 848 -74.324 80.442 24.531 1.00 53.24 H new ATOM 0 HH21 ARG A 848 -72.971 78.661 21.806 1.00 22.44 H new ATOM 0 HH22 ARG A 848 -74.272 78.740 22.998 1.00 22.44 H new ATOM 1654 N GLN A 849 -69.940 83.345 18.055 1.00 3.31 N ATOM 1655 CA GLN A 849 -70.077 84.095 16.812 1.00 62.42 C ATOM 1656 C GLN A 849 -70.587 83.198 15.689 1.00 35.40 C ATOM 1657 O GLN A 849 -71.436 83.602 14.895 1.00 31.33 O ATOM 1658 CB GLN A 849 -68.736 84.715 16.415 1.00 11.11 C ATOM 1659 CG GLN A 849 -68.818 85.605 15.185 1.00 24.04 C ATOM 1660 CD GLN A 849 -67.726 86.656 15.152 1.00 24.11 C ATOM 1661 OE1 GLN A 849 -67.911 87.775 15.630 1.00 4.44 O ATOM 1662 NE2 GLN A 849 -66.578 86.300 14.586 1.00 55.34 N ATOM 0 H GLN A 849 -69.005 83.368 18.461 1.00 3.31 H new ATOM 0 HA GLN A 849 -70.803 84.891 16.976 1.00 62.42 H new ATOM 0 HB2 GLN A 849 -68.354 85.300 17.252 1.00 11.11 H new ATOM 0 HB3 GLN A 849 -68.017 83.917 16.229 1.00 11.11 H new ATOM 0 HG2 GLN A 849 -68.750 84.988 14.289 1.00 24.04 H new ATOM 0 HG3 GLN A 849 -69.791 86.096 15.161 1.00 24.04 H new ATOM 0 HE21 GLN A 849 -66.468 85.361 14.202 1.00 55.34 H new ATOM 0 HE22 GLN A 849 -65.807 86.965 14.535 1.00 55.34 H new ATOM 1671 N GLY A 850 -70.064 81.977 15.629 1.00 63.14 N ATOM 1672 CA GLY A 850 -70.478 81.042 14.599 1.00 33.11 C ATOM 1673 C GLY A 850 -71.929 80.628 14.742 1.00 33.44 C ATOM 1674 O GLY A 850 -72.694 80.672 13.778 1.00 63.35 O ATOM 0 H GLY A 850 -69.361 81.619 16.275 1.00 63.14 H new ATOM 0 HA2 GLY A 850 -70.327 81.495 13.619 1.00 33.11 H new ATOM 0 HA3 GLY A 850 -69.845 80.156 14.641 1.00 33.11 H new ATOM 1678 N LEU A 851 -72.311 80.222 15.949 1.00 44.24 N ATOM 1679 CA LEU A 851 -73.680 79.796 16.215 1.00 11.11 C ATOM 1680 C LEU A 851 -74.672 80.900 15.862 1.00 32.24 C ATOM 1681 O LEU A 851 -75.704 80.645 15.242 1.00 63.50 O ATOM 1682 CB LEU A 851 -73.836 79.405 17.686 1.00 75.03 C ATOM 1683 CG LEU A 851 -75.181 78.791 18.078 1.00 61.14 C ATOM 1684 CD1 LEU A 851 -75.250 77.336 17.641 1.00 34.43 C ATOM 1685 CD2 LEU A 851 -75.405 78.911 19.578 1.00 50.11 C ATOM 0 H LEU A 851 -71.691 80.179 16.758 1.00 44.24 H new ATOM 0 HA LEU A 851 -73.893 78.929 15.590 1.00 11.11 H new ATOM 0 HB2 LEU A 851 -73.048 78.695 17.938 1.00 75.03 H new ATOM 0 HB3 LEU A 851 -73.673 80.293 18.297 1.00 75.03 H new ATOM 0 HG LEU A 851 -75.973 79.340 17.568 1.00 61.14 H new ATOM 0 HD11 LEU A 851 -76.214 76.915 17.928 1.00 34.43 H new ATOM 0 HD12 LEU A 851 -75.135 77.275 16.559 1.00 34.43 H new ATOM 0 HD13 LEU A 851 -74.450 76.773 18.123 1.00 34.43 H new ATOM 0 HD21 LEU A 851 -76.367 78.469 19.839 1.00 50.11 H new ATOM 0 HD22 LEU A 851 -74.609 78.387 20.108 1.00 50.11 H new ATOM 0 HD23 LEU A 851 -75.400 79.963 19.864 1.00 50.11 H new ATOM 1697 N GLU A 852 -74.351 82.127 16.261 1.00 61.34 N ATOM 1698 CA GLU A 852 -75.214 83.269 15.985 1.00 50.22 C ATOM 1699 C GLU A 852 -75.142 83.663 14.512 1.00 22.41 C ATOM 1700 O GLU A 852 -76.103 84.189 13.952 1.00 51.34 O ATOM 1701 CB GLU A 852 -74.819 84.459 16.862 1.00 65.02 C ATOM 1702 CG GLU A 852 -73.491 85.087 16.473 1.00 42.12 C ATOM 1703 CD GLU A 852 -73.191 86.350 17.257 1.00 24.42 C ATOM 1704 OE1 GLU A 852 -72.722 87.331 16.643 1.00 13.43 O ATOM 1705 OE2 GLU A 852 -73.424 86.356 18.484 1.00 45.21 O ATOM 0 H GLU A 852 -73.501 82.355 16.776 1.00 61.34 H new ATOM 0 HA GLU A 852 -76.239 82.981 16.216 1.00 50.22 H new ATOM 0 HB2 GLU A 852 -75.600 85.217 16.805 1.00 65.02 H new ATOM 0 HB3 GLU A 852 -74.767 84.133 17.901 1.00 65.02 H new ATOM 0 HG2 GLU A 852 -72.691 84.365 16.635 1.00 42.12 H new ATOM 0 HG3 GLU A 852 -73.501 85.319 15.408 1.00 42.12 H new ATOM 1712 N ARG A 853 -73.995 83.403 13.892 1.00 13.31 N ATOM 1713 CA ARG A 853 -73.796 83.732 12.486 1.00 71.54 C ATOM 1714 C ARG A 853 -74.595 82.790 11.589 1.00 14.22 C ATOM 1715 O ARG A 853 -75.221 83.222 10.620 1.00 3.14 O ATOM 1716 CB ARG A 853 -72.311 83.655 12.128 1.00 42.35 C ATOM 1717 CG ARG A 853 -72.037 83.775 10.637 1.00 24.13 C ATOM 1718 CD ARG A 853 -70.565 84.039 10.361 1.00 2.31 C ATOM 1719 NE ARG A 853 -70.266 84.030 8.932 1.00 41.14 N ATOM 1720 CZ ARG A 853 -70.656 84.984 8.093 1.00 22.31 C ATOM 1721 NH1 ARG A 853 -71.356 86.018 8.539 1.00 30.50 N ATOM 1722 NH2 ARG A 853 -70.345 84.905 6.806 1.00 62.34 N ATOM 0 H ARG A 853 -73.190 82.966 14.341 1.00 13.31 H new ATOM 0 HA ARG A 853 -74.150 84.750 12.323 1.00 71.54 H new ATOM 0 HB2 ARG A 853 -71.778 84.448 12.652 1.00 42.35 H new ATOM 0 HB3 ARG A 853 -71.908 82.709 12.488 1.00 42.35 H new ATOM 0 HG2 ARG A 853 -72.344 82.858 10.135 1.00 24.13 H new ATOM 0 HG3 ARG A 853 -72.637 84.583 10.219 1.00 24.13 H new ATOM 0 HD2 ARG A 853 -70.284 85.004 10.784 1.00 2.31 H new ATOM 0 HD3 ARG A 853 -69.961 83.283 10.863 1.00 2.31 H new ATOM 0 HE ARG A 853 -69.728 83.249 8.557 1.00 41.14 H new ATOM 0 HH11 ARG A 853 -71.596 86.083 9.528 1.00 30.50 H new ATOM 0 HH12 ARG A 853 -71.654 86.749 7.893 1.00 30.50 H new ATOM 0 HH21 ARG A 853 -69.806 84.111 6.459 1.00 62.34 H new ATOM 0 HH22 ARG A 853 -70.645 85.638 6.163 1.00 62.34 H new ATOM 1736 N ILE A 854 -74.569 81.503 11.919 1.00 13.40 N ATOM 1737 CA ILE A 854 -75.292 80.502 11.144 1.00 24.03 C ATOM 1738 C ILE A 854 -76.794 80.595 11.390 1.00 24.25 C ATOM 1739 O ILE A 854 -77.598 80.212 10.540 1.00 51.43 O ATOM 1740 CB ILE A 854 -74.814 79.077 11.482 1.00 14.11 C ATOM 1741 CG1 ILE A 854 -75.145 78.737 12.937 1.00 63.43 C ATOM 1742 CG2 ILE A 854 -73.320 78.945 11.227 1.00 34.44 C ATOM 1743 CD1 ILE A 854 -74.781 77.320 13.323 1.00 35.01 C ATOM 0 H ILE A 854 -74.056 81.129 12.717 1.00 13.40 H new ATOM 0 HA ILE A 854 -75.086 80.706 10.093 1.00 24.03 H new ATOM 0 HB ILE A 854 -75.336 78.371 10.836 1.00 14.11 H new ATOM 0 HG12 ILE A 854 -74.619 79.430 13.593 1.00 63.43 H new ATOM 0 HG13 ILE A 854 -76.212 78.888 13.104 1.00 63.43 H new ATOM 0 HG21 ILE A 854 -72.997 77.933 11.470 1.00 34.44 H new ATOM 0 HG22 ILE A 854 -73.111 79.150 10.177 1.00 34.44 H new ATOM 0 HG23 ILE A 854 -72.780 79.658 11.850 1.00 34.44 H new ATOM 0 HD11 ILE A 854 -75.043 77.149 14.367 1.00 35.01 H new ATOM 0 HD12 ILE A 854 -75.327 76.619 12.692 1.00 35.01 H new ATOM 0 HD13 ILE A 854 -73.710 77.170 13.189 1.00 35.01 H new ATOM 1755 N LEU A 855 -77.165 81.106 12.559 1.00 55.44 N ATOM 1756 CA LEU A 855 -78.572 81.252 12.917 1.00 11.01 C ATOM 1757 C LEU A 855 -79.287 82.189 11.948 1.00 23.24 C ATOM 1758 O LEU A 855 -80.432 81.947 11.565 1.00 12.14 O ATOM 1759 CB LEU A 855 -78.702 81.782 14.346 1.00 32.43 C ATOM 1760 CG LEU A 855 -79.805 81.152 15.198 1.00 73.24 C ATOM 1761 CD1 LEU A 855 -79.902 81.848 16.546 1.00 24.44 C ATOM 1762 CD2 LEU A 855 -81.140 81.210 14.469 1.00 20.30 C ATOM 0 H LEU A 855 -76.512 81.426 13.274 1.00 55.44 H new ATOM 0 HA LEU A 855 -79.041 80.270 12.856 1.00 11.01 H new ATOM 0 HB2 LEU A 855 -77.749 81.635 14.855 1.00 32.43 H new ATOM 0 HB3 LEU A 855 -78.876 82.857 14.299 1.00 32.43 H new ATOM 0 HG LEU A 855 -79.552 80.106 15.370 1.00 73.24 H new ATOM 0 HD11 LEU A 855 -80.692 81.386 17.138 1.00 24.44 H new ATOM 0 HD12 LEU A 855 -78.952 81.755 17.073 1.00 24.44 H new ATOM 0 HD13 LEU A 855 -80.131 82.903 16.395 1.00 24.44 H new ATOM 0 HD21 LEU A 855 -81.913 80.757 15.090 1.00 20.30 H new ATOM 0 HD22 LEU A 855 -81.399 82.249 14.267 1.00 20.30 H new ATOM 0 HD23 LEU A 855 -81.065 80.665 13.528 1.00 20.30 H new