USER MOD reduce.3.24.130724 H: found=0, std=0, add=547, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 547 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 1 MET CE :methyl -177:sc= 0 (180deg=-0.0195) USER MOD Single : A 1 MET N :NH3+ -160:sc= 2.48 (180deg=1.91) USER MOD Single : A 2 GLN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 178:sc= 1.27 (180deg=1.22) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot -67:sc= 0.362 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.225 USER MOD Single : A 25 ASN : amide:sc= 1.11 K(o=1.1,f=-1.1) USER MOD Single : A 27 LYS NZ :NH3+ -151:sc= 1.65 (180deg=1.16) USER MOD Single : A 29 LYS NZ :NH3+ -170:sc= 1.21 (180deg=1.1) USER MOD Single : A 31 GLN : amide:sc= -0.861 K(o=-0.86,f=-1.9) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=-0.078) USER MOD Single : A 41 GLN : amide:sc= 1.6 K(o=1.6,f=-4.1!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 1.84 K(o=1.8,f=-3.7!) USER MOD Single : A 55 THR OG1 : rot -76:sc= 0.958 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 80:sc= 0.446 USER MOD Single : A 60 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00124) USER MOD Single : A 65 SER OG : rot 88:sc= 1.22 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= -0.128 K(o=-0.13,f=-1.9) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 32.730 51.672 20.119 1.00 0.00 N ATOM 2 CA MET A 1 33.054 51.689 21.555 1.00 0.00 C ATOM 3 C MET A 1 34.465 52.226 21.798 1.00 0.00 C ATOM 4 O MET A 1 35.381 51.901 21.045 1.00 0.00 O ATOM 5 CB MET A 1 32.983 50.318 22.221 1.00 0.00 C ATOM 6 CG MET A 1 31.685 49.540 22.027 1.00 0.00 C ATOM 7 SD MET A 1 31.521 48.103 23.116 1.00 0.00 S ATOM 8 CE MET A 1 32.905 47.062 22.596 1.00 0.00 C ATOM 0 H1 MET A 1 31.698 51.636 19.996 1.00 0.00 H new ATOM 0 H2 MET A 1 33.103 52.532 19.669 1.00 0.00 H new ATOM 0 H3 MET A 1 33.160 50.835 19.676 1.00 0.00 H new ATOM 0 HA MET A 1 32.295 52.336 21.995 1.00 0.00 H new ATOM 0 HB2 MET A 1 33.806 49.711 21.843 1.00 0.00 H new ATOM 0 HB3 MET A 1 33.148 50.448 23.291 1.00 0.00 H new ATOM 0 HG2 MET A 1 30.842 50.210 22.197 1.00 0.00 H new ATOM 0 HG3 MET A 1 31.624 49.207 20.991 1.00 0.00 H new ATOM 0 HE1 MET A 1 32.884 46.125 23.152 1.00 0.00 H new ATOM 0 HE2 MET A 1 32.823 46.853 21.529 1.00 0.00 H new ATOM 0 HE3 MET A 1 33.844 47.580 22.793 1.00 0.00 H new ATOM 20 N GLN A 2 34.656 52.944 22.901 1.00 0.00 N ATOM 21 CA GLN A 2 35.918 53.444 23.407 1.00 0.00 C ATOM 22 C GLN A 2 36.649 52.410 24.267 1.00 0.00 C ATOM 23 O GLN A 2 36.030 51.800 25.135 1.00 0.00 O ATOM 24 CB GLN A 2 35.602 54.708 24.201 1.00 0.00 C ATOM 25 CG GLN A 2 36.776 55.382 24.907 1.00 0.00 C ATOM 26 CD GLN A 2 36.295 56.615 25.674 1.00 0.00 C ATOM 27 OE1 GLN A 2 35.849 56.541 26.816 1.00 0.00 O ATOM 28 NE2 GLN A 2 36.311 57.796 25.060 1.00 0.00 N ATOM 0 H GLN A 2 33.875 53.207 23.502 1.00 0.00 H new ATOM 0 HA GLN A 2 36.595 53.661 22.581 1.00 0.00 H new ATOM 0 HB2 GLN A 2 35.150 55.432 23.523 1.00 0.00 H new ATOM 0 HB3 GLN A 2 34.850 54.461 24.950 1.00 0.00 H new ATOM 0 HG2 GLN A 2 37.249 54.679 25.593 1.00 0.00 H new ATOM 0 HG3 GLN A 2 37.531 55.671 24.176 1.00 0.00 H new ATOM 0 HE21 GLN A 2 36.678 57.873 24.112 1.00 0.00 H new ATOM 0 HE22 GLN A 2 35.956 58.624 25.538 1.00 0.00 H new ATOM 37 N ILE A 3 37.960 52.270 24.095 1.00 0.00 N ATOM 38 CA ILE A 3 38.860 51.584 25.000 1.00 0.00 C ATOM 39 C ILE A 3 40.185 52.339 25.135 1.00 0.00 C ATOM 40 O ILE A 3 40.492 53.186 24.300 1.00 0.00 O ATOM 41 CB ILE A 3 39.109 50.134 24.594 1.00 0.00 C ATOM 42 CG1 ILE A 3 39.712 50.000 23.197 1.00 0.00 C ATOM 43 CG2 ILE A 3 37.850 49.284 24.737 1.00 0.00 C ATOM 44 CD1 ILE A 3 40.332 48.635 22.915 1.00 0.00 C ATOM 0 H ILE A 3 38.441 52.652 23.281 1.00 0.00 H new ATOM 0 HA ILE A 3 38.367 51.564 25.972 1.00 0.00 H new ATOM 0 HB ILE A 3 39.854 49.751 25.291 1.00 0.00 H new ATOM 0 HG12 ILE A 3 38.935 50.194 22.457 1.00 0.00 H new ATOM 0 HG13 ILE A 3 40.475 50.768 23.067 1.00 0.00 H new ATOM 0 HG21 ILE A 3 38.068 48.258 24.439 1.00 0.00 H new ATOM 0 HG22 ILE A 3 37.518 49.297 25.775 1.00 0.00 H new ATOM 0 HG23 ILE A 3 37.064 49.688 24.100 1.00 0.00 H new ATOM 0 HD11 ILE A 3 40.738 48.622 21.903 1.00 0.00 H new ATOM 0 HD12 ILE A 3 41.133 48.445 23.629 1.00 0.00 H new ATOM 0 HD13 ILE A 3 39.569 47.862 23.010 1.00 0.00 H new ATOM 56 N PHE A 4 41.001 52.006 26.130 1.00 0.00 N ATOM 57 CA PHE A 4 42.315 52.581 26.341 1.00 0.00 C ATOM 58 C PHE A 4 43.403 51.511 26.431 1.00 0.00 C ATOM 59 O PHE A 4 43.209 50.483 27.076 1.00 0.00 O ATOM 60 CB PHE A 4 42.314 53.437 27.605 1.00 0.00 C ATOM 61 CG PHE A 4 41.250 54.508 27.653 1.00 0.00 C ATOM 62 CD1 PHE A 4 41.372 55.655 26.858 1.00 0.00 C ATOM 63 CD2 PHE A 4 40.144 54.366 28.499 1.00 0.00 C ATOM 64 CE1 PHE A 4 40.394 56.654 26.912 1.00 0.00 C ATOM 65 CE2 PHE A 4 39.173 55.371 28.565 1.00 0.00 C ATOM 66 CZ PHE A 4 39.294 56.516 27.769 1.00 0.00 C ATOM 0 H PHE A 4 40.754 51.307 26.830 1.00 0.00 H new ATOM 0 HA PHE A 4 42.543 53.205 25.477 1.00 0.00 H new ATOM 0 HB2 PHE A 4 42.188 52.783 28.468 1.00 0.00 H new ATOM 0 HB3 PHE A 4 43.290 53.912 27.704 1.00 0.00 H new ATOM 0 HD1 PHE A 4 42.223 55.768 26.202 1.00 0.00 H new ATOM 0 HD2 PHE A 4 40.040 53.477 29.103 1.00 0.00 H new ATOM 0 HE1 PHE A 4 40.487 57.533 26.292 1.00 0.00 H new ATOM 0 HE2 PHE A 4 38.329 55.263 29.231 1.00 0.00 H new ATOM 0 HZ PHE A 4 38.542 57.290 27.815 1.00 0.00 H new ATOM 76 N VAL A 5 44.557 51.763 25.818 1.00 0.00 N ATOM 77 CA VAL A 5 45.706 50.879 25.817 1.00 0.00 C ATOM 78 C VAL A 5 46.925 51.589 26.408 1.00 0.00 C ATOM 79 O VAL A 5 47.345 52.623 25.891 1.00 0.00 O ATOM 80 CB VAL A 5 46.010 50.346 24.421 1.00 0.00 C ATOM 81 CG1 VAL A 5 47.149 49.331 24.454 1.00 0.00 C ATOM 82 CG2 VAL A 5 44.792 49.682 23.785 1.00 0.00 C ATOM 0 H VAL A 5 44.717 52.621 25.291 1.00 0.00 H new ATOM 0 HA VAL A 5 45.464 50.020 26.443 1.00 0.00 H new ATOM 0 HB VAL A 5 46.299 51.210 23.822 1.00 0.00 H new ATOM 0 HG11 VAL A 5 47.343 48.969 23.444 1.00 0.00 H new ATOM 0 HG12 VAL A 5 48.048 49.805 24.848 1.00 0.00 H new ATOM 0 HG13 VAL A 5 46.871 48.493 25.093 1.00 0.00 H new ATOM 0 HG21 VAL A 5 45.054 49.317 22.792 1.00 0.00 H new ATOM 0 HG22 VAL A 5 44.468 48.846 24.405 1.00 0.00 H new ATOM 0 HG23 VAL A 5 43.983 50.408 23.703 1.00 0.00 H new ATOM 92 N LYS A 6 47.507 51.028 27.464 1.00 0.00 N ATOM 93 CA LYS A 6 48.659 51.537 28.180 1.00 0.00 C ATOM 94 C LYS A 6 49.932 50.831 27.708 1.00 0.00 C ATOM 95 O LYS A 6 50.056 49.621 27.883 1.00 0.00 O ATOM 96 CB LYS A 6 48.364 51.387 29.669 1.00 0.00 C ATOM 97 CG LYS A 6 49.176 52.271 30.613 1.00 0.00 C ATOM 98 CD LYS A 6 50.685 52.049 30.637 1.00 0.00 C ATOM 99 CE LYS A 6 51.056 50.596 30.919 1.00 0.00 C ATOM 100 NZ LYS A 6 52.506 50.383 30.799 1.00 0.00 N ATOM 0 H LYS A 6 47.162 50.154 27.862 1.00 0.00 H new ATOM 0 HA LYS A 6 48.841 52.593 27.979 1.00 0.00 H new ATOM 0 HB2 LYS A 6 47.306 51.595 29.831 1.00 0.00 H new ATOM 0 HB3 LYS A 6 48.530 50.346 29.947 1.00 0.00 H new ATOM 0 HG2 LYS A 6 48.990 53.312 30.348 1.00 0.00 H new ATOM 0 HG3 LYS A 6 48.796 52.127 31.624 1.00 0.00 H new ATOM 0 HD2 LYS A 6 51.109 52.350 29.679 1.00 0.00 H new ATOM 0 HD3 LYS A 6 51.131 52.689 31.398 1.00 0.00 H new ATOM 0 HE2 LYS A 6 50.728 50.322 31.922 1.00 0.00 H new ATOM 0 HE3 LYS A 6 50.531 49.942 30.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 52.728 49.386 30.996 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 52.813 50.622 29.835 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 53.004 50.990 31.481 1.00 0.00 H new ATOM 168 N LYS A 11 52.880 55.686 28.449 1.00 0.00 N ATOM 169 CA LYS A 11 51.947 56.338 27.553 1.00 0.00 C ATOM 170 C LYS A 11 50.627 55.563 27.502 1.00 0.00 C ATOM 171 O LYS A 11 50.621 54.341 27.630 1.00 0.00 O ATOM 172 CB LYS A 11 52.640 56.446 26.198 1.00 0.00 C ATOM 173 CG LYS A 11 51.811 56.994 25.040 1.00 0.00 C ATOM 174 CD LYS A 11 52.681 57.101 23.792 1.00 0.00 C ATOM 175 CE LYS A 11 51.857 57.426 22.549 1.00 0.00 C ATOM 176 NZ LYS A 11 52.700 57.461 21.344 1.00 0.00 N ATOM 0 HA LYS A 11 51.680 57.338 27.895 1.00 0.00 H new ATOM 0 HB2 LYS A 11 53.519 57.080 26.316 1.00 0.00 H new ATOM 0 HB3 LYS A 11 52.997 55.455 25.920 1.00 0.00 H new ATOM 0 HG2 LYS A 11 50.960 56.340 24.847 1.00 0.00 H new ATOM 0 HG3 LYS A 11 51.408 57.973 25.300 1.00 0.00 H new ATOM 0 HD2 LYS A 11 53.435 57.874 23.940 1.00 0.00 H new ATOM 0 HD3 LYS A 11 53.213 56.162 23.639 1.00 0.00 H new ATOM 0 HE2 LYS A 11 51.072 56.680 22.425 1.00 0.00 H new ATOM 0 HE3 LYS A 11 51.364 58.389 22.679 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 52.107 57.651 20.511 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 53.412 58.213 21.440 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 53.177 56.544 21.228 1.00 0.00 H new ATOM 190 N THR A 12 49.521 56.262 27.271 1.00 0.00 N ATOM 191 CA THR A 12 48.222 55.678 27.002 1.00 0.00 C ATOM 192 C THR A 12 47.701 56.180 25.652 1.00 0.00 C ATOM 193 O THR A 12 47.907 57.341 25.306 1.00 0.00 O ATOM 194 CB THR A 12 47.224 55.972 28.119 1.00 0.00 C ATOM 195 OG1 THR A 12 47.705 55.500 29.357 1.00 0.00 O ATOM 196 CG2 THR A 12 45.877 55.282 27.924 1.00 0.00 C ATOM 0 H THR A 12 49.509 57.282 27.267 1.00 0.00 H new ATOM 0 HA THR A 12 48.337 54.595 26.960 1.00 0.00 H new ATOM 0 HB THR A 12 47.100 57.055 28.098 1.00 0.00 H new ATOM 0 HG1 THR A 12 47.052 55.700 30.060 1.00 0.00 H new ATOM 0 HG21 THR A 12 45.216 55.534 28.753 1.00 0.00 H new ATOM 0 HG22 THR A 12 45.429 55.616 26.988 1.00 0.00 H new ATOM 0 HG23 THR A 12 46.023 54.202 27.891 1.00 0.00 H new ATOM 204 N ILE A 13 47.036 55.314 24.893 1.00 0.00 N ATOM 205 CA ILE A 13 46.384 55.638 23.641 1.00 0.00 C ATOM 206 C ILE A 13 44.914 55.213 23.658 1.00 0.00 C ATOM 207 O ILE A 13 44.573 54.149 24.168 1.00 0.00 O ATOM 208 CB ILE A 13 47.138 55.070 22.441 1.00 0.00 C ATOM 209 CG1 ILE A 13 47.253 53.549 22.459 1.00 0.00 C ATOM 210 CG2 ILE A 13 48.516 55.715 22.322 1.00 0.00 C ATOM 211 CD1 ILE A 13 47.816 52.919 21.187 1.00 0.00 C ATOM 0 H ILE A 13 46.936 54.332 25.148 1.00 0.00 H new ATOM 0 HA ILE A 13 46.405 56.722 23.530 1.00 0.00 H new ATOM 0 HB ILE A 13 46.545 55.318 21.560 1.00 0.00 H new ATOM 0 HG12 ILE A 13 47.886 53.259 23.298 1.00 0.00 H new ATOM 0 HG13 ILE A 13 46.264 53.129 22.645 1.00 0.00 H new ATOM 0 HG21 ILE A 13 49.040 55.298 21.462 1.00 0.00 H new ATOM 0 HG22 ILE A 13 48.404 56.791 22.192 1.00 0.00 H new ATOM 0 HG23 ILE A 13 49.090 55.516 23.227 1.00 0.00 H new ATOM 0 HD11 ILE A 13 47.856 51.836 21.304 1.00 0.00 H new ATOM 0 HD12 ILE A 13 47.174 53.169 20.342 1.00 0.00 H new ATOM 0 HD13 ILE A 13 48.820 53.301 21.005 1.00 0.00 H new ATOM 223 N THR A 14 44.041 56.037 23.086 1.00 0.00 N ATOM 224 CA THR A 14 42.628 55.746 22.953 1.00 0.00 C ATOM 225 C THR A 14 42.342 55.007 21.644 1.00 0.00 C ATOM 226 O THR A 14 42.674 55.504 20.570 1.00 0.00 O ATOM 227 CB THR A 14 41.766 57.004 23.025 1.00 0.00 C ATOM 228 OG1 THR A 14 42.088 57.763 24.168 1.00 0.00 O ATOM 229 CG2 THR A 14 40.284 56.654 23.123 1.00 0.00 C ATOM 0 H THR A 14 44.307 56.941 22.696 1.00 0.00 H new ATOM 0 HA THR A 14 42.365 55.108 23.797 1.00 0.00 H new ATOM 0 HB THR A 14 41.962 57.570 22.114 1.00 0.00 H new ATOM 0 HG1 THR A 14 41.822 57.271 24.973 1.00 0.00 H new ATOM 0 HG21 THR A 14 39.696 57.571 23.173 1.00 0.00 H new ATOM 0 HG22 THR A 14 39.987 56.080 22.246 1.00 0.00 H new ATOM 0 HG23 THR A 14 40.109 56.061 24.021 1.00 0.00 H new ATOM 237 N LEU A 15 41.690 53.851 21.724 1.00 0.00 N ATOM 238 CA LEU A 15 41.278 53.046 20.592 1.00 0.00 C ATOM 239 C LEU A 15 39.759 53.030 20.414 1.00 0.00 C ATOM 240 O LEU A 15 38.998 53.280 21.347 1.00 0.00 O ATOM 241 CB LEU A 15 41.869 51.643 20.703 1.00 0.00 C ATOM 242 CG LEU A 15 43.000 51.368 19.716 1.00 0.00 C ATOM 243 CD1 LEU A 15 44.261 52.165 20.037 1.00 0.00 C ATOM 244 CD2 LEU A 15 43.371 49.888 19.740 1.00 0.00 C ATOM 0 H LEU A 15 41.426 53.438 22.618 1.00 0.00 H new ATOM 0 HA LEU A 15 41.673 53.505 19.686 1.00 0.00 H new ATOM 0 HB2 LEU A 15 42.241 51.495 21.717 1.00 0.00 H new ATOM 0 HB3 LEU A 15 41.076 50.912 20.545 1.00 0.00 H new ATOM 0 HG LEU A 15 42.631 51.668 18.735 1.00 0.00 H new ATOM 0 HD11 LEU A 15 45.034 51.933 19.305 1.00 0.00 H new ATOM 0 HD12 LEU A 15 44.036 53.231 20.002 1.00 0.00 H new ATOM 0 HD13 LEU A 15 44.614 51.901 21.034 1.00 0.00 H new ATOM 0 HD21 LEU A 15 44.179 49.704 19.032 1.00 0.00 H new ATOM 0 HD22 LEU A 15 43.697 49.611 20.743 1.00 0.00 H new ATOM 0 HD23 LEU A 15 42.502 49.291 19.463 1.00 0.00 H new ATOM 256 N GLU A 16 39.323 52.704 19.201 1.00 0.00 N ATOM 257 CA GLU A 16 37.935 52.519 18.828 1.00 0.00 C ATOM 258 C GLU A 16 37.713 51.095 18.315 1.00 0.00 C ATOM 259 O GLU A 16 38.488 50.581 17.511 1.00 0.00 O ATOM 260 CB GLU A 16 37.550 53.593 17.814 1.00 0.00 C ATOM 261 CG GLU A 16 36.067 53.636 17.457 1.00 0.00 C ATOM 262 CD GLU A 16 35.165 54.099 18.602 1.00 0.00 C ATOM 263 OE1 GLU A 16 35.572 54.959 19.414 1.00 0.00 O ATOM 264 OE2 GLU A 16 34.007 53.633 18.670 1.00 0.00 O ATOM 0 H GLU A 16 39.962 52.556 18.419 1.00 0.00 H new ATOM 0 HA GLU A 16 37.282 52.635 19.693 1.00 0.00 H new ATOM 0 HB2 GLU A 16 37.842 54.566 18.208 1.00 0.00 H new ATOM 0 HB3 GLU A 16 38.124 53.433 16.901 1.00 0.00 H new ATOM 0 HG2 GLU A 16 35.928 54.303 16.606 1.00 0.00 H new ATOM 0 HG3 GLU A 16 35.751 52.642 17.138 1.00 0.00 H new ATOM 271 N VAL A 17 36.697 50.420 18.846 1.00 0.00 N ATOM 272 CA VAL A 17 36.418 49.011 18.653 1.00 0.00 C ATOM 273 C VAL A 17 34.915 48.727 18.625 1.00 0.00 C ATOM 274 O VAL A 17 34.128 49.492 19.178 1.00 0.00 O ATOM 275 CB VAL A 17 37.069 48.168 19.746 1.00 0.00 C ATOM 276 CG1 VAL A 17 38.594 48.197 19.673 1.00 0.00 C ATOM 277 CG2 VAL A 17 36.635 48.573 21.151 1.00 0.00 C ATOM 0 H VAL A 17 36.013 50.871 19.454 1.00 0.00 H new ATOM 0 HA VAL A 17 36.841 48.738 17.686 1.00 0.00 H new ATOM 0 HB VAL A 17 36.720 47.153 19.555 1.00 0.00 H new ATOM 0 HG11 VAL A 17 39.008 47.582 20.472 1.00 0.00 H new ATOM 0 HG12 VAL A 17 38.920 47.807 18.709 1.00 0.00 H new ATOM 0 HG13 VAL A 17 38.944 49.223 19.786 1.00 0.00 H new ATOM 0 HG21 VAL A 17 37.132 47.937 21.883 1.00 0.00 H new ATOM 0 HG22 VAL A 17 36.907 49.613 21.330 1.00 0.00 H new ATOM 0 HG23 VAL A 17 35.555 48.459 21.245 1.00 0.00 H new ATOM 287 N GLU A 18 34.508 47.600 18.047 1.00 0.00 N ATOM 288 CA GLU A 18 33.152 47.091 18.092 1.00 0.00 C ATOM 289 C GLU A 18 33.113 45.699 18.727 1.00 0.00 C ATOM 290 O GLU A 18 34.134 45.016 18.693 1.00 0.00 O ATOM 291 CB GLU A 18 32.525 47.066 16.702 1.00 0.00 C ATOM 292 CG GLU A 18 32.484 48.428 16.014 1.00 0.00 C ATOM 293 CD GLU A 18 31.668 48.374 14.721 1.00 0.00 C ATOM 294 OE1 GLU A 18 30.429 48.526 14.776 1.00 0.00 O ATOM 295 OE2 GLU A 18 32.258 48.200 13.633 1.00 0.00 O ATOM 0 H GLU A 18 35.140 47.000 17.517 1.00 0.00 H new ATOM 0 HA GLU A 18 32.565 47.767 18.713 1.00 0.00 H new ATOM 0 HB2 GLU A 18 33.084 46.371 16.075 1.00 0.00 H new ATOM 0 HB3 GLU A 18 31.509 46.679 16.780 1.00 0.00 H new ATOM 0 HG2 GLU A 18 32.051 49.166 16.689 1.00 0.00 H new ATOM 0 HG3 GLU A 18 33.499 48.756 15.792 1.00 0.00 H new ATOM 302 N PRO A 19 32.000 45.234 19.289 1.00 0.00 N ATOM 303 CA PRO A 19 31.965 43.986 20.024 1.00 0.00 C ATOM 304 C PRO A 19 32.387 42.755 19.219 1.00 0.00 C ATOM 305 O PRO A 19 33.073 41.890 19.760 1.00 0.00 O ATOM 306 CB PRO A 19 30.539 43.842 20.549 1.00 0.00 C ATOM 307 CG PRO A 19 30.039 45.281 20.620 1.00 0.00 C ATOM 308 CD PRO A 19 30.735 45.926 19.425 1.00 0.00 C ATOM 0 HA PRO A 19 32.702 44.029 20.826 1.00 0.00 H new ATOM 0 HB2 PRO A 19 29.925 43.236 19.882 1.00 0.00 H new ATOM 0 HB3 PRO A 19 30.518 43.361 21.527 1.00 0.00 H new ATOM 0 HG2 PRO A 19 28.954 45.339 20.538 1.00 0.00 H new ATOM 0 HG3 PRO A 19 30.314 45.761 21.559 1.00 0.00 H new ATOM 0 HD2 PRO A 19 30.134 45.826 18.521 1.00 0.00 H new ATOM 0 HD3 PRO A 19 30.888 46.993 19.589 1.00 0.00 H new ATOM 316 N SER A 20 32.028 42.677 17.942 1.00 0.00 N ATOM 317 CA SER A 20 32.398 41.575 17.076 1.00 0.00 C ATOM 318 C SER A 20 33.645 41.840 16.231 1.00 0.00 C ATOM 319 O SER A 20 33.974 41.033 15.364 1.00 0.00 O ATOM 320 CB SER A 20 31.204 41.100 16.252 1.00 0.00 C ATOM 321 OG SER A 20 30.203 40.626 17.125 1.00 0.00 O ATOM 0 H SER A 20 31.464 43.389 17.478 1.00 0.00 H new ATOM 0 HA SER A 20 32.691 40.753 17.729 1.00 0.00 H new ATOM 0 HB2 SER A 20 30.817 41.918 15.644 1.00 0.00 H new ATOM 0 HB3 SER A 20 31.510 40.310 15.566 1.00 0.00 H new ATOM 0 HG SER A 20 29.432 40.321 16.603 1.00 0.00 H new ATOM 327 N ASP A 21 34.386 42.911 16.504 1.00 0.00 N ATOM 328 CA ASP A 21 35.708 43.140 15.960 1.00 0.00 C ATOM 329 C ASP A 21 36.761 42.304 16.690 1.00 0.00 C ATOM 330 O ASP A 21 36.534 41.838 17.805 1.00 0.00 O ATOM 331 CB ASP A 21 36.003 44.638 15.990 1.00 0.00 C ATOM 332 CG ASP A 21 37.188 45.060 15.118 1.00 0.00 C ATOM 333 OD1 ASP A 21 37.688 44.265 14.293 1.00 0.00 O ATOM 334 OD2 ASP A 21 37.660 46.204 15.290 1.00 0.00 O ATOM 0 H ASP A 21 34.070 43.657 17.124 1.00 0.00 H new ATOM 0 HA ASP A 21 35.746 42.811 14.921 1.00 0.00 H new ATOM 0 HB2 ASP A 21 35.115 45.179 15.663 1.00 0.00 H new ATOM 0 HB3 ASP A 21 36.198 44.938 17.019 1.00 0.00 H new ATOM 339 N THR A 22 37.919 42.083 16.076 1.00 0.00 N ATOM 340 CA THR A 22 38.914 41.129 16.521 1.00 0.00 C ATOM 341 C THR A 22 40.030 41.745 17.368 1.00 0.00 C ATOM 342 O THR A 22 40.368 42.919 17.239 1.00 0.00 O ATOM 343 CB THR A 22 39.496 40.311 15.372 1.00 0.00 C ATOM 344 OG1 THR A 22 40.317 41.091 14.533 1.00 0.00 O ATOM 345 CG2 THR A 22 38.414 39.660 14.515 1.00 0.00 C ATOM 0 H THR A 22 38.194 42.581 15.229 1.00 0.00 H new ATOM 0 HA THR A 22 38.367 40.451 17.176 1.00 0.00 H new ATOM 0 HB THR A 22 40.093 39.532 15.846 1.00 0.00 H new ATOM 0 HG1 THR A 22 40.672 40.532 13.811 1.00 0.00 H new ATOM 0 HG21 THR A 22 38.880 39.090 13.712 1.00 0.00 H new ATOM 0 HG22 THR A 22 37.813 38.992 15.133 1.00 0.00 H new ATOM 0 HG23 THR A 22 37.775 40.432 14.088 1.00 0.00 H new ATOM 353 N ILE A 23 40.658 40.920 18.203 1.00 0.00 N ATOM 354 CA ILE A 23 41.858 41.267 18.935 1.00 0.00 C ATOM 355 C ILE A 23 43.048 41.459 17.992 1.00 0.00 C ATOM 356 O ILE A 23 43.888 42.319 18.243 1.00 0.00 O ATOM 357 CB ILE A 23 42.123 40.227 20.021 1.00 0.00 C ATOM 358 CG1 ILE A 23 40.998 40.131 21.047 1.00 0.00 C ATOM 359 CG2 ILE A 23 43.455 40.452 20.730 1.00 0.00 C ATOM 360 CD1 ILE A 23 40.649 41.405 21.811 1.00 0.00 C ATOM 0 H ILE A 23 40.333 39.971 18.389 1.00 0.00 H new ATOM 0 HA ILE A 23 41.710 42.227 19.430 1.00 0.00 H new ATOM 0 HB ILE A 23 42.170 39.275 19.492 1.00 0.00 H new ATOM 0 HG12 ILE A 23 40.100 39.786 20.534 1.00 0.00 H new ATOM 0 HG13 ILE A 23 41.265 39.363 21.773 1.00 0.00 H new ATOM 0 HG21 ILE A 23 43.595 39.686 21.493 1.00 0.00 H new ATOM 0 HG22 ILE A 23 44.267 40.395 20.005 1.00 0.00 H new ATOM 0 HG23 ILE A 23 43.456 41.436 21.199 1.00 0.00 H new ATOM 0 HD11 ILE A 23 39.835 41.201 22.507 1.00 0.00 H new ATOM 0 HD12 ILE A 23 41.523 41.748 22.365 1.00 0.00 H new ATOM 0 HD13 ILE A 23 40.339 42.178 21.108 1.00 0.00 H new ATOM 372 N GLU A 24 43.107 40.756 16.865 1.00 0.00 N ATOM 373 CA GLU A 24 44.080 41.034 15.829 1.00 0.00 C ATOM 374 C GLU A 24 43.942 42.448 15.261 1.00 0.00 C ATOM 375 O GLU A 24 44.952 43.123 15.071 1.00 0.00 O ATOM 376 CB GLU A 24 43.971 39.976 14.735 1.00 0.00 C ATOM 377 CG GLU A 24 44.823 40.274 13.503 1.00 0.00 C ATOM 378 CD GLU A 24 45.012 39.023 12.644 1.00 0.00 C ATOM 379 OE1 GLU A 24 46.167 38.572 12.494 1.00 0.00 O ATOM 380 OE2 GLU A 24 43.998 38.469 12.166 1.00 0.00 O ATOM 0 H GLU A 24 42.480 39.980 16.650 1.00 0.00 H new ATOM 0 HA GLU A 24 45.074 40.988 16.274 1.00 0.00 H new ATOM 0 HB2 GLU A 24 44.267 39.011 15.145 1.00 0.00 H new ATOM 0 HB3 GLU A 24 42.928 39.887 14.431 1.00 0.00 H new ATOM 0 HG2 GLU A 24 44.349 41.057 12.911 1.00 0.00 H new ATOM 0 HG3 GLU A 24 45.796 40.655 13.814 1.00 0.00 H new ATOM 387 N ASN A 25 42.724 42.947 15.068 1.00 0.00 N ATOM 388 CA ASN A 25 42.508 44.326 14.676 1.00 0.00 C ATOM 389 C ASN A 25 42.873 45.331 15.770 1.00 0.00 C ATOM 390 O ASN A 25 43.329 46.425 15.445 1.00 0.00 O ATOM 391 CB ASN A 25 41.072 44.504 14.193 1.00 0.00 C ATOM 392 CG ASN A 25 40.847 44.164 12.717 1.00 0.00 C ATOM 393 OD1 ASN A 25 41.755 43.929 11.922 1.00 0.00 O ATOM 394 ND2 ASN A 25 39.591 44.196 12.284 1.00 0.00 N ATOM 0 H ASN A 25 41.867 42.406 15.180 1.00 0.00 H new ATOM 0 HA ASN A 25 43.189 44.544 13.853 1.00 0.00 H new ATOM 0 HB2 ASN A 25 40.419 43.877 14.800 1.00 0.00 H new ATOM 0 HB3 ASN A 25 40.771 45.538 14.364 1.00 0.00 H new ATOM 0 HD21 ASN A 25 39.387 44.026 11.299 1.00 0.00 H new ATOM 0 HD22 ASN A 25 38.831 44.390 12.936 1.00 0.00 H new ATOM 401 N VAL A 26 42.766 44.982 17.048 1.00 0.00 N ATOM 402 CA VAL A 26 43.305 45.789 18.125 1.00 0.00 C ATOM 403 C VAL A 26 44.826 45.880 17.985 1.00 0.00 C ATOM 404 O VAL A 26 45.364 46.985 17.967 1.00 0.00 O ATOM 405 CB VAL A 26 42.898 45.285 19.507 1.00 0.00 C ATOM 406 CG1 VAL A 26 43.522 46.102 20.635 1.00 0.00 C ATOM 407 CG2 VAL A 26 41.386 45.337 19.703 1.00 0.00 C ATOM 0 H VAL A 26 42.302 44.130 17.361 1.00 0.00 H new ATOM 0 HA VAL A 26 42.876 46.787 18.039 1.00 0.00 H new ATOM 0 HB VAL A 26 43.259 44.257 19.550 1.00 0.00 H new ATOM 0 HG11 VAL A 26 43.200 45.701 21.596 1.00 0.00 H new ATOM 0 HG12 VAL A 26 44.608 46.048 20.565 1.00 0.00 H new ATOM 0 HG13 VAL A 26 43.204 47.141 20.550 1.00 0.00 H new ATOM 0 HG21 VAL A 26 41.135 44.970 20.698 1.00 0.00 H new ATOM 0 HG22 VAL A 26 41.041 46.365 19.597 1.00 0.00 H new ATOM 0 HG23 VAL A 26 40.900 44.712 18.953 1.00 0.00 H new ATOM 417 N LYS A 27 45.511 44.761 17.767 1.00 0.00 N ATOM 418 CA LYS A 27 46.943 44.739 17.548 1.00 0.00 C ATOM 419 C LYS A 27 47.358 45.476 16.273 1.00 0.00 C ATOM 420 O LYS A 27 48.376 46.166 16.285 1.00 0.00 O ATOM 421 CB LYS A 27 47.471 43.307 17.572 1.00 0.00 C ATOM 422 CG LYS A 27 47.347 42.654 18.946 1.00 0.00 C ATOM 423 CD LYS A 27 47.943 41.248 18.977 1.00 0.00 C ATOM 424 CE LYS A 27 47.869 40.708 20.402 1.00 0.00 C ATOM 425 NZ LYS A 27 48.442 39.357 20.509 1.00 0.00 N ATOM 0 H LYS A 27 45.078 43.838 17.738 1.00 0.00 H new ATOM 0 HA LYS A 27 47.402 45.285 18.372 1.00 0.00 H new ATOM 0 HB2 LYS A 27 46.925 42.711 16.841 1.00 0.00 H new ATOM 0 HB3 LYS A 27 48.517 43.305 17.267 1.00 0.00 H new ATOM 0 HG2 LYS A 27 47.849 43.275 19.687 1.00 0.00 H new ATOM 0 HG3 LYS A 27 46.296 42.607 19.229 1.00 0.00 H new ATOM 0 HD2 LYS A 27 47.398 40.593 18.297 1.00 0.00 H new ATOM 0 HD3 LYS A 27 48.978 41.270 18.636 1.00 0.00 H new ATOM 0 HE2 LYS A 27 48.401 41.382 21.073 1.00 0.00 H new ATOM 0 HE3 LYS A 27 46.829 40.688 20.729 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 47.971 38.840 21.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 48.300 38.848 19.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 49.460 39.427 20.710 1.00 0.00 H new ATOM 439 N ALA A 28 46.577 45.415 15.199 1.00 0.00 N ATOM 440 CA ALA A 28 46.829 46.150 13.975 1.00 0.00 C ATOM 441 C ALA A 28 46.747 47.664 14.171 1.00 0.00 C ATOM 442 O ALA A 28 47.628 48.388 13.711 1.00 0.00 O ATOM 443 CB ALA A 28 45.842 45.682 12.908 1.00 0.00 C ATOM 0 H ALA A 28 45.735 44.840 15.160 1.00 0.00 H new ATOM 0 HA ALA A 28 47.850 45.943 13.655 1.00 0.00 H new ATOM 0 HB1 ALA A 28 46.022 46.228 11.982 1.00 0.00 H new ATOM 0 HB2 ALA A 28 45.976 44.615 12.732 1.00 0.00 H new ATOM 0 HB3 ALA A 28 44.823 45.869 13.248 1.00 0.00 H new ATOM 449 N LYS A 29 45.761 48.150 14.921 1.00 0.00 N ATOM 450 CA LYS A 29 45.638 49.550 15.275 1.00 0.00 C ATOM 451 C LYS A 29 46.796 50.025 16.156 1.00 0.00 C ATOM 452 O LYS A 29 47.309 51.118 15.923 1.00 0.00 O ATOM 453 CB LYS A 29 44.285 49.805 15.933 1.00 0.00 C ATOM 454 CG LYS A 29 43.205 50.022 14.876 1.00 0.00 C ATOM 455 CD LYS A 29 41.786 50.089 15.433 1.00 0.00 C ATOM 456 CE LYS A 29 41.287 48.696 15.807 1.00 0.00 C ATOM 457 NZ LYS A 29 39.827 48.663 15.989 1.00 0.00 N ATOM 0 H LYS A 29 45.016 47.567 15.303 1.00 0.00 H new ATOM 0 HA LYS A 29 45.692 50.137 14.358 1.00 0.00 H new ATOM 0 HB2 LYS A 29 44.017 48.959 16.566 1.00 0.00 H new ATOM 0 HB3 LYS A 29 44.349 50.680 16.580 1.00 0.00 H new ATOM 0 HG2 LYS A 29 43.417 50.948 14.341 1.00 0.00 H new ATOM 0 HG3 LYS A 29 43.259 49.213 14.147 1.00 0.00 H new ATOM 0 HD2 LYS A 29 41.764 50.736 16.310 1.00 0.00 H new ATOM 0 HD3 LYS A 29 41.120 50.533 14.693 1.00 0.00 H new ATOM 0 HE2 LYS A 29 41.571 47.988 15.028 1.00 0.00 H new ATOM 0 HE3 LYS A 29 41.774 48.371 16.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 39.549 47.751 16.404 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 39.539 49.434 16.624 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 39.360 48.781 15.067 1.00 0.00 H new ATOM 471 N ILE A 30 47.246 49.200 17.097 1.00 0.00 N ATOM 472 CA ILE A 30 48.410 49.444 17.925 1.00 0.00 C ATOM 473 C ILE A 30 49.706 49.433 17.110 1.00 0.00 C ATOM 474 O ILE A 30 50.577 50.258 17.376 1.00 0.00 O ATOM 475 CB ILE A 30 48.454 48.457 19.087 1.00 0.00 C ATOM 476 CG1 ILE A 30 47.280 48.668 20.040 1.00 0.00 C ATOM 477 CG2 ILE A 30 49.757 48.543 19.878 1.00 0.00 C ATOM 478 CD1 ILE A 30 47.052 47.493 20.985 1.00 0.00 C ATOM 0 H ILE A 30 46.789 48.312 17.307 1.00 0.00 H new ATOM 0 HA ILE A 30 48.322 50.447 18.342 1.00 0.00 H new ATOM 0 HB ILE A 30 48.388 47.466 18.639 1.00 0.00 H new ATOM 0 HG12 ILE A 30 47.455 49.569 20.628 1.00 0.00 H new ATOM 0 HG13 ILE A 30 46.374 48.838 19.458 1.00 0.00 H new ATOM 0 HG21 ILE A 30 49.736 47.820 20.693 1.00 0.00 H new ATOM 0 HG22 ILE A 30 50.597 48.324 19.220 1.00 0.00 H new ATOM 0 HG23 ILE A 30 49.869 49.547 20.287 1.00 0.00 H new ATOM 0 HD11 ILE A 30 46.204 47.708 21.635 1.00 0.00 H new ATOM 0 HD12 ILE A 30 46.846 46.594 20.404 1.00 0.00 H new ATOM 0 HD13 ILE A 30 47.943 47.336 21.592 1.00 0.00 H new ATOM 490 N GLN A 31 49.852 48.586 16.095 1.00 0.00 N ATOM 491 CA GLN A 31 51.013 48.592 15.228 1.00 0.00 C ATOM 492 C GLN A 31 51.139 49.910 14.463 1.00 0.00 C ATOM 493 O GLN A 31 52.240 50.448 14.365 1.00 0.00 O ATOM 494 CB GLN A 31 50.976 47.389 14.289 1.00 0.00 C ATOM 495 CG GLN A 31 52.078 47.444 13.235 1.00 0.00 C ATOM 496 CD GLN A 31 52.106 46.221 12.315 1.00 0.00 C ATOM 497 OE1 GLN A 31 53.083 45.475 12.283 1.00 0.00 O ATOM 498 NE2 GLN A 31 51.050 45.978 11.544 1.00 0.00 N ATOM 0 H GLN A 31 49.161 47.875 15.855 1.00 0.00 H new ATOM 0 HA GLN A 31 51.905 48.508 15.849 1.00 0.00 H new ATOM 0 HB2 GLN A 31 51.078 46.473 14.871 1.00 0.00 H new ATOM 0 HB3 GLN A 31 50.005 47.346 13.795 1.00 0.00 H new ATOM 0 HG2 GLN A 31 51.946 48.341 12.630 1.00 0.00 H new ATOM 0 HG3 GLN A 31 53.043 47.535 13.734 1.00 0.00 H new ATOM 0 HE21 GLN A 31 50.242 46.600 11.575 1.00 0.00 H new ATOM 0 HE22 GLN A 31 51.048 45.170 10.922 1.00 0.00 H new ATOM 507 N ASP A 32 50.045 50.448 13.934 1.00 0.00 N ATOM 508 CA ASP A 32 50.063 51.728 13.254 1.00 0.00 C ATOM 509 C ASP A 32 50.338 52.886 14.215 1.00 0.00 C ATOM 510 O ASP A 32 51.086 53.798 13.874 1.00 0.00 O ATOM 511 CB ASP A 32 48.747 51.909 12.502 1.00 0.00 C ATOM 512 CG ASP A 32 48.728 53.185 11.657 1.00 0.00 C ATOM 513 OD1 ASP A 32 48.188 54.208 12.131 1.00 0.00 O ATOM 514 OD2 ASP A 32 49.224 53.170 10.510 1.00 0.00 O ATOM 0 H ASP A 32 49.126 50.007 13.967 1.00 0.00 H new ATOM 0 HA ASP A 32 50.885 51.737 12.538 1.00 0.00 H new ATOM 0 HB2 ASP A 32 48.579 51.047 11.857 1.00 0.00 H new ATOM 0 HB3 ASP A 32 47.924 51.937 13.217 1.00 0.00 H new ATOM 519 N LYS A 33 49.804 52.842 15.433 1.00 0.00 N ATOM 520 CA LYS A 33 49.922 53.914 16.399 1.00 0.00 C ATOM 521 C LYS A 33 51.249 53.931 17.160 1.00 0.00 C ATOM 522 O LYS A 33 51.774 55.013 17.414 1.00 0.00 O ATOM 523 CB LYS A 33 48.716 53.870 17.333 1.00 0.00 C ATOM 524 CG LYS A 33 48.535 55.106 18.209 1.00 0.00 C ATOM 525 CD LYS A 33 48.211 56.363 17.404 1.00 0.00 C ATOM 526 CE LYS A 33 48.011 57.576 18.309 1.00 0.00 C ATOM 527 NZ LYS A 33 47.817 58.786 17.495 1.00 0.00 N ATOM 0 H LYS A 33 49.269 52.044 15.775 1.00 0.00 H new ATOM 0 HA LYS A 33 49.927 54.855 15.850 1.00 0.00 H new ATOM 0 HB2 LYS A 33 47.816 53.733 16.734 1.00 0.00 H new ATOM 0 HB3 LYS A 33 48.806 52.996 17.978 1.00 0.00 H new ATOM 0 HG2 LYS A 33 47.734 54.923 18.926 1.00 0.00 H new ATOM 0 HG3 LYS A 33 49.445 55.274 18.784 1.00 0.00 H new ATOM 0 HD2 LYS A 33 49.019 56.563 16.700 1.00 0.00 H new ATOM 0 HD3 LYS A 33 47.309 56.196 16.815 1.00 0.00 H new ATOM 0 HE2 LYS A 33 47.147 57.420 18.954 1.00 0.00 H new ATOM 0 HE3 LYS A 33 48.876 57.701 18.960 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 47.682 59.607 18.120 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 48.654 58.940 16.897 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 46.978 58.668 16.892 1.00 0.00 H new ATOM 541 N GLU A 34 51.779 52.768 17.525 1.00 0.00 N ATOM 542 CA GLU A 34 52.870 52.578 18.461 1.00 0.00 C ATOM 543 C GLU A 34 53.978 51.633 17.992 1.00 0.00 C ATOM 544 O GLU A 34 54.939 51.419 18.729 1.00 0.00 O ATOM 545 CB GLU A 34 52.311 52.153 19.815 1.00 0.00 C ATOM 546 CG GLU A 34 51.826 53.327 20.660 1.00 0.00 C ATOM 547 CD GLU A 34 52.972 54.024 21.397 1.00 0.00 C ATOM 548 OE1 GLU A 34 53.181 53.729 22.593 1.00 0.00 O ATOM 549 OE2 GLU A 34 53.629 54.905 20.800 1.00 0.00 O ATOM 0 H GLU A 34 51.435 51.884 17.150 1.00 0.00 H new ATOM 0 HA GLU A 34 53.368 53.544 18.542 1.00 0.00 H new ATOM 0 HB2 GLU A 34 51.484 51.460 19.658 1.00 0.00 H new ATOM 0 HB3 GLU A 34 53.081 51.611 20.365 1.00 0.00 H new ATOM 0 HG2 GLU A 34 51.317 54.047 20.019 1.00 0.00 H new ATOM 0 HG3 GLU A 34 51.093 52.972 21.385 1.00 0.00 H new ATOM 556 N GLY A 35 53.919 51.082 16.783 1.00 0.00 N ATOM 557 CA GLY A 35 55.098 50.579 16.107 1.00 0.00 C ATOM 558 C GLY A 35 55.669 49.233 16.556 1.00 0.00 C ATOM 559 O GLY A 35 56.836 48.968 16.274 1.00 0.00 O ATOM 0 H GLY A 35 53.055 50.975 16.252 1.00 0.00 H new ATOM 0 HA2 GLY A 35 54.866 50.505 15.044 1.00 0.00 H new ATOM 0 HA3 GLY A 35 55.885 51.326 16.210 1.00 0.00 H new ATOM 563 N ILE A 36 54.905 48.382 17.234 1.00 0.00 N ATOM 564 CA ILE A 36 55.284 47.024 17.568 1.00 0.00 C ATOM 565 C ILE A 36 54.488 46.066 16.679 1.00 0.00 C ATOM 566 O ILE A 36 53.271 46.219 16.607 1.00 0.00 O ATOM 567 CB ILE A 36 55.099 46.758 19.059 1.00 0.00 C ATOM 568 CG1 ILE A 36 56.013 47.660 19.882 1.00 0.00 C ATOM 569 CG2 ILE A 36 55.369 45.298 19.412 1.00 0.00 C ATOM 570 CD1 ILE A 36 55.825 47.570 21.394 1.00 0.00 C ATOM 0 H ILE A 36 53.977 48.632 17.574 1.00 0.00 H new ATOM 0 HA ILE A 36 56.344 46.863 17.373 1.00 0.00 H new ATOM 0 HB ILE A 36 54.059 46.979 19.298 1.00 0.00 H new ATOM 0 HG12 ILE A 36 57.048 47.414 19.645 1.00 0.00 H new ATOM 0 HG13 ILE A 36 55.852 48.693 19.573 1.00 0.00 H new ATOM 0 HG21 ILE A 36 55.227 45.150 20.482 1.00 0.00 H new ATOM 0 HG22 ILE A 36 54.680 44.657 18.862 1.00 0.00 H new ATOM 0 HG23 ILE A 36 56.394 45.042 19.144 1.00 0.00 H new ATOM 0 HD11 ILE A 36 56.520 48.249 21.888 1.00 0.00 H new ATOM 0 HD12 ILE A 36 54.803 47.848 21.651 1.00 0.00 H new ATOM 0 HD13 ILE A 36 56.018 46.549 21.724 1.00 0.00 H new ATOM 582 N PRO A 37 55.092 45.084 16.016 1.00 0.00 N ATOM 583 CA PRO A 37 54.367 44.160 15.169 1.00 0.00 C ATOM 584 C PRO A 37 53.474 43.209 15.969 1.00 0.00 C ATOM 585 O PRO A 37 53.875 42.798 17.055 1.00 0.00 O ATOM 586 CB PRO A 37 55.415 43.407 14.354 1.00 0.00 C ATOM 587 CG PRO A 37 56.646 43.453 15.254 1.00 0.00 C ATOM 588 CD PRO A 37 56.511 44.792 15.973 1.00 0.00 C ATOM 0 HA PRO A 37 53.681 44.701 14.517 1.00 0.00 H new ATOM 0 HB2 PRO A 37 55.105 42.383 14.146 1.00 0.00 H new ATOM 0 HB3 PRO A 37 55.600 43.886 13.392 1.00 0.00 H new ATOM 0 HG2 PRO A 37 56.661 42.620 15.957 1.00 0.00 H new ATOM 0 HG3 PRO A 37 57.568 43.399 14.676 1.00 0.00 H new ATOM 0 HD2 PRO A 37 56.928 44.738 16.978 1.00 0.00 H new ATOM 0 HD3 PRO A 37 57.054 45.575 15.444 1.00 0.00 H new ATOM 596 N PRO A 38 52.305 42.813 15.470 1.00 0.00 N ATOM 597 CA PRO A 38 51.332 42.057 16.232 1.00 0.00 C ATOM 598 C PRO A 38 51.859 40.801 16.926 1.00 0.00 C ATOM 599 O PRO A 38 51.510 40.593 18.086 1.00 0.00 O ATOM 600 CB PRO A 38 50.218 41.708 15.248 1.00 0.00 C ATOM 601 CG PRO A 38 50.222 42.910 14.307 1.00 0.00 C ATOM 602 CD PRO A 38 51.707 43.251 14.226 1.00 0.00 C ATOM 0 HA PRO A 38 50.998 42.673 17.067 1.00 0.00 H new ATOM 0 HB2 PRO A 38 50.421 40.777 14.718 1.00 0.00 H new ATOM 0 HB3 PRO A 38 49.257 41.587 15.748 1.00 0.00 H new ATOM 0 HG2 PRO A 38 49.807 42.663 13.330 1.00 0.00 H new ATOM 0 HG3 PRO A 38 49.635 43.739 14.703 1.00 0.00 H new ATOM 0 HD2 PRO A 38 52.173 42.752 13.376 1.00 0.00 H new ATOM 0 HD3 PRO A 38 51.851 44.322 14.084 1.00 0.00 H new ATOM 610 N ASP A 39 52.739 40.013 16.314 1.00 0.00 N ATOM 611 CA ASP A 39 53.273 38.802 16.906 1.00 0.00 C ATOM 612 C ASP A 39 54.179 39.050 18.114 1.00 0.00 C ATOM 613 O ASP A 39 54.359 38.167 18.950 1.00 0.00 O ATOM 614 CB ASP A 39 53.923 37.926 15.840 1.00 0.00 C ATOM 615 CG ASP A 39 55.074 38.588 15.080 1.00 0.00 C ATOM 616 OD1 ASP A 39 54.801 39.338 14.117 1.00 0.00 O ATOM 617 OD2 ASP A 39 56.251 38.303 15.387 1.00 0.00 O ATOM 0 H ASP A 39 53.103 40.205 15.381 1.00 0.00 H new ATOM 0 HA ASP A 39 52.428 38.252 17.319 1.00 0.00 H new ATOM 0 HB2 ASP A 39 54.294 37.017 16.313 1.00 0.00 H new ATOM 0 HB3 ASP A 39 53.160 37.623 15.123 1.00 0.00 H new ATOM 622 N GLN A 40 54.686 40.269 18.274 1.00 0.00 N ATOM 623 CA GLN A 40 55.408 40.726 19.443 1.00 0.00 C ATOM 624 C GLN A 40 54.538 41.439 20.481 1.00 0.00 C ATOM 625 O GLN A 40 55.024 41.700 21.580 1.00 0.00 O ATOM 626 CB GLN A 40 56.561 41.636 19.027 1.00 0.00 C ATOM 627 CG GLN A 40 57.649 40.896 18.254 1.00 0.00 C ATOM 628 CD GLN A 40 58.933 41.728 18.260 1.00 0.00 C ATOM 629 OE1 GLN A 40 59.275 42.395 17.286 1.00 0.00 O ATOM 630 NE2 GLN A 40 59.647 41.741 19.383 1.00 0.00 N ATOM 0 H GLN A 40 54.598 40.991 17.559 1.00 0.00 H new ATOM 0 HA GLN A 40 55.784 39.825 19.928 1.00 0.00 H new ATOM 0 HB2 GLN A 40 56.173 42.448 18.412 1.00 0.00 H new ATOM 0 HB3 GLN A 40 56.998 42.090 19.916 1.00 0.00 H new ATOM 0 HG2 GLN A 40 57.832 39.921 18.706 1.00 0.00 H new ATOM 0 HG3 GLN A 40 57.324 40.716 17.229 1.00 0.00 H new ATOM 0 HE21 GLN A 40 59.350 41.182 20.183 1.00 0.00 H new ATOM 0 HE22 GLN A 40 60.491 42.310 19.444 1.00 0.00 H new ATOM 639 N GLN A 41 53.281 41.752 20.181 1.00 0.00 N ATOM 640 CA GLN A 41 52.379 42.388 21.121 1.00 0.00 C ATOM 641 C GLN A 41 51.706 41.353 22.025 1.00 0.00 C ATOM 642 O GLN A 41 50.969 40.496 21.543 1.00 0.00 O ATOM 643 CB GLN A 41 51.300 43.195 20.406 1.00 0.00 C ATOM 644 CG GLN A 41 51.798 44.388 19.598 1.00 0.00 C ATOM 645 CD GLN A 41 50.622 45.138 18.969 1.00 0.00 C ATOM 646 OE1 GLN A 41 49.532 45.223 19.531 1.00 0.00 O ATOM 647 NE2 GLN A 41 50.770 45.691 17.769 1.00 0.00 N ATOM 0 H GLN A 41 52.861 41.568 19.270 1.00 0.00 H new ATOM 0 HA GLN A 41 52.984 43.063 21.727 1.00 0.00 H new ATOM 0 HB2 GLN A 41 50.755 42.528 19.738 1.00 0.00 H new ATOM 0 HB3 GLN A 41 50.587 43.554 21.149 1.00 0.00 H new ATOM 0 HG2 GLN A 41 52.363 45.061 20.243 1.00 0.00 H new ATOM 0 HG3 GLN A 41 52.479 44.048 18.818 1.00 0.00 H new ATOM 0 HE21 GLN A 41 51.667 45.631 17.287 1.00 0.00 H new ATOM 0 HE22 GLN A 41 49.987 46.175 17.331 1.00 0.00 H new ATOM 656 N ARG A 42 51.890 41.486 23.335 1.00 0.00 N ATOM 657 CA ARG A 42 51.194 40.730 24.358 1.00 0.00 C ATOM 658 C ARG A 42 50.225 41.666 25.082 1.00 0.00 C ATOM 659 O ARG A 42 50.661 42.599 25.753 1.00 0.00 O ATOM 660 CB ARG A 42 52.252 40.108 25.266 1.00 0.00 C ATOM 661 CG ARG A 42 51.675 39.130 26.286 1.00 0.00 C ATOM 662 CD ARG A 42 52.794 38.582 27.166 1.00 0.00 C ATOM 663 NE ARG A 42 52.290 37.591 28.116 1.00 0.00 N ATOM 664 CZ ARG A 42 52.994 36.989 29.085 1.00 0.00 C ATOM 665 NH1 ARG A 42 54.296 37.228 29.292 1.00 0.00 N ATOM 666 NH2 ARG A 42 52.415 36.102 29.905 1.00 0.00 N ATOM 0 H ARG A 42 52.557 42.153 23.724 1.00 0.00 H new ATOM 0 HA ARG A 42 50.591 39.918 23.952 1.00 0.00 H new ATOM 0 HB2 ARG A 42 52.988 39.589 24.652 1.00 0.00 H new ATOM 0 HB3 ARG A 42 52.780 40.902 25.793 1.00 0.00 H new ATOM 0 HG2 ARG A 42 50.928 39.631 26.902 1.00 0.00 H new ATOM 0 HG3 ARG A 42 51.169 38.312 25.773 1.00 0.00 H new ATOM 0 HD2 ARG A 42 53.563 38.129 26.540 1.00 0.00 H new ATOM 0 HD3 ARG A 42 53.266 39.401 27.709 1.00 0.00 H new ATOM 0 HE ARG A 42 51.307 37.333 28.033 1.00 0.00 H new ATOM 0 HH11 ARG A 42 54.793 37.893 28.699 1.00 0.00 H new ATOM 0 HH12 ARG A 42 54.790 36.745 30.043 1.00 0.00 H new ATOM 0 HH21 ARG A 42 51.426 35.877 29.796 1.00 0.00 H new ATOM 0 HH22 ARG A 42 52.963 35.652 30.638 1.00 0.00 H new ATOM 680 N LEU A 43 48.922 41.464 24.906 1.00 0.00 N ATOM 681 CA LEU A 43 47.876 42.296 25.464 1.00 0.00 C ATOM 682 C LEU A 43 47.271 41.648 26.712 1.00 0.00 C ATOM 683 O LEU A 43 46.760 40.534 26.635 1.00 0.00 O ATOM 684 CB LEU A 43 46.799 42.569 24.420 1.00 0.00 C ATOM 685 CG LEU A 43 47.236 43.355 23.187 1.00 0.00 C ATOM 686 CD1 LEU A 43 46.043 43.540 22.254 1.00 0.00 C ATOM 687 CD2 LEU A 43 47.787 44.738 23.523 1.00 0.00 C ATOM 0 H LEU A 43 48.560 40.689 24.351 1.00 0.00 H new ATOM 0 HA LEU A 43 48.317 43.248 25.760 1.00 0.00 H new ATOM 0 HB2 LEU A 43 46.392 41.613 24.090 1.00 0.00 H new ATOM 0 HB3 LEU A 43 45.986 43.112 24.901 1.00 0.00 H new ATOM 0 HG LEU A 43 48.033 42.778 22.718 1.00 0.00 H new ATOM 0 HD11 LEU A 43 46.354 44.101 21.373 1.00 0.00 H new ATOM 0 HD12 LEU A 43 45.666 42.564 21.948 1.00 0.00 H new ATOM 0 HD13 LEU A 43 45.256 44.087 22.774 1.00 0.00 H new ATOM 0 HD21 LEU A 43 48.080 45.246 22.604 1.00 0.00 H new ATOM 0 HD22 LEU A 43 47.020 45.322 24.031 1.00 0.00 H new ATOM 0 HD23 LEU A 43 48.655 44.635 24.174 1.00 0.00 H new ATOM 699 N ILE A 44 47.300 42.361 27.834 1.00 0.00 N ATOM 700 CA ILE A 44 46.816 41.911 29.125 1.00 0.00 C ATOM 701 C ILE A 44 45.679 42.807 29.619 1.00 0.00 C ATOM 702 O ILE A 44 45.826 44.025 29.695 1.00 0.00 O ATOM 703 CB ILE A 44 47.946 41.836 30.148 1.00 0.00 C ATOM 704 CG1 ILE A 44 49.194 41.085 29.693 1.00 0.00 C ATOM 705 CG2 ILE A 44 47.427 41.228 31.447 1.00 0.00 C ATOM 706 CD1 ILE A 44 49.017 39.608 29.351 1.00 0.00 C ATOM 0 H ILE A 44 47.678 43.308 27.864 1.00 0.00 H new ATOM 0 HA ILE A 44 46.422 40.902 29.002 1.00 0.00 H new ATOM 0 HB ILE A 44 48.268 42.867 30.291 1.00 0.00 H new ATOM 0 HG12 ILE A 44 49.596 41.592 28.816 1.00 0.00 H new ATOM 0 HG13 ILE A 44 49.945 41.165 30.479 1.00 0.00 H new ATOM 0 HG21 ILE A 44 48.238 41.177 32.174 1.00 0.00 H new ATOM 0 HG22 ILE A 44 46.623 41.848 31.843 1.00 0.00 H new ATOM 0 HG23 ILE A 44 47.049 40.224 31.253 1.00 0.00 H new ATOM 0 HD11 ILE A 44 49.975 39.189 29.042 1.00 0.00 H new ATOM 0 HD12 ILE A 44 48.652 39.073 30.228 1.00 0.00 H new ATOM 0 HD13 ILE A 44 48.297 39.506 28.539 1.00 0.00 H new ATOM 718 N PHE A 45 44.554 42.208 29.998 1.00 0.00 N ATOM 719 CA PHE A 45 43.389 42.860 30.563 1.00 0.00 C ATOM 720 C PHE A 45 43.026 42.233 31.910 1.00 0.00 C ATOM 721 O PHE A 45 42.572 41.093 31.972 1.00 0.00 O ATOM 722 CB PHE A 45 42.251 42.769 29.549 1.00 0.00 C ATOM 723 CG PHE A 45 40.934 43.373 29.975 1.00 0.00 C ATOM 724 CD1 PHE A 45 40.888 44.674 30.489 1.00 0.00 C ATOM 725 CD2 PHE A 45 39.744 42.651 29.826 1.00 0.00 C ATOM 726 CE1 PHE A 45 39.671 45.238 30.889 1.00 0.00 C ATOM 727 CE2 PHE A 45 38.520 43.224 30.191 1.00 0.00 C ATOM 728 CZ PHE A 45 38.482 44.516 30.728 1.00 0.00 C ATOM 0 H PHE A 45 44.429 41.199 29.912 1.00 0.00 H new ATOM 0 HA PHE A 45 43.594 43.912 30.761 1.00 0.00 H new ATOM 0 HB2 PHE A 45 42.571 43.258 28.629 1.00 0.00 H new ATOM 0 HB3 PHE A 45 42.086 41.718 29.311 1.00 0.00 H new ATOM 0 HD1 PHE A 45 41.799 45.247 30.578 1.00 0.00 H new ATOM 0 HD2 PHE A 45 39.770 41.647 29.428 1.00 0.00 H new ATOM 0 HE1 PHE A 45 39.649 46.228 31.321 1.00 0.00 H new ATOM 0 HE2 PHE A 45 37.604 42.668 30.058 1.00 0.00 H new ATOM 0 HZ PHE A 45 37.539 44.955 31.017 1.00 0.00 H new ATOM 738 N ALA A 46 43.254 42.960 33.000 1.00 0.00 N ATOM 739 CA ALA A 46 43.109 42.496 34.365 1.00 0.00 C ATOM 740 C ALA A 46 43.719 41.116 34.621 1.00 0.00 C ATOM 741 O ALA A 46 43.058 40.205 35.114 1.00 0.00 O ATOM 742 CB ALA A 46 41.652 42.626 34.800 1.00 0.00 C ATOM 0 H ALA A 46 43.558 43.932 32.947 1.00 0.00 H new ATOM 0 HA ALA A 46 43.706 43.145 35.006 1.00 0.00 H new ATOM 0 HB1 ALA A 46 41.546 42.276 35.827 1.00 0.00 H new ATOM 0 HB2 ALA A 46 41.346 43.670 34.739 1.00 0.00 H new ATOM 0 HB3 ALA A 46 41.022 42.024 34.145 1.00 0.00 H new ATOM 748 N GLY A 47 44.966 40.919 34.202 1.00 0.00 N ATOM 749 CA GLY A 47 45.687 39.665 34.275 1.00 0.00 C ATOM 750 C GLY A 47 45.393 38.632 33.184 1.00 0.00 C ATOM 751 O GLY A 47 46.192 37.711 33.028 1.00 0.00 O ATOM 0 H GLY A 47 45.521 41.667 33.785 1.00 0.00 H new ATOM 0 HA2 GLY A 47 46.754 39.886 34.254 1.00 0.00 H new ATOM 0 HA3 GLY A 47 45.475 39.207 35.241 1.00 0.00 H new ATOM 755 N LYS A 48 44.326 38.754 32.400 1.00 0.00 N ATOM 756 CA LYS A 48 43.992 37.848 31.319 1.00 0.00 C ATOM 757 C LYS A 48 44.707 38.234 30.023 1.00 0.00 C ATOM 758 O LYS A 48 44.632 39.389 29.611 1.00 0.00 O ATOM 759 CB LYS A 48 42.481 37.809 31.118 1.00 0.00 C ATOM 760 CG LYS A 48 42.055 36.680 30.184 1.00 0.00 C ATOM 761 CD LYS A 48 40.545 36.583 29.980 1.00 0.00 C ATOM 762 CE LYS A 48 39.815 36.170 31.255 1.00 0.00 C ATOM 763 NZ LYS A 48 38.360 36.130 31.045 1.00 0.00 N ATOM 0 H LYS A 48 43.652 39.512 32.507 1.00 0.00 H new ATOM 0 HA LYS A 48 44.335 36.850 31.592 1.00 0.00 H new ATOM 0 HB2 LYS A 48 41.990 37.685 32.083 1.00 0.00 H new ATOM 0 HB3 LYS A 48 42.145 38.762 30.710 1.00 0.00 H new ATOM 0 HG2 LYS A 48 42.534 36.822 29.215 1.00 0.00 H new ATOM 0 HG3 LYS A 48 42.419 35.734 30.584 1.00 0.00 H new ATOM 0 HD2 LYS A 48 40.164 37.546 29.641 1.00 0.00 H new ATOM 0 HD3 LYS A 48 40.332 35.861 29.192 1.00 0.00 H new ATOM 0 HE2 LYS A 48 40.166 35.189 31.577 1.00 0.00 H new ATOM 0 HE3 LYS A 48 40.050 36.871 32.056 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 37.889 35.846 31.928 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 38.024 37.072 30.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 38.136 35.443 30.297 1.00 0.00 H new ATOM 777 N GLN A 49 45.360 37.288 29.352 1.00 0.00 N ATOM 778 CA GLN A 49 45.939 37.495 28.040 1.00 0.00 C ATOM 779 C GLN A 49 44.864 37.428 26.953 1.00 0.00 C ATOM 780 O GLN A 49 44.081 36.481 26.924 1.00 0.00 O ATOM 781 CB GLN A 49 47.056 36.480 27.817 1.00 0.00 C ATOM 782 CG GLN A 49 47.826 36.708 26.519 1.00 0.00 C ATOM 783 CD GLN A 49 49.092 35.851 26.465 1.00 0.00 C ATOM 784 OE1 GLN A 49 50.131 36.207 27.016 1.00 0.00 O ATOM 785 NE2 GLN A 49 49.086 34.704 25.793 1.00 0.00 N ATOM 0 H GLN A 49 45.500 36.345 29.715 1.00 0.00 H new ATOM 0 HA GLN A 49 46.373 38.493 27.983 1.00 0.00 H new ATOM 0 HB2 GLN A 49 47.750 36.524 28.656 1.00 0.00 H new ATOM 0 HB3 GLN A 49 46.630 35.477 27.808 1.00 0.00 H new ATOM 0 HG2 GLN A 49 47.187 36.471 25.668 1.00 0.00 H new ATOM 0 HG3 GLN A 49 48.093 37.761 26.433 1.00 0.00 H new ATOM 0 HE21 GLN A 49 48.234 34.390 25.328 1.00 0.00 H new ATOM 0 HE22 GLN A 49 49.933 34.138 25.742 1.00 0.00 H new ATOM 794 N LEU A 50 44.830 38.409 26.055 1.00 0.00 N ATOM 795 CA LEU A 50 43.885 38.473 24.958 1.00 0.00 C ATOM 796 C LEU A 50 44.528 37.953 23.671 1.00 0.00 C ATOM 797 O LEU A 50 45.552 38.471 23.235 1.00 0.00 O ATOM 798 CB LEU A 50 43.341 39.889 24.795 1.00 0.00 C ATOM 799 CG LEU A 50 42.732 40.526 26.040 1.00 0.00 C ATOM 800 CD1 LEU A 50 42.167 41.893 25.664 1.00 0.00 C ATOM 801 CD2 LEU A 50 41.610 39.699 26.660 1.00 0.00 C ATOM 0 H LEU A 50 45.477 39.197 26.076 1.00 0.00 H new ATOM 0 HA LEU A 50 43.036 37.828 25.185 1.00 0.00 H new ATOM 0 HB2 LEU A 50 44.151 40.529 24.445 1.00 0.00 H new ATOM 0 HB3 LEU A 50 42.583 39.876 24.012 1.00 0.00 H new ATOM 0 HG LEU A 50 43.529 40.598 26.780 1.00 0.00 H new ATOM 0 HD11 LEU A 50 41.728 42.360 26.546 1.00 0.00 H new ATOM 0 HD12 LEU A 50 42.968 42.524 25.279 1.00 0.00 H new ATOM 0 HD13 LEU A 50 41.401 41.772 24.898 1.00 0.00 H new ATOM 0 HD21 LEU A 50 41.224 40.212 27.541 1.00 0.00 H new ATOM 0 HD22 LEU A 50 40.808 39.572 25.933 1.00 0.00 H new ATOM 0 HD23 LEU A 50 41.996 38.722 26.950 1.00 0.00 H new ATOM 813 N GLU A 51 43.935 36.927 23.066 1.00 0.00 N ATOM 814 CA GLU A 51 44.457 36.238 21.903 1.00 0.00 C ATOM 815 C GLU A 51 43.812 36.734 20.607 1.00 0.00 C ATOM 816 O GLU A 51 42.595 36.890 20.538 1.00 0.00 O ATOM 817 CB GLU A 51 44.259 34.734 22.070 1.00 0.00 C ATOM 818 CG GLU A 51 44.876 34.104 23.316 1.00 0.00 C ATOM 819 CD GLU A 51 46.403 34.027 23.319 1.00 0.00 C ATOM 820 OE1 GLU A 51 47.060 34.345 22.304 1.00 0.00 O ATOM 821 OE2 GLU A 51 46.978 33.599 24.345 1.00 0.00 O ATOM 0 H GLU A 51 43.046 36.544 23.388 1.00 0.00 H new ATOM 0 HA GLU A 51 45.522 36.455 21.827 1.00 0.00 H new ATOM 0 HB2 GLU A 51 43.189 34.529 22.077 1.00 0.00 H new ATOM 0 HB3 GLU A 51 44.673 34.235 21.194 1.00 0.00 H new ATOM 0 HG2 GLU A 51 44.555 34.674 24.188 1.00 0.00 H new ATOM 0 HG3 GLU A 51 44.477 33.096 23.429 1.00 0.00 H new ATOM 828 N ASP A 52 44.609 36.940 19.562 1.00 0.00 N ATOM 829 CA ASP A 52 44.221 37.423 18.252 1.00 0.00 C ATOM 830 C ASP A 52 42.953 36.799 17.666 1.00 0.00 C ATOM 831 O ASP A 52 42.131 37.504 17.084 1.00 0.00 O ATOM 832 CB ASP A 52 45.349 37.114 17.272 1.00 0.00 C ATOM 833 CG ASP A 52 46.627 37.938 17.443 1.00 0.00 C ATOM 834 OD1 ASP A 52 47.217 37.903 18.544 1.00 0.00 O ATOM 835 OD2 ASP A 52 47.102 38.519 16.443 1.00 0.00 O ATOM 0 H ASP A 52 45.611 36.759 19.619 1.00 0.00 H new ATOM 0 HA ASP A 52 44.020 38.486 18.389 1.00 0.00 H new ATOM 0 HB2 ASP A 52 45.605 36.059 17.364 1.00 0.00 H new ATOM 0 HB3 ASP A 52 44.976 37.264 16.259 1.00 0.00 H new ATOM 840 N GLY A 53 42.792 35.487 17.811 1.00 0.00 N ATOM 841 CA GLY A 53 41.712 34.693 17.259 1.00 0.00 C ATOM 842 C GLY A 53 40.373 34.780 17.993 1.00 0.00 C ATOM 843 O GLY A 53 39.547 33.890 17.806 1.00 0.00 O ATOM 0 H GLY A 53 43.451 34.923 18.348 1.00 0.00 H new ATOM 0 HA2 GLY A 53 41.557 34.997 16.224 1.00 0.00 H new ATOM 0 HA3 GLY A 53 42.027 33.650 17.241 1.00 0.00 H new ATOM 847 N ARG A 54 40.145 35.793 18.824 1.00 0.00 N ATOM 848 CA ARG A 54 38.880 36.098 19.460 1.00 0.00 C ATOM 849 C ARG A 54 38.345 37.466 19.035 1.00 0.00 C ATOM 850 O ARG A 54 39.099 38.342 18.616 1.00 0.00 O ATOM 851 CB ARG A 54 39.029 36.044 20.977 1.00 0.00 C ATOM 852 CG ARG A 54 38.898 34.670 21.630 1.00 0.00 C ATOM 853 CD ARG A 54 40.132 33.779 21.515 1.00 0.00 C ATOM 854 NE ARG A 54 40.094 32.697 22.498 1.00 0.00 N ATOM 855 CZ ARG A 54 41.027 31.762 22.725 1.00 0.00 C ATOM 856 NH1 ARG A 54 42.144 31.644 21.996 1.00 0.00 N ATOM 857 NH2 ARG A 54 40.858 30.871 23.712 1.00 0.00 N ATOM 0 H ARG A 54 40.879 36.453 19.081 1.00 0.00 H new ATOM 0 HA ARG A 54 38.160 35.346 19.138 1.00 0.00 H new ATOM 0 HB2 ARG A 54 40.005 36.453 21.238 1.00 0.00 H new ATOM 0 HB3 ARG A 54 38.280 36.702 21.416 1.00 0.00 H new ATOM 0 HG2 ARG A 54 38.665 34.807 22.686 1.00 0.00 H new ATOM 0 HG3 ARG A 54 38.051 34.151 21.182 1.00 0.00 H new ATOM 0 HD2 ARG A 54 40.189 33.360 20.510 1.00 0.00 H new ATOM 0 HD3 ARG A 54 41.031 34.377 21.663 1.00 0.00 H new ATOM 0 HE ARG A 54 39.258 32.648 23.080 1.00 0.00 H new ATOM 0 HH11 ARG A 54 42.318 32.286 21.223 1.00 0.00 H new ATOM 0 HH12 ARG A 54 42.820 30.912 22.214 1.00 0.00 H new ATOM 0 HH21 ARG A 54 40.019 30.904 24.291 1.00 0.00 H new ATOM 0 HH22 ARG A 54 41.569 30.160 23.884 1.00 0.00 H new ATOM 871 N THR A 55 37.041 37.667 19.199 1.00 0.00 N ATOM 872 CA THR A 55 36.393 38.963 19.198 1.00 0.00 C ATOM 873 C THR A 55 36.313 39.557 20.605 1.00 0.00 C ATOM 874 O THR A 55 36.453 38.840 21.593 1.00 0.00 O ATOM 875 CB THR A 55 35.003 38.936 18.567 1.00 0.00 C ATOM 876 OG1 THR A 55 34.076 38.194 19.326 1.00 0.00 O ATOM 877 CG2 THR A 55 34.998 38.363 17.153 1.00 0.00 C ATOM 0 H THR A 55 36.386 36.898 19.341 1.00 0.00 H new ATOM 0 HA THR A 55 37.022 39.602 18.579 1.00 0.00 H new ATOM 0 HB THR A 55 34.707 39.985 18.537 1.00 0.00 H new ATOM 0 HG1 THR A 55 34.235 37.236 19.191 1.00 0.00 H new ATOM 0 HG21 THR A 55 33.981 38.371 16.761 1.00 0.00 H new ATOM 0 HG22 THR A 55 35.639 38.969 16.513 1.00 0.00 H new ATOM 0 HG23 THR A 55 35.370 37.339 17.174 1.00 0.00 H new ATOM 885 N LEU A 56 36.056 40.856 20.730 1.00 0.00 N ATOM 886 CA LEU A 56 35.898 41.492 22.023 1.00 0.00 C ATOM 887 C LEU A 56 34.724 40.920 22.820 1.00 0.00 C ATOM 888 O LEU A 56 34.816 40.782 24.038 1.00 0.00 O ATOM 889 CB LEU A 56 35.769 43.003 21.852 1.00 0.00 C ATOM 890 CG LEU A 56 37.097 43.734 21.686 1.00 0.00 C ATOM 891 CD1 LEU A 56 37.696 43.606 20.288 1.00 0.00 C ATOM 892 CD2 LEU A 56 36.885 45.220 21.965 1.00 0.00 C ATOM 0 H LEU A 56 35.953 41.490 19.938 1.00 0.00 H new ATOM 0 HA LEU A 56 36.794 41.278 22.606 1.00 0.00 H new ATOM 0 HB2 LEU A 56 35.145 43.206 20.981 1.00 0.00 H new ATOM 0 HB3 LEU A 56 35.249 43.411 22.719 1.00 0.00 H new ATOM 0 HG LEU A 56 37.791 43.273 22.388 1.00 0.00 H new ATOM 0 HD11 LEU A 56 38.639 44.151 20.245 1.00 0.00 H new ATOM 0 HD12 LEU A 56 37.874 42.554 20.063 1.00 0.00 H new ATOM 0 HD13 LEU A 56 37.003 44.021 19.556 1.00 0.00 H new ATOM 0 HD21 LEU A 56 37.830 45.751 21.849 1.00 0.00 H new ATOM 0 HD22 LEU A 56 36.155 45.621 21.263 1.00 0.00 H new ATOM 0 HD23 LEU A 56 36.519 45.350 22.983 1.00 0.00 H new ATOM 904 N SER A 57 33.651 40.524 22.143 1.00 0.00 N ATOM 905 CA SER A 57 32.499 39.852 22.710 1.00 0.00 C ATOM 906 C SER A 57 32.824 38.452 23.235 1.00 0.00 C ATOM 907 O SER A 57 32.259 38.043 24.247 1.00 0.00 O ATOM 908 CB SER A 57 31.404 39.758 21.650 1.00 0.00 C ATOM 909 OG SER A 57 30.175 39.416 22.248 1.00 0.00 O ATOM 0 H SER A 57 33.562 40.672 21.138 1.00 0.00 H new ATOM 0 HA SER A 57 32.165 40.442 23.564 1.00 0.00 H new ATOM 0 HB2 SER A 57 31.310 40.710 21.128 1.00 0.00 H new ATOM 0 HB3 SER A 57 31.674 39.011 20.903 1.00 0.00 H new ATOM 0 HG SER A 57 29.480 39.360 21.559 1.00 0.00 H new ATOM 915 N ASP A 58 33.769 37.734 22.635 1.00 0.00 N ATOM 916 CA ASP A 58 34.238 36.461 23.147 1.00 0.00 C ATOM 917 C ASP A 58 34.979 36.585 24.480 1.00 0.00 C ATOM 918 O ASP A 58 35.122 35.594 25.191 1.00 0.00 O ATOM 919 CB ASP A 58 35.119 35.742 22.130 1.00 0.00 C ATOM 920 CG ASP A 58 34.437 35.455 20.791 1.00 0.00 C ATOM 921 OD1 ASP A 58 33.318 34.900 20.770 1.00 0.00 O ATOM 922 OD2 ASP A 58 35.037 35.768 19.739 1.00 0.00 O ATOM 0 H ASP A 58 34.231 38.026 21.774 1.00 0.00 H new ATOM 0 HA ASP A 58 33.341 35.869 23.327 1.00 0.00 H new ATOM 0 HB2 ASP A 58 36.009 36.345 21.948 1.00 0.00 H new ATOM 0 HB3 ASP A 58 35.455 34.799 22.562 1.00 0.00 H new ATOM 927 N TYR A 59 35.410 37.790 24.844 1.00 0.00 N ATOM 928 CA TYR A 59 35.962 38.147 26.136 1.00 0.00 C ATOM 929 C TYR A 59 35.045 39.040 26.973 1.00 0.00 C ATOM 930 O TYR A 59 35.483 39.564 27.994 1.00 0.00 O ATOM 931 CB TYR A 59 37.350 38.751 25.942 1.00 0.00 C ATOM 932 CG TYR A 59 38.430 37.814 25.454 1.00 0.00 C ATOM 933 CD1 TYR A 59 38.795 36.707 26.230 1.00 0.00 C ATOM 934 CD2 TYR A 59 39.143 38.106 24.286 1.00 0.00 C ATOM 935 CE1 TYR A 59 39.854 35.879 25.838 1.00 0.00 C ATOM 936 CE2 TYR A 59 40.233 37.313 23.909 1.00 0.00 C ATOM 937 CZ TYR A 59 40.588 36.187 24.676 1.00 0.00 C ATOM 938 OH TYR A 59 41.638 35.410 24.281 1.00 0.00 O ATOM 0 H TYR A 59 35.379 38.584 24.205 1.00 0.00 H new ATOM 0 HA TYR A 59 36.050 37.233 26.723 1.00 0.00 H new ATOM 0 HB2 TYR A 59 37.268 39.575 25.234 1.00 0.00 H new ATOM 0 HB3 TYR A 59 37.672 39.178 26.892 1.00 0.00 H new ATOM 0 HD1 TYR A 59 38.255 36.490 27.139 1.00 0.00 H new ATOM 0 HD2 TYR A 59 38.851 38.946 23.673 1.00 0.00 H new ATOM 0 HE1 TYR A 59 40.107 35.008 26.424 1.00 0.00 H new ATOM 0 HE2 TYR A 59 40.803 37.566 23.027 1.00 0.00 H new ATOM 0 HH TYR A 59 41.301 34.614 23.820 1.00 0.00 H new ATOM 948 N ASN A 60 33.781 39.237 26.607 1.00 0.00 N ATOM 949 CA ASN A 60 32.825 40.054 27.325 1.00 0.00 C ATOM 950 C ASN A 60 33.283 41.487 27.604 1.00 0.00 C ATOM 951 O ASN A 60 32.929 42.071 28.626 1.00 0.00 O ATOM 952 CB ASN A 60 32.325 39.317 28.565 1.00 0.00 C ATOM 953 CG ASN A 60 31.668 37.969 28.264 1.00 0.00 C ATOM 954 OD1 ASN A 60 32.319 36.927 28.234 1.00 0.00 O ATOM 955 ND2 ASN A 60 30.352 37.927 28.074 1.00 0.00 N ATOM 0 H ASN A 60 33.386 38.812 25.768 1.00 0.00 H new ATOM 0 HA ASN A 60 31.977 40.202 26.656 1.00 0.00 H new ATOM 0 HB2 ASN A 60 33.163 39.158 29.243 1.00 0.00 H new ATOM 0 HB3 ASN A 60 31.608 39.951 29.087 1.00 0.00 H new ATOM 0 HD21 ASN A 60 29.889 37.034 27.905 1.00 0.00 H new ATOM 0 HD22 ASN A 60 29.806 38.788 28.098 1.00 0.00 H new ATOM 962 N ILE A 61 34.103 42.070 26.734 1.00 0.00 N ATOM 963 CA ILE A 61 34.658 43.395 26.912 1.00 0.00 C ATOM 964 C ILE A 61 33.587 44.448 26.621 1.00 0.00 C ATOM 965 O ILE A 61 32.917 44.379 25.592 1.00 0.00 O ATOM 966 CB ILE A 61 35.918 43.575 26.070 1.00 0.00 C ATOM 967 CG1 ILE A 61 37.006 42.598 26.508 1.00 0.00 C ATOM 968 CG2 ILE A 61 36.444 45.005 26.148 1.00 0.00 C ATOM 969 CD1 ILE A 61 38.224 42.530 25.590 1.00 0.00 C ATOM 0 H ILE A 61 34.402 41.619 25.869 1.00 0.00 H new ATOM 0 HA ILE A 61 34.967 43.526 27.949 1.00 0.00 H new ATOM 0 HB ILE A 61 35.648 43.366 25.035 1.00 0.00 H new ATOM 0 HG12 ILE A 61 37.339 42.874 27.508 1.00 0.00 H new ATOM 0 HG13 ILE A 61 36.570 41.602 26.581 1.00 0.00 H new ATOM 0 HG21 ILE A 61 37.342 45.096 25.536 1.00 0.00 H new ATOM 0 HG22 ILE A 61 35.683 45.693 25.780 1.00 0.00 H new ATOM 0 HG23 ILE A 61 36.684 45.249 27.183 1.00 0.00 H new ATOM 0 HD11 ILE A 61 38.939 41.809 25.987 1.00 0.00 H new ATOM 0 HD12 ILE A 61 37.911 42.220 24.593 1.00 0.00 H new ATOM 0 HD13 ILE A 61 38.693 43.512 25.534 1.00 0.00 H new ATOM 981 N GLN A 62 33.434 45.420 27.515 1.00 0.00 N ATOM 982 CA GLN A 62 32.576 46.575 27.345 1.00 0.00 C ATOM 983 C GLN A 62 33.371 47.876 27.224 1.00 0.00 C ATOM 984 O GLN A 62 34.580 47.901 27.449 1.00 0.00 O ATOM 985 CB GLN A 62 31.516 46.622 28.441 1.00 0.00 C ATOM 986 CG GLN A 62 32.050 46.849 29.853 1.00 0.00 C ATOM 987 CD GLN A 62 30.920 47.068 30.862 1.00 0.00 C ATOM 988 OE1 GLN A 62 30.639 48.179 31.308 1.00 0.00 O ATOM 989 NE2 GLN A 62 30.219 46.007 31.249 1.00 0.00 N ATOM 0 H GLN A 62 33.925 45.419 28.409 1.00 0.00 H new ATOM 0 HA GLN A 62 32.052 46.469 26.395 1.00 0.00 H new ATOM 0 HB2 GLN A 62 30.808 47.417 28.206 1.00 0.00 H new ATOM 0 HB3 GLN A 62 30.960 45.685 28.427 1.00 0.00 H new ATOM 0 HG2 GLN A 62 32.647 45.990 30.158 1.00 0.00 H new ATOM 0 HG3 GLN A 62 32.712 47.715 29.856 1.00 0.00 H new ATOM 0 HE21 GLN A 62 30.448 45.083 30.882 1.00 0.00 H new ATOM 0 HE22 GLN A 62 29.452 46.117 31.913 1.00 0.00 H new ATOM 998 N LYS A 63 32.697 48.968 26.878 1.00 0.00 N ATOM 999 CA LYS A 63 33.280 50.286 26.725 1.00 0.00 C ATOM 1000 C LYS A 63 34.008 50.804 27.968 1.00 0.00 C ATOM 1001 O LYS A 63 33.746 50.395 29.097 1.00 0.00 O ATOM 1002 CB LYS A 63 32.217 51.266 26.237 1.00 0.00 C ATOM 1003 CG LYS A 63 31.162 51.618 27.281 1.00 0.00 C ATOM 1004 CD LYS A 63 29.985 52.350 26.640 1.00 0.00 C ATOM 1005 CE LYS A 63 28.992 52.894 27.662 1.00 0.00 C ATOM 1006 NZ LYS A 63 28.418 51.842 28.516 1.00 0.00 N ATOM 0 H LYS A 63 31.694 48.953 26.691 1.00 0.00 H new ATOM 0 HA LYS A 63 34.064 50.196 25.973 1.00 0.00 H new ATOM 0 HB2 LYS A 63 32.707 52.183 25.910 1.00 0.00 H new ATOM 0 HB3 LYS A 63 31.721 50.841 25.365 1.00 0.00 H new ATOM 0 HG2 LYS A 63 30.809 50.709 27.768 1.00 0.00 H new ATOM 0 HG3 LYS A 63 31.606 52.243 28.056 1.00 0.00 H new ATOM 0 HD2 LYS A 63 30.363 53.174 26.035 1.00 0.00 H new ATOM 0 HD3 LYS A 63 29.466 51.670 25.964 1.00 0.00 H new ATOM 0 HE2 LYS A 63 29.491 53.633 28.289 1.00 0.00 H new ATOM 0 HE3 LYS A 63 28.187 53.411 27.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 27.738 52.266 29.179 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 27.931 51.140 27.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 29.178 51.375 29.050 1.00 0.00 H new ATOM 1020 N GLU A 64 34.936 51.728 27.737 1.00 0.00 N ATOM 1021 CA GLU A 64 35.770 52.379 28.726 1.00 0.00 C ATOM 1022 C GLU A 64 36.708 51.443 29.494 1.00 0.00 C ATOM 1023 O GLU A 64 37.185 51.772 30.577 1.00 0.00 O ATOM 1024 CB GLU A 64 34.930 53.294 29.612 1.00 0.00 C ATOM 1025 CG GLU A 64 35.697 54.552 30.009 1.00 0.00 C ATOM 1026 CD GLU A 64 34.877 55.457 30.930 1.00 0.00 C ATOM 1027 OE1 GLU A 64 35.295 55.650 32.093 1.00 0.00 O ATOM 1028 OE2 GLU A 64 33.837 56.000 30.500 1.00 0.00 O ATOM 0 H GLU A 64 35.133 52.059 26.792 1.00 0.00 H new ATOM 0 HA GLU A 64 36.472 53.009 28.180 1.00 0.00 H new ATOM 0 HB2 GLU A 64 34.018 53.575 29.085 1.00 0.00 H new ATOM 0 HB3 GLU A 64 34.626 52.754 30.509 1.00 0.00 H new ATOM 0 HG2 GLU A 64 36.623 54.269 30.510 1.00 0.00 H new ATOM 0 HG3 GLU A 64 35.976 55.105 29.112 1.00 0.00 H new ATOM 1035 N SER A 65 36.992 50.266 28.943 1.00 0.00 N ATOM 1036 CA SER A 65 37.976 49.343 29.472 1.00 0.00 C ATOM 1037 C SER A 65 39.402 49.856 29.253 1.00 0.00 C ATOM 1038 O SER A 65 39.717 50.315 28.159 1.00 0.00 O ATOM 1039 CB SER A 65 37.843 47.967 28.827 1.00 0.00 C ATOM 1040 OG SER A 65 36.601 47.372 29.130 1.00 0.00 O ATOM 0 H SER A 65 36.532 49.926 28.099 1.00 0.00 H new ATOM 0 HA SER A 65 37.786 49.263 30.542 1.00 0.00 H new ATOM 0 HB2 SER A 65 37.950 48.059 27.746 1.00 0.00 H new ATOM 0 HB3 SER A 65 38.651 47.322 29.173 1.00 0.00 H new ATOM 0 HG SER A 65 35.936 47.646 28.464 1.00 0.00 H new ATOM 1046 N THR A 66 40.270 49.701 30.248 1.00 0.00 N ATOM 1047 CA THR A 66 41.695 49.944 30.149 1.00 0.00 C ATOM 1048 C THR A 66 42.450 48.614 30.136 1.00 0.00 C ATOM 1049 O THR A 66 42.193 47.751 30.973 1.00 0.00 O ATOM 1050 CB THR A 66 42.208 50.840 31.273 1.00 0.00 C ATOM 1051 OG1 THR A 66 41.525 52.074 31.294 1.00 0.00 O ATOM 1052 CG2 THR A 66 43.686 51.187 31.121 1.00 0.00 C ATOM 0 H THR A 66 39.984 49.391 31.177 1.00 0.00 H new ATOM 0 HA THR A 66 41.876 50.473 29.213 1.00 0.00 H new ATOM 0 HB THR A 66 42.043 50.267 32.186 1.00 0.00 H new ATOM 0 HG1 THR A 66 41.872 52.628 32.024 1.00 0.00 H new ATOM 0 HG21 THR A 66 43.997 51.826 31.948 1.00 0.00 H new ATOM 0 HG22 THR A 66 44.277 50.271 31.128 1.00 0.00 H new ATOM 0 HG23 THR A 66 43.841 51.712 30.179 1.00 0.00 H new ATOM 1060 N LEU A 67 43.391 48.437 29.213 1.00 0.00 N ATOM 1061 CA LEU A 67 44.238 47.268 29.092 1.00 0.00 C ATOM 1062 C LEU A 67 45.695 47.649 28.821 1.00 0.00 C ATOM 1063 O LEU A 67 45.989 48.778 28.435 1.00 0.00 O ATOM 1064 CB LEU A 67 43.628 46.301 28.082 1.00 0.00 C ATOM 1065 CG LEU A 67 43.694 46.704 26.611 1.00 0.00 C ATOM 1066 CD1 LEU A 67 44.987 46.253 25.936 1.00 0.00 C ATOM 1067 CD2 LEU A 67 42.555 46.053 25.832 1.00 0.00 C ATOM 0 H LEU A 67 43.588 49.139 28.500 1.00 0.00 H new ATOM 0 HA LEU A 67 44.279 46.737 30.043 1.00 0.00 H new ATOM 0 HB2 LEU A 67 44.126 45.337 28.192 1.00 0.00 H new ATOM 0 HB3 LEU A 67 42.581 46.151 28.346 1.00 0.00 H new ATOM 0 HG LEU A 67 43.631 47.792 26.599 1.00 0.00 H new ATOM 0 HD11 LEU A 67 44.981 46.566 24.892 1.00 0.00 H new ATOM 0 HD12 LEU A 67 45.839 46.704 26.445 1.00 0.00 H new ATOM 0 HD13 LEU A 67 45.065 45.167 25.989 1.00 0.00 H new ATOM 0 HD21 LEU A 67 42.615 46.349 24.785 1.00 0.00 H new ATOM 0 HD22 LEU A 67 42.636 44.969 25.908 1.00 0.00 H new ATOM 0 HD23 LEU A 67 41.600 46.375 26.246 1.00 0.00 H new ATOM 1079 N HIS A 68 46.620 46.713 29.019 1.00 0.00 N ATOM 1080 CA HIS A 68 48.049 46.947 28.989 1.00 0.00 C ATOM 1081 C HIS A 68 48.737 46.181 27.856 1.00 0.00 C ATOM 1082 O HIS A 68 48.304 45.093 27.482 1.00 0.00 O ATOM 1083 CB HIS A 68 48.645 46.596 30.349 1.00 0.00 C ATOM 1084 CG HIS A 68 48.041 47.384 31.479 1.00 0.00 C ATOM 1085 ND1 HIS A 68 48.551 48.566 32.012 1.00 0.00 N ATOM 1086 CD2 HIS A 68 46.865 47.083 32.118 1.00 0.00 C ATOM 1087 CE1 HIS A 68 47.670 48.968 32.931 1.00 0.00 C ATOM 1088 NE2 HIS A 68 46.646 48.105 33.022 1.00 0.00 N ATOM 0 H HIS A 68 46.380 45.740 29.211 1.00 0.00 H new ATOM 0 HA HIS A 68 48.223 48.004 28.785 1.00 0.00 H new ATOM 0 HB2 HIS A 68 48.501 45.532 30.538 1.00 0.00 H new ATOM 0 HB3 HIS A 68 49.720 46.773 30.324 1.00 0.00 H new ATOM 0 HD2 HIS A 68 46.237 46.221 31.949 1.00 0.00 H new ATOM 0 HE1 HIS A 68 47.768 49.867 33.522 1.00 0.00 H new ATOM 0 HE2 HIS A 68 45.846 48.189 33.649 1.00 0.00 H new ATOM 1096 N LEU A 69 49.833 46.732 27.341 1.00 0.00 N ATOM 1097 CA LEU A 69 50.683 46.135 26.332 1.00 0.00 C ATOM 1098 C LEU A 69 52.058 45.796 26.912 1.00 0.00 C ATOM 1099 O LEU A 69 52.668 46.615 27.597 1.00 0.00 O ATOM 1100 CB LEU A 69 50.764 47.083 25.139 1.00 0.00 C ATOM 1101 CG LEU A 69 51.757 46.699 24.045 1.00 0.00 C ATOM 1102 CD1 LEU A 69 51.368 45.433 23.287 1.00 0.00 C ATOM 1103 CD2 LEU A 69 51.868 47.841 23.040 1.00 0.00 C ATOM 0 H LEU A 69 50.163 47.652 27.635 1.00 0.00 H new ATOM 0 HA LEU A 69 50.259 45.191 25.990 1.00 0.00 H new ATOM 0 HB2 LEU A 69 49.773 47.158 24.692 1.00 0.00 H new ATOM 0 HB3 LEU A 69 51.024 48.076 25.506 1.00 0.00 H new ATOM 0 HG LEU A 69 52.706 46.505 24.545 1.00 0.00 H new ATOM 0 HD11 LEU A 69 52.118 45.220 22.525 1.00 0.00 H new ATOM 0 HD12 LEU A 69 51.309 44.596 23.983 1.00 0.00 H new ATOM 0 HD13 LEU A 69 50.398 45.577 22.811 1.00 0.00 H new ATOM 0 HD21 LEU A 69 52.577 47.569 22.258 1.00 0.00 H new ATOM 0 HD22 LEU A 69 50.891 48.030 22.595 1.00 0.00 H new ATOM 0 HD23 LEU A 69 52.216 48.740 23.548 1.00 0.00 H new ATOM 1115 N VAL A 70 52.558 44.606 26.591 1.00 0.00 N ATOM 1116 CA VAL A 70 53.866 44.088 26.941 1.00 0.00 C ATOM 1117 C VAL A 70 54.507 43.501 25.681 1.00 0.00 C ATOM 1118 O VAL A 70 53.794 43.086 24.771 1.00 0.00 O ATOM 1119 CB VAL A 70 53.737 43.065 28.065 1.00 0.00 C ATOM 1120 CG1 VAL A 70 55.090 42.601 28.595 1.00 0.00 C ATOM 1121 CG2 VAL A 70 52.974 43.596 29.276 1.00 0.00 C ATOM 0 H VAL A 70 52.019 43.937 26.042 1.00 0.00 H new ATOM 0 HA VAL A 70 54.513 44.882 27.314 1.00 0.00 H new ATOM 0 HB VAL A 70 53.194 42.242 27.600 1.00 0.00 H new ATOM 0 HG11 VAL A 70 54.938 41.874 29.393 1.00 0.00 H new ATOM 0 HG12 VAL A 70 55.658 42.140 27.787 1.00 0.00 H new ATOM 0 HG13 VAL A 70 55.641 43.457 28.984 1.00 0.00 H new ATOM 0 HG21 VAL A 70 52.917 42.820 30.039 1.00 0.00 H new ATOM 0 HG22 VAL A 70 53.493 44.465 29.680 1.00 0.00 H new ATOM 0 HG23 VAL A 70 51.966 43.882 28.974 1.00 0.00 H new