USER MOD reduce.3.24.130724 H: found=0, std=0, add=570, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 571 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 25 ASN : amide:sc= -1.96 K(o=-3.2,f=-8.9!) USER MOD Set 1.2: A 29 LYS NZ :NH3+ 172:sc= -1.24 (180deg=-0.223) USER MOD Set 2.1: A 7 THR OG1 : rot 129:sc= 0.306 USER MOD Set 2.2: A 9 THR OG1 : rot -150:sc= 0.193 USER MOD Single : A 1 MET CE :methyl 152:sc= 0 (180deg=-0.00638) USER MOD Single : A 1 MET N :NH3+ 160:sc= 0.678 (180deg=-0.387) USER MOD Single : A 2 GLN : amide:sc= -0.919! K(o=-0.92!,f=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ -167:sc=-0.00601 (180deg=-0.217) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot -77:sc= 2.08 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.549 USER MOD Single : A 27 LYS NZ :NH3+ -117:sc= 0.934 (180deg=-0.706) USER MOD Single : A 31 GLN : amide:sc= -2.17! K(o=-2.2!,f=-0.78) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= -0.126 X(o=-0.13,f=-0.13) USER MOD Single : A 41 GLN : amide:sc= -2.38 K(o=-2.4,f=-6.7!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= -0.726 K(o=-0.73,f=-0.0035) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0.0133 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 180:sc= 0.0347 USER MOD Single : A 60 ASN : amide:sc= -4.53! K(o=-4.5!,f=-1) USER MOD Single : A 62 GLN : amide:sc= -0.16 X(o=-0.16,f=-0.16) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 THR OG1 : rot 33:sc= 0.153 USER MOD Single : A 68 HIS : no HD1:sc= 0 X(o=0,f=-0.00014) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 32.324 31.889 2.480 1.00 0.00 N ATOM 2 CA MET A 1 32.077 33.041 3.391 1.00 0.00 C ATOM 3 C MET A 1 32.891 32.858 4.665 1.00 0.00 C ATOM 4 O MET A 1 33.120 31.733 5.111 1.00 0.00 O ATOM 5 CB MET A 1 30.584 33.120 3.726 1.00 0.00 C ATOM 6 CG MET A 1 30.073 31.740 4.151 1.00 0.00 C ATOM 7 SD MET A 1 28.281 31.817 4.421 1.00 0.00 S ATOM 8 CE MET A 1 28.308 32.067 6.215 1.00 0.00 C ATOM 0 H1 MET A 1 31.551 31.822 1.788 1.00 0.00 H new ATOM 0 H2 MET A 1 33.225 32.029 1.980 1.00 0.00 H new ATOM 0 H3 MET A 1 32.369 31.011 3.035 1.00 0.00 H new ATOM 0 HA MET A 1 32.379 33.968 2.903 1.00 0.00 H new ATOM 0 HB2 MET A 1 30.419 33.841 4.527 1.00 0.00 H new ATOM 0 HB3 MET A 1 30.026 33.473 2.859 1.00 0.00 H new ATOM 0 HG2 MET A 1 30.305 31.002 3.383 1.00 0.00 H new ATOM 0 HG3 MET A 1 30.576 31.419 5.063 1.00 0.00 H new ATOM 0 HE1 MET A 1 27.417 32.616 6.519 1.00 0.00 H new ATOM 0 HE2 MET A 1 28.327 31.100 6.717 1.00 0.00 H new ATOM 0 HE3 MET A 1 29.196 32.636 6.490 1.00 0.00 H new ATOM 20 N GLN A 2 33.321 33.972 5.258 1.00 0.00 N ATOM 21 CA GLN A 2 34.108 33.932 6.488 1.00 0.00 C ATOM 22 C GLN A 2 33.324 34.548 7.645 1.00 0.00 C ATOM 23 O GLN A 2 32.397 35.332 7.437 1.00 0.00 O ATOM 24 CB GLN A 2 35.406 34.719 6.286 1.00 0.00 C ATOM 25 CG GLN A 2 36.250 34.051 5.199 1.00 0.00 C ATOM 26 CD GLN A 2 37.439 34.939 4.842 1.00 0.00 C ATOM 27 OE1 GLN A 2 38.137 34.680 3.861 1.00 0.00 O ATOM 28 NE2 GLN A 2 37.713 35.976 5.586 1.00 0.00 N ATOM 0 H GLN A 2 33.137 34.912 4.906 1.00 0.00 H new ATOM 0 HA GLN A 2 34.333 32.892 6.726 1.00 0.00 H new ATOM 0 HB2 GLN A 2 35.179 35.747 6.003 1.00 0.00 H new ATOM 0 HB3 GLN A 2 35.966 34.761 7.220 1.00 0.00 H new ATOM 0 HG2 GLN A 2 36.602 33.080 5.546 1.00 0.00 H new ATOM 0 HG3 GLN A 2 35.641 33.871 4.313 1.00 0.00 H new ATOM 0 HE21 GLN A 2 37.133 36.189 6.398 1.00 0.00 H new ATOM 0 HE22 GLN A 2 38.507 36.574 5.355 1.00 0.00 H new ATOM 37 N ILE A 3 33.724 34.203 8.866 1.00 0.00 N ATOM 38 CA ILE A 3 33.079 34.743 10.063 1.00 0.00 C ATOM 39 C ILE A 3 34.035 34.683 11.240 1.00 0.00 C ATOM 40 O ILE A 3 35.114 34.099 11.151 1.00 0.00 O ATOM 41 CB ILE A 3 31.783 33.993 10.406 1.00 0.00 C ATOM 42 CG1 ILE A 3 32.056 32.473 10.499 1.00 0.00 C ATOM 43 CG2 ILE A 3 30.715 34.291 9.340 1.00 0.00 C ATOM 44 CD1 ILE A 3 30.768 31.684 10.240 1.00 0.00 C ATOM 0 H ILE A 3 34.489 33.555 9.054 1.00 0.00 H new ATOM 0 HA ILE A 3 32.816 35.780 9.854 1.00 0.00 H new ATOM 0 HB ILE A 3 31.415 34.333 11.374 1.00 0.00 H new ATOM 0 HG12 ILE A 3 32.817 32.188 9.773 1.00 0.00 H new ATOM 0 HG13 ILE A 3 32.449 32.227 11.485 1.00 0.00 H new ATOM 0 HG21 ILE A 3 29.797 33.758 9.586 1.00 0.00 H new ATOM 0 HG22 ILE A 3 30.516 35.362 9.314 1.00 0.00 H new ATOM 0 HG23 ILE A 3 31.074 33.964 8.364 1.00 0.00 H new ATOM 0 HD11 ILE A 3 30.975 30.616 10.309 1.00 0.00 H new ATOM 0 HD12 ILE A 3 30.019 31.957 10.983 1.00 0.00 H new ATOM 0 HD13 ILE A 3 30.393 31.917 9.244 1.00 0.00 H new ATOM 56 N PHE A 4 33.629 35.296 12.345 1.00 0.00 N ATOM 57 CA PHE A 4 34.451 35.329 13.554 1.00 0.00 C ATOM 58 C PHE A 4 33.762 34.589 14.691 1.00 0.00 C ATOM 59 O PHE A 4 32.543 34.666 14.845 1.00 0.00 O ATOM 60 CB PHE A 4 34.687 36.781 13.972 1.00 0.00 C ATOM 61 CG PHE A 4 35.290 37.555 12.823 1.00 0.00 C ATOM 62 CD1 PHE A 4 34.463 38.074 11.820 1.00 0.00 C ATOM 63 CD2 PHE A 4 36.673 37.763 12.768 1.00 0.00 C ATOM 64 CE1 PHE A 4 35.020 38.801 10.760 1.00 0.00 C ATOM 65 CE2 PHE A 4 37.230 38.489 11.709 1.00 0.00 C ATOM 66 CZ PHE A 4 36.403 39.009 10.705 1.00 0.00 C ATOM 0 H PHE A 4 32.735 35.778 12.432 1.00 0.00 H new ATOM 0 HA PHE A 4 35.402 34.842 13.340 1.00 0.00 H new ATOM 0 HB2 PHE A 4 33.746 37.239 14.276 1.00 0.00 H new ATOM 0 HB3 PHE A 4 35.352 36.817 14.835 1.00 0.00 H new ATOM 0 HD1 PHE A 4 33.396 37.914 11.863 1.00 0.00 H new ATOM 0 HD2 PHE A 4 37.310 37.363 13.543 1.00 0.00 H new ATOM 0 HE1 PHE A 4 34.382 39.201 9.985 1.00 0.00 H new ATOM 0 HE2 PHE A 4 38.297 38.648 11.666 1.00 0.00 H new ATOM 0 HZ PHE A 4 36.833 39.570 9.888 1.00 0.00 H new ATOM 76 N VAL A 5 34.556 33.890 15.504 1.00 0.00 N ATOM 77 CA VAL A 5 34.025 33.154 16.649 1.00 0.00 C ATOM 78 C VAL A 5 34.603 33.736 17.928 1.00 0.00 C ATOM 79 O VAL A 5 35.812 33.938 18.049 1.00 0.00 O ATOM 80 CB VAL A 5 34.377 31.666 16.532 1.00 0.00 C ATOM 81 CG1 VAL A 5 34.137 30.964 17.876 1.00 0.00 C ATOM 82 CG2 VAL A 5 33.479 31.028 15.469 1.00 0.00 C ATOM 0 H VAL A 5 35.567 33.819 15.390 1.00 0.00 H new ATOM 0 HA VAL A 5 32.939 33.247 16.669 1.00 0.00 H new ATOM 0 HB VAL A 5 35.426 31.562 16.254 1.00 0.00 H new ATOM 0 HG11 VAL A 5 34.389 29.908 17.785 1.00 0.00 H new ATOM 0 HG12 VAL A 5 34.763 31.422 18.642 1.00 0.00 H new ATOM 0 HG13 VAL A 5 33.088 31.064 18.156 1.00 0.00 H new ATOM 0 HG21 VAL A 5 33.720 29.969 15.377 1.00 0.00 H new ATOM 0 HG22 VAL A 5 32.435 31.138 15.761 1.00 0.00 H new ATOM 0 HG23 VAL A 5 33.642 31.522 14.511 1.00 0.00 H new ATOM 92 N LYS A 6 33.717 34.019 18.870 1.00 0.00 N ATOM 93 CA LYS A 6 34.108 34.603 20.150 1.00 0.00 C ATOM 94 C LYS A 6 33.970 33.577 21.272 1.00 0.00 C ATOM 95 O LYS A 6 32.938 32.918 21.393 1.00 0.00 O ATOM 96 CB LYS A 6 33.199 35.801 20.435 1.00 0.00 C ATOM 97 CG LYS A 6 33.846 36.714 21.471 1.00 0.00 C ATOM 98 CD LYS A 6 32.940 37.925 21.699 1.00 0.00 C ATOM 99 CE LYS A 6 33.584 38.874 22.710 1.00 0.00 C ATOM 100 NZ LYS A 6 32.711 40.067 22.894 1.00 0.00 N ATOM 0 H LYS A 6 32.715 33.854 18.774 1.00 0.00 H new ATOM 0 HA LYS A 6 35.150 34.920 20.101 1.00 0.00 H new ATOM 0 HB2 LYS A 6 33.015 36.355 19.515 1.00 0.00 H new ATOM 0 HB3 LYS A 6 32.231 35.455 20.798 1.00 0.00 H new ATOM 0 HG2 LYS A 6 33.997 36.175 22.406 1.00 0.00 H new ATOM 0 HG3 LYS A 6 34.828 37.038 21.127 1.00 0.00 H new ATOM 0 HD2 LYS A 6 32.770 38.445 20.756 1.00 0.00 H new ATOM 0 HD3 LYS A 6 31.966 37.598 22.063 1.00 0.00 H new ATOM 0 HE2 LYS A 6 33.728 38.365 23.663 1.00 0.00 H new ATOM 0 HE3 LYS A 6 34.570 39.181 22.360 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 33.147 40.714 23.582 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 32.595 40.556 21.984 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 31.780 39.765 23.246 1.00 0.00 H new ATOM 114 N THR A 7 35.012 33.448 22.096 1.00 0.00 N ATOM 115 CA THR A 7 34.990 32.498 23.214 1.00 0.00 C ATOM 116 C THR A 7 34.866 33.241 24.541 1.00 0.00 C ATOM 117 O THR A 7 34.803 34.470 24.577 1.00 0.00 O ATOM 118 CB THR A 7 36.265 31.653 23.220 1.00 0.00 C ATOM 119 OG1 THR A 7 37.352 32.435 23.695 1.00 0.00 O ATOM 120 CG2 THR A 7 36.569 31.163 21.802 1.00 0.00 C ATOM 0 H THR A 7 35.876 33.984 22.013 1.00 0.00 H new ATOM 0 HA THR A 7 34.127 31.844 23.088 1.00 0.00 H new ATOM 0 HB THR A 7 36.122 30.793 23.875 1.00 0.00 H new ATOM 0 HG1 THR A 7 37.817 31.950 24.408 1.00 0.00 H new ATOM 0 HG21 THR A 7 37.478 30.562 21.812 1.00 0.00 H new ATOM 0 HG22 THR A 7 35.738 30.558 21.440 1.00 0.00 H new ATOM 0 HG23 THR A 7 36.708 32.020 21.143 1.00 0.00 H new ATOM 128 N LEU A 8 34.855 32.494 25.637 1.00 0.00 N ATOM 129 CA LEU A 8 34.752 33.107 26.952 1.00 0.00 C ATOM 130 C LEU A 8 36.026 33.883 27.295 1.00 0.00 C ATOM 131 O LEU A 8 35.972 34.900 27.989 1.00 0.00 O ATOM 132 CB LEU A 8 34.490 32.029 28.021 1.00 0.00 C ATOM 133 CG LEU A 8 34.405 32.671 29.416 1.00 0.00 C ATOM 134 CD1 LEU A 8 33.284 33.719 29.441 1.00 0.00 C ATOM 135 CD2 LEU A 8 34.116 31.589 30.465 1.00 0.00 C ATOM 0 H LEU A 8 34.915 31.476 25.642 1.00 0.00 H new ATOM 0 HA LEU A 8 33.917 33.807 26.936 1.00 0.00 H new ATOM 0 HB2 LEU A 8 33.561 31.504 27.798 1.00 0.00 H new ATOM 0 HB3 LEU A 8 35.288 31.287 28.003 1.00 0.00 H new ATOM 0 HG LEU A 8 35.355 33.155 29.644 1.00 0.00 H new ATOM 0 HD11 LEU A 8 33.229 34.170 30.432 1.00 0.00 H new ATOM 0 HD12 LEU A 8 33.492 34.492 28.702 1.00 0.00 H new ATOM 0 HD13 LEU A 8 32.333 33.240 29.207 1.00 0.00 H new ATOM 0 HD21 LEU A 8 34.056 32.046 31.453 1.00 0.00 H new ATOM 0 HD22 LEU A 8 33.169 31.101 30.233 1.00 0.00 H new ATOM 0 HD23 LEU A 8 34.917 30.850 30.455 1.00 0.00 H new ATOM 147 N THR A 9 37.170 33.396 26.824 1.00 0.00 N ATOM 148 CA THR A 9 38.439 34.060 27.113 1.00 0.00 C ATOM 149 C THR A 9 38.588 35.336 26.290 1.00 0.00 C ATOM 150 O THR A 9 39.655 35.951 26.280 1.00 0.00 O ATOM 151 CB THR A 9 39.611 33.120 26.819 1.00 0.00 C ATOM 152 OG1 THR A 9 39.468 32.576 25.516 1.00 0.00 O ATOM 153 CG2 THR A 9 39.635 31.988 27.847 1.00 0.00 C ATOM 0 H THR A 9 37.246 32.557 26.249 1.00 0.00 H new ATOM 0 HA THR A 9 38.445 34.324 28.170 1.00 0.00 H new ATOM 0 HB THR A 9 40.545 33.679 26.878 1.00 0.00 H new ATOM 0 HG1 THR A 9 39.875 31.685 25.487 1.00 0.00 H new ATOM 0 HG21 THR A 9 40.471 31.321 27.634 1.00 0.00 H new ATOM 0 HG22 THR A 9 39.750 32.407 28.847 1.00 0.00 H new ATOM 0 HG23 THR A 9 38.701 31.428 27.794 1.00 0.00 H new ATOM 161 N GLY A 10 37.514 35.747 25.620 1.00 0.00 N ATOM 162 CA GLY A 10 37.550 36.966 24.824 1.00 0.00 C ATOM 163 C GLY A 10 38.463 36.806 23.617 1.00 0.00 C ATOM 164 O GLY A 10 38.968 37.789 23.074 1.00 0.00 O ATOM 0 H GLY A 10 36.619 35.259 25.613 1.00 0.00 H new ATOM 0 HA2 GLY A 10 36.543 37.216 24.491 1.00 0.00 H new ATOM 0 HA3 GLY A 10 37.898 37.796 25.439 1.00 0.00 H new ATOM 168 N LYS A 11 38.662 35.563 23.189 1.00 0.00 N ATOM 169 CA LYS A 11 39.505 35.288 22.030 1.00 0.00 C ATOM 170 C LYS A 11 38.661 35.337 20.764 1.00 0.00 C ATOM 171 O LYS A 11 37.562 34.783 20.724 1.00 0.00 O ATOM 172 CB LYS A 11 40.144 33.900 22.154 1.00 0.00 C ATOM 173 CG LYS A 11 41.198 33.906 23.267 1.00 0.00 C ATOM 174 CD LYS A 11 41.803 32.504 23.402 1.00 0.00 C ATOM 175 CE LYS A 11 42.754 32.464 24.601 1.00 0.00 C ATOM 176 NZ LYS A 11 43.925 33.346 24.337 1.00 0.00 N ATOM 0 H LYS A 11 38.254 34.735 23.624 1.00 0.00 H new ATOM 0 HA LYS A 11 40.292 36.041 21.982 1.00 0.00 H new ATOM 0 HB2 LYS A 11 39.378 33.156 22.371 1.00 0.00 H new ATOM 0 HB3 LYS A 11 40.604 33.616 21.207 1.00 0.00 H new ATOM 0 HG2 LYS A 11 41.979 34.631 23.039 1.00 0.00 H new ATOM 0 HG3 LYS A 11 40.745 34.211 24.210 1.00 0.00 H new ATOM 0 HD2 LYS A 11 41.011 31.767 23.530 1.00 0.00 H new ATOM 0 HD3 LYS A 11 42.340 32.240 22.491 1.00 0.00 H new ATOM 0 HE2 LYS A 11 42.235 32.791 25.502 1.00 0.00 H new ATOM 0 HE3 LYS A 11 43.088 31.442 24.780 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 44.669 33.155 25.038 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 44.293 33.158 23.382 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 43.632 34.342 24.406 1.00 0.00 H new ATOM 190 N THR A 12 39.178 35.995 19.728 1.00 0.00 N ATOM 191 CA THR A 12 38.464 36.101 18.455 1.00 0.00 C ATOM 192 C THR A 12 39.285 35.451 17.354 1.00 0.00 C ATOM 193 O THR A 12 40.448 35.793 17.142 1.00 0.00 O ATOM 194 CB THR A 12 38.218 37.570 18.097 1.00 0.00 C ATOM 195 OG1 THR A 12 37.508 38.200 19.154 1.00 0.00 O ATOM 196 CG2 THR A 12 37.389 37.644 16.807 1.00 0.00 C ATOM 0 H THR A 12 40.085 36.461 19.744 1.00 0.00 H new ATOM 0 HA THR A 12 37.504 35.594 18.553 1.00 0.00 H new ATOM 0 HB THR A 12 39.171 38.077 17.948 1.00 0.00 H new ATOM 0 HG1 THR A 12 37.351 39.141 18.928 1.00 0.00 H new ATOM 0 HG21 THR A 12 37.211 38.688 16.548 1.00 0.00 H new ATOM 0 HG22 THR A 12 37.932 37.157 15.997 1.00 0.00 H new ATOM 0 HG23 THR A 12 36.434 37.140 16.959 1.00 0.00 H new ATOM 204 N ILE A 13 38.666 34.511 16.660 1.00 0.00 N ATOM 205 CA ILE A 13 39.332 33.803 15.568 1.00 0.00 C ATOM 206 C ILE A 13 38.426 33.746 14.356 1.00 0.00 C ATOM 207 O ILE A 13 37.209 33.602 14.478 1.00 0.00 O ATOM 208 CB ILE A 13 39.712 32.389 16.005 1.00 0.00 C ATOM 209 CG1 ILE A 13 38.483 31.690 16.583 1.00 0.00 C ATOM 210 CG2 ILE A 13 40.809 32.459 17.068 1.00 0.00 C ATOM 211 CD1 ILE A 13 38.812 30.225 16.866 1.00 0.00 C ATOM 0 H ILE A 13 37.704 34.217 16.829 1.00 0.00 H new ATOM 0 HA ILE A 13 40.241 34.344 15.305 1.00 0.00 H new ATOM 0 HB ILE A 13 40.079 31.828 15.145 1.00 0.00 H new ATOM 0 HG12 ILE A 13 38.168 32.186 17.501 1.00 0.00 H new ATOM 0 HG13 ILE A 13 37.651 31.757 15.882 1.00 0.00 H new ATOM 0 HG21 ILE A 13 41.079 31.450 17.379 1.00 0.00 H new ATOM 0 HG22 ILE A 13 41.685 32.958 16.654 1.00 0.00 H new ATOM 0 HG23 ILE A 13 40.446 33.019 17.930 1.00 0.00 H new ATOM 0 HD11 ILE A 13 37.934 29.728 17.278 1.00 0.00 H new ATOM 0 HD12 ILE A 13 39.106 29.732 15.939 1.00 0.00 H new ATOM 0 HD13 ILE A 13 39.631 30.168 17.583 1.00 0.00 H new ATOM 223 N THR A 14 39.026 33.867 13.181 1.00 0.00 N ATOM 224 CA THR A 14 38.261 33.835 11.936 1.00 0.00 C ATOM 225 C THR A 14 38.344 32.460 11.288 1.00 0.00 C ATOM 226 O THR A 14 39.400 31.827 11.268 1.00 0.00 O ATOM 227 CB THR A 14 38.783 34.899 10.970 1.00 0.00 C ATOM 228 OG1 THR A 14 38.930 36.129 11.668 1.00 0.00 O ATOM 229 CG2 THR A 14 37.780 35.081 9.824 1.00 0.00 C ATOM 0 H THR A 14 40.032 33.987 13.060 1.00 0.00 H new ATOM 0 HA THR A 14 37.217 34.046 12.169 1.00 0.00 H new ATOM 0 HB THR A 14 39.746 34.588 10.565 1.00 0.00 H new ATOM 0 HG1 THR A 14 38.051 36.546 11.784 1.00 0.00 H new ATOM 0 HG21 THR A 14 38.150 35.839 9.134 1.00 0.00 H new ATOM 0 HG22 THR A 14 37.658 34.136 9.294 1.00 0.00 H new ATOM 0 HG23 THR A 14 36.818 35.397 10.229 1.00 0.00 H new ATOM 237 N LEU A 15 37.205 32.003 10.773 1.00 0.00 N ATOM 238 CA LEU A 15 37.105 30.694 10.129 1.00 0.00 C ATOM 239 C LEU A 15 36.499 30.847 8.731 1.00 0.00 C ATOM 240 O LEU A 15 35.690 31.744 8.487 1.00 0.00 O ATOM 241 CB LEU A 15 36.203 29.779 11.000 1.00 0.00 C ATOM 242 CG LEU A 15 37.000 28.610 11.600 1.00 0.00 C ATOM 243 CD1 LEU A 15 38.032 29.135 12.606 1.00 0.00 C ATOM 244 CD2 LEU A 15 36.024 27.667 12.313 1.00 0.00 C ATOM 0 H LEU A 15 36.329 32.526 10.790 1.00 0.00 H new ATOM 0 HA LEU A 15 38.096 30.251 10.032 1.00 0.00 H new ATOM 0 HB2 LEU A 15 35.755 30.365 11.802 1.00 0.00 H new ATOM 0 HB3 LEU A 15 35.385 29.390 10.394 1.00 0.00 H new ATOM 0 HG LEU A 15 37.525 28.079 10.805 1.00 0.00 H new ATOM 0 HD11 LEU A 15 38.591 28.298 13.025 1.00 0.00 H new ATOM 0 HD12 LEU A 15 38.719 29.814 12.101 1.00 0.00 H new ATOM 0 HD13 LEU A 15 37.520 29.667 13.408 1.00 0.00 H new ATOM 0 HD21 LEU A 15 36.575 26.831 12.744 1.00 0.00 H new ATOM 0 HD22 LEU A 15 35.508 28.209 13.105 1.00 0.00 H new ATOM 0 HD23 LEU A 15 35.294 27.289 11.597 1.00 0.00 H new ATOM 256 N GLU A 16 36.871 29.941 7.828 1.00 0.00 N ATOM 257 CA GLU A 16 36.335 29.953 6.463 1.00 0.00 C ATOM 258 C GLU A 16 35.337 28.811 6.320 1.00 0.00 C ATOM 259 O GLU A 16 35.671 27.654 6.577 1.00 0.00 O ATOM 260 CB GLU A 16 37.461 29.790 5.434 1.00 0.00 C ATOM 261 CG GLU A 16 36.904 30.002 4.022 1.00 0.00 C ATOM 262 CD GLU A 16 38.043 30.003 3.007 1.00 0.00 C ATOM 263 OE1 GLU A 16 38.725 28.996 2.912 1.00 0.00 O ATOM 264 OE2 GLU A 16 38.217 31.010 2.341 1.00 0.00 O ATOM 0 H GLU A 16 37.538 29.192 8.013 1.00 0.00 H new ATOM 0 HA GLU A 16 35.844 30.908 6.279 1.00 0.00 H new ATOM 0 HB2 GLU A 16 38.256 30.508 5.634 1.00 0.00 H new ATOM 0 HB3 GLU A 16 37.901 28.796 5.516 1.00 0.00 H new ATOM 0 HG2 GLU A 16 36.192 29.213 3.781 1.00 0.00 H new ATOM 0 HG3 GLU A 16 36.362 30.946 3.974 1.00 0.00 H new ATOM 271 N VAL A 17 34.109 29.139 5.933 1.00 0.00 N ATOM 272 CA VAL A 17 33.072 28.117 5.791 1.00 0.00 C ATOM 273 C VAL A 17 32.124 28.437 4.641 1.00 0.00 C ATOM 274 O VAL A 17 32.064 29.569 4.159 1.00 0.00 O ATOM 275 CB VAL A 17 32.288 27.970 7.115 1.00 0.00 C ATOM 276 CG1 VAL A 17 33.224 28.199 8.303 1.00 0.00 C ATOM 277 CG2 VAL A 17 31.147 28.987 7.180 1.00 0.00 C ATOM 0 H VAL A 17 33.808 30.089 5.714 1.00 0.00 H new ATOM 0 HA VAL A 17 33.561 27.171 5.559 1.00 0.00 H new ATOM 0 HB VAL A 17 31.874 26.962 7.156 1.00 0.00 H new ATOM 0 HG11 VAL A 17 32.665 28.094 9.233 1.00 0.00 H new ATOM 0 HG12 VAL A 17 34.029 27.464 8.279 1.00 0.00 H new ATOM 0 HG13 VAL A 17 33.646 29.202 8.245 1.00 0.00 H new ATOM 0 HG21 VAL A 17 30.607 28.868 8.119 1.00 0.00 H new ATOM 0 HG22 VAL A 17 31.555 29.996 7.121 1.00 0.00 H new ATOM 0 HG23 VAL A 17 30.465 28.823 6.346 1.00 0.00 H new ATOM 287 N GLU A 18 31.366 27.424 4.226 1.00 0.00 N ATOM 288 CA GLU A 18 30.391 27.575 3.151 1.00 0.00 C ATOM 289 C GLU A 18 29.002 27.737 3.767 1.00 0.00 C ATOM 290 O GLU A 18 28.747 27.237 4.863 1.00 0.00 O ATOM 291 CB GLU A 18 30.423 26.334 2.251 1.00 0.00 C ATOM 292 CG GLU A 18 31.614 26.421 1.295 1.00 0.00 C ATOM 293 CD GLU A 18 31.730 25.133 0.489 1.00 0.00 C ATOM 294 OE1 GLU A 18 30.745 24.417 0.412 1.00 0.00 O ATOM 295 OE2 GLU A 18 32.800 24.881 -0.039 1.00 0.00 O ATOM 0 H GLU A 18 31.410 26.485 4.622 1.00 0.00 H new ATOM 0 HA GLU A 18 30.630 28.452 2.550 1.00 0.00 H new ATOM 0 HB2 GLU A 18 30.498 25.433 2.860 1.00 0.00 H new ATOM 0 HB3 GLU A 18 29.495 26.259 1.685 1.00 0.00 H new ATOM 0 HG2 GLU A 18 31.490 27.270 0.623 1.00 0.00 H new ATOM 0 HG3 GLU A 18 32.531 26.591 1.858 1.00 0.00 H new ATOM 302 N PRO A 19 28.105 28.422 3.110 1.00 0.00 N ATOM 303 CA PRO A 19 26.731 28.644 3.646 1.00 0.00 C ATOM 304 C PRO A 19 25.974 27.331 3.812 1.00 0.00 C ATOM 305 O PRO A 19 24.932 27.281 4.468 1.00 0.00 O ATOM 306 CB PRO A 19 26.066 29.549 2.591 1.00 0.00 C ATOM 307 CG PRO A 19 26.840 29.303 1.337 1.00 0.00 C ATOM 308 CD PRO A 19 28.276 29.048 1.787 1.00 0.00 C ATOM 0 HA PRO A 19 26.738 29.093 4.639 1.00 0.00 H new ATOM 0 HB2 PRO A 19 25.013 29.299 2.462 1.00 0.00 H new ATOM 0 HB3 PRO A 19 26.111 30.598 2.884 1.00 0.00 H new ATOM 0 HG2 PRO A 19 26.442 28.447 0.792 1.00 0.00 H new ATOM 0 HG3 PRO A 19 26.785 30.161 0.667 1.00 0.00 H new ATOM 0 HD2 PRO A 19 28.805 28.392 1.096 1.00 0.00 H new ATOM 0 HD3 PRO A 19 28.849 29.973 1.850 1.00 0.00 H new ATOM 316 N SER A 20 26.493 26.268 3.193 1.00 0.00 N ATOM 317 CA SER A 20 25.853 24.956 3.249 1.00 0.00 C ATOM 318 C SER A 20 26.602 24.010 4.185 1.00 0.00 C ATOM 319 O SER A 20 26.297 22.818 4.238 1.00 0.00 O ATOM 320 CB SER A 20 25.820 24.352 1.845 1.00 0.00 C ATOM 321 OG SER A 20 24.953 25.124 1.023 1.00 0.00 O ATOM 0 H SER A 20 27.355 26.292 2.648 1.00 0.00 H new ATOM 0 HA SER A 20 24.841 25.086 3.633 1.00 0.00 H new ATOM 0 HB2 SER A 20 26.824 24.335 1.420 1.00 0.00 H new ATOM 0 HB3 SER A 20 25.475 23.319 1.889 1.00 0.00 H new ATOM 0 HG SER A 20 24.930 24.741 0.121 1.00 0.00 H new ATOM 327 N ASP A 21 27.574 24.534 4.924 1.00 0.00 N ATOM 328 CA ASP A 21 28.334 23.711 5.851 1.00 0.00 C ATOM 329 C ASP A 21 27.438 23.222 6.980 1.00 0.00 C ATOM 330 O ASP A 21 26.537 23.935 7.421 1.00 0.00 O ATOM 331 CB ASP A 21 29.506 24.532 6.416 1.00 0.00 C ATOM 332 CG ASP A 21 30.685 24.534 5.438 1.00 0.00 C ATOM 333 OD1 ASP A 21 30.648 23.777 4.484 1.00 0.00 O ATOM 334 OD2 ASP A 21 31.614 25.284 5.667 1.00 0.00 O ATOM 0 H ASP A 21 27.851 25.515 4.899 1.00 0.00 H new ATOM 0 HA ASP A 21 28.725 22.841 5.324 1.00 0.00 H new ATOM 0 HB2 ASP A 21 29.182 25.555 6.605 1.00 0.00 H new ATOM 0 HB3 ASP A 21 29.821 24.115 7.373 1.00 0.00 H new ATOM 339 N THR A 22 27.691 22.002 7.449 1.00 0.00 N ATOM 340 CA THR A 22 26.900 21.431 8.535 1.00 0.00 C ATOM 341 C THR A 22 27.501 21.832 9.873 1.00 0.00 C ATOM 342 O THR A 22 28.716 21.975 9.994 1.00 0.00 O ATOM 343 CB THR A 22 26.867 19.905 8.423 1.00 0.00 C ATOM 344 OG1 THR A 22 28.152 19.383 8.728 1.00 0.00 O ATOM 345 CG2 THR A 22 26.471 19.497 7.002 1.00 0.00 C ATOM 0 H THR A 22 28.431 21.395 7.097 1.00 0.00 H new ATOM 0 HA THR A 22 25.881 21.812 8.465 1.00 0.00 H new ATOM 0 HB THR A 22 26.135 19.507 9.125 1.00 0.00 H new ATOM 0 HG1 THR A 22 28.133 18.406 8.659 1.00 0.00 H new ATOM 0 HG21 THR A 22 26.449 18.410 6.928 1.00 0.00 H new ATOM 0 HG22 THR A 22 25.483 19.896 6.771 1.00 0.00 H new ATOM 0 HG23 THR A 22 27.198 19.894 6.294 1.00 0.00 H new ATOM 353 N ILE A 23 26.650 22.003 10.871 1.00 0.00 N ATOM 354 CA ILE A 23 27.133 22.384 12.191 1.00 0.00 C ATOM 355 C ILE A 23 28.270 21.460 12.613 1.00 0.00 C ATOM 356 O ILE A 23 29.117 21.829 13.426 1.00 0.00 O ATOM 357 CB ILE A 23 25.997 22.304 13.213 1.00 0.00 C ATOM 358 CG1 ILE A 23 24.757 23.029 12.676 1.00 0.00 C ATOM 359 CG2 ILE A 23 26.437 22.956 14.524 1.00 0.00 C ATOM 360 CD1 ILE A 23 25.132 24.436 12.192 1.00 0.00 C ATOM 0 H ILE A 23 25.639 21.887 10.798 1.00 0.00 H new ATOM 0 HA ILE A 23 27.499 23.410 12.148 1.00 0.00 H new ATOM 0 HB ILE A 23 25.753 21.256 13.390 1.00 0.00 H new ATOM 0 HG12 ILE A 23 24.321 22.459 11.856 1.00 0.00 H new ATOM 0 HG13 ILE A 23 23.999 23.095 13.457 1.00 0.00 H new ATOM 0 HG21 ILE A 23 25.626 22.897 15.250 1.00 0.00 H new ATOM 0 HG22 ILE A 23 27.311 22.435 14.914 1.00 0.00 H new ATOM 0 HG23 ILE A 23 26.688 24.001 14.344 1.00 0.00 H new ATOM 0 HD11 ILE A 23 24.243 24.940 11.813 1.00 0.00 H new ATOM 0 HD12 ILE A 23 25.547 25.008 13.022 1.00 0.00 H new ATOM 0 HD13 ILE A 23 25.873 24.362 11.396 1.00 0.00 H new ATOM 372 N GLU A 24 28.299 20.271 12.024 1.00 0.00 N ATOM 373 CA GLU A 24 29.345 19.305 12.329 1.00 0.00 C ATOM 374 C GLU A 24 30.658 19.716 11.665 1.00 0.00 C ATOM 375 O GLU A 24 31.667 19.921 12.337 1.00 0.00 O ATOM 376 CB GLU A 24 28.920 17.916 11.847 1.00 0.00 C ATOM 377 CG GLU A 24 29.956 16.880 12.286 1.00 0.00 C ATOM 378 CD GLU A 24 29.475 15.477 11.935 1.00 0.00 C ATOM 379 OE1 GLU A 24 28.331 15.172 12.233 1.00 0.00 O ATOM 380 OE2 GLU A 24 30.257 14.728 11.375 1.00 0.00 O ATOM 0 H GLU A 24 27.615 19.955 11.337 1.00 0.00 H new ATOM 0 HA GLU A 24 29.499 19.277 13.408 1.00 0.00 H new ATOM 0 HB2 GLU A 24 27.942 17.662 12.255 1.00 0.00 H new ATOM 0 HB3 GLU A 24 28.823 17.911 10.761 1.00 0.00 H new ATOM 0 HG2 GLU A 24 30.910 17.079 11.797 1.00 0.00 H new ATOM 0 HG3 GLU A 24 30.126 16.957 13.360 1.00 0.00 H new ATOM 387 N ASN A 25 30.628 19.840 10.344 1.00 0.00 N ATOM 388 CA ASN A 25 31.813 20.237 9.594 1.00 0.00 C ATOM 389 C ASN A 25 32.401 21.526 10.167 1.00 0.00 C ATOM 390 O ASN A 25 33.617 21.675 10.271 1.00 0.00 O ATOM 391 CB ASN A 25 31.437 20.453 8.128 1.00 0.00 C ATOM 392 CG ASN A 25 32.664 20.857 7.320 1.00 0.00 C ATOM 393 OD1 ASN A 25 33.781 20.845 7.837 1.00 0.00 O ATOM 394 ND2 ASN A 25 32.520 21.218 6.074 1.00 0.00 N ATOM 0 H ASN A 25 29.800 19.672 9.772 1.00 0.00 H new ATOM 0 HA ASN A 25 32.560 19.447 9.671 1.00 0.00 H new ATOM 0 HB2 ASN A 25 31.008 19.539 7.717 1.00 0.00 H new ATOM 0 HB3 ASN A 25 30.673 21.226 8.052 1.00 0.00 H new ATOM 0 HD21 ASN A 25 33.335 21.492 5.525 1.00 0.00 H new ATOM 0 HD22 ASN A 25 31.593 21.227 5.649 1.00 0.00 H new ATOM 401 N VAL A 26 31.529 22.462 10.532 1.00 0.00 N ATOM 402 CA VAL A 26 31.988 23.733 11.084 1.00 0.00 C ATOM 403 C VAL A 26 32.726 23.506 12.402 1.00 0.00 C ATOM 404 O VAL A 26 33.780 24.099 12.642 1.00 0.00 O ATOM 405 CB VAL A 26 30.805 24.685 11.294 1.00 0.00 C ATOM 406 CG1 VAL A 26 31.313 25.995 11.891 1.00 0.00 C ATOM 407 CG2 VAL A 26 30.134 24.972 9.944 1.00 0.00 C ATOM 0 H VAL A 26 30.516 22.367 10.457 1.00 0.00 H new ATOM 0 HA VAL A 26 32.678 24.188 10.373 1.00 0.00 H new ATOM 0 HB VAL A 26 30.084 24.227 11.970 1.00 0.00 H new ATOM 0 HG11 VAL A 26 30.475 26.675 12.042 1.00 0.00 H new ATOM 0 HG12 VAL A 26 31.796 25.796 12.848 1.00 0.00 H new ATOM 0 HG13 VAL A 26 32.032 26.451 11.210 1.00 0.00 H new ATOM 0 HG21 VAL A 26 29.293 25.649 10.092 1.00 0.00 H new ATOM 0 HG22 VAL A 26 30.856 25.433 9.270 1.00 0.00 H new ATOM 0 HG23 VAL A 26 29.776 24.038 9.510 1.00 0.00 H new ATOM 417 N LYS A 27 32.184 22.634 13.244 1.00 0.00 N ATOM 418 CA LYS A 27 32.828 22.332 14.515 1.00 0.00 C ATOM 419 C LYS A 27 34.177 21.697 14.242 1.00 0.00 C ATOM 420 O LYS A 27 35.153 21.936 14.951 1.00 0.00 O ATOM 421 CB LYS A 27 31.950 21.386 15.346 1.00 0.00 C ATOM 422 CG LYS A 27 30.874 22.190 16.086 1.00 0.00 C ATOM 423 CD LYS A 27 30.119 21.274 17.054 1.00 0.00 C ATOM 424 CE LYS A 27 29.288 20.258 16.267 1.00 0.00 C ATOM 425 NZ LYS A 27 28.268 19.649 17.162 1.00 0.00 N ATOM 0 H LYS A 27 31.313 22.131 13.073 1.00 0.00 H new ATOM 0 HA LYS A 27 32.966 23.252 15.083 1.00 0.00 H new ATOM 0 HB2 LYS A 27 31.482 20.646 14.697 1.00 0.00 H new ATOM 0 HB3 LYS A 27 32.565 20.839 16.061 1.00 0.00 H new ATOM 0 HG2 LYS A 27 31.333 23.013 16.633 1.00 0.00 H new ATOM 0 HG3 LYS A 27 30.179 22.631 15.371 1.00 0.00 H new ATOM 0 HD2 LYS A 27 30.825 20.755 17.703 1.00 0.00 H new ATOM 0 HD3 LYS A 27 29.470 21.867 17.698 1.00 0.00 H new ATOM 0 HE2 LYS A 27 28.801 20.747 15.423 1.00 0.00 H new ATOM 0 HE3 LYS A 27 29.935 19.483 15.856 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 28.447 18.628 17.249 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 28.322 20.091 18.102 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 27.320 19.801 16.762 1.00 0.00 H new ATOM 439 N ALA A 28 34.220 20.889 13.195 1.00 0.00 N ATOM 440 CA ALA A 28 35.445 20.222 12.802 1.00 0.00 C ATOM 441 C ALA A 28 36.523 21.256 12.483 1.00 0.00 C ATOM 442 O ALA A 28 37.678 21.103 12.879 1.00 0.00 O ATOM 443 CB ALA A 28 35.158 19.358 11.572 1.00 0.00 C ATOM 0 H ALA A 28 33.417 20.680 12.602 1.00 0.00 H new ATOM 0 HA ALA A 28 35.804 19.593 13.616 1.00 0.00 H new ATOM 0 HB1 ALA A 28 36.071 18.849 11.264 1.00 0.00 H new ATOM 0 HB2 ALA A 28 34.395 18.619 11.817 1.00 0.00 H new ATOM 0 HB3 ALA A 28 34.803 19.990 10.758 1.00 0.00 H new ATOM 449 N LYS A 29 36.128 22.317 11.780 1.00 0.00 N ATOM 450 CA LYS A 29 37.066 23.382 11.431 1.00 0.00 C ATOM 451 C LYS A 29 37.615 24.018 12.708 1.00 0.00 C ATOM 452 O LYS A 29 38.799 24.349 12.800 1.00 0.00 O ATOM 453 CB LYS A 29 36.372 24.463 10.589 1.00 0.00 C ATOM 454 CG LYS A 29 35.995 23.906 9.214 1.00 0.00 C ATOM 455 CD LYS A 29 35.299 25.000 8.393 1.00 0.00 C ATOM 456 CE LYS A 29 35.160 24.535 6.941 1.00 0.00 C ATOM 457 NZ LYS A 29 34.282 23.333 6.888 1.00 0.00 N ATOM 0 H LYS A 29 35.176 22.461 11.444 1.00 0.00 H new ATOM 0 HA LYS A 29 37.879 22.949 10.849 1.00 0.00 H new ATOM 0 HB2 LYS A 29 35.478 24.816 11.103 1.00 0.00 H new ATOM 0 HB3 LYS A 29 37.033 25.322 10.472 1.00 0.00 H new ATOM 0 HG2 LYS A 29 36.887 23.558 8.694 1.00 0.00 H new ATOM 0 HG3 LYS A 29 35.335 23.046 9.327 1.00 0.00 H new ATOM 0 HD2 LYS A 29 34.317 25.216 8.813 1.00 0.00 H new ATOM 0 HD3 LYS A 29 35.874 25.925 8.437 1.00 0.00 H new ATOM 0 HE2 LYS A 29 34.739 25.334 6.331 1.00 0.00 H new ATOM 0 HE3 LYS A 29 36.141 24.301 6.527 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 34.076 23.097 5.896 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 34.764 22.531 7.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 33.392 23.531 7.388 1.00 0.00 H new ATOM 471 N ILE A 30 36.737 24.157 13.696 1.00 0.00 N ATOM 472 CA ILE A 30 37.121 24.730 14.971 1.00 0.00 C ATOM 473 C ILE A 30 38.075 23.793 15.705 1.00 0.00 C ATOM 474 O ILE A 30 39.068 24.232 16.275 1.00 0.00 O ATOM 475 CB ILE A 30 35.867 24.984 15.809 1.00 0.00 C ATOM 476 CG1 ILE A 30 35.006 26.042 15.110 1.00 0.00 C ATOM 477 CG2 ILE A 30 36.270 25.486 17.196 1.00 0.00 C ATOM 478 CD1 ILE A 30 33.687 26.232 15.869 1.00 0.00 C ATOM 0 H ILE A 30 35.757 23.880 13.634 1.00 0.00 H new ATOM 0 HA ILE A 30 37.636 25.676 14.803 1.00 0.00 H new ATOM 0 HB ILE A 30 35.301 24.059 15.914 1.00 0.00 H new ATOM 0 HG12 ILE A 30 35.546 26.988 15.061 1.00 0.00 H new ATOM 0 HG13 ILE A 30 34.803 25.737 14.083 1.00 0.00 H new ATOM 0 HG21 ILE A 30 35.375 25.667 17.792 1.00 0.00 H new ATOM 0 HG22 ILE A 30 36.889 24.736 17.689 1.00 0.00 H new ATOM 0 HG23 ILE A 30 36.834 26.414 17.098 1.00 0.00 H new ATOM 0 HD11 ILE A 30 33.082 26.986 15.365 1.00 0.00 H new ATOM 0 HD12 ILE A 30 33.143 25.288 15.895 1.00 0.00 H new ATOM 0 HD13 ILE A 30 33.897 26.558 16.888 1.00 0.00 H new ATOM 490 N GLN A 31 37.769 22.500 15.685 1.00 0.00 N ATOM 491 CA GLN A 31 38.615 21.517 16.356 1.00 0.00 C ATOM 492 C GLN A 31 40.008 21.493 15.736 1.00 0.00 C ATOM 493 O GLN A 31 41.014 21.516 16.442 1.00 0.00 O ATOM 494 CB GLN A 31 37.996 20.122 16.244 1.00 0.00 C ATOM 495 CG GLN A 31 38.727 19.162 17.188 1.00 0.00 C ATOM 496 CD GLN A 31 38.298 17.726 16.917 1.00 0.00 C ATOM 497 OE1 GLN A 31 38.635 16.821 17.682 1.00 0.00 O ATOM 498 NE2 GLN A 31 37.574 17.456 15.865 1.00 0.00 N ATOM 0 H GLN A 31 36.951 22.110 15.217 1.00 0.00 H new ATOM 0 HA GLN A 31 38.694 21.801 17.405 1.00 0.00 H new ATOM 0 HB2 GLN A 31 36.936 20.161 16.497 1.00 0.00 H new ATOM 0 HB3 GLN A 31 38.066 19.763 15.217 1.00 0.00 H new ATOM 0 HG2 GLN A 31 39.804 19.259 17.053 1.00 0.00 H new ATOM 0 HG3 GLN A 31 38.511 19.424 18.224 1.00 0.00 H new ATOM 0 HE21 GLN A 31 37.295 18.205 15.232 1.00 0.00 H new ATOM 0 HE22 GLN A 31 37.287 16.496 15.676 1.00 0.00 H new ATOM 507 N ASP A 32 40.055 21.432 14.415 1.00 0.00 N ATOM 508 CA ASP A 32 41.327 21.386 13.706 1.00 0.00 C ATOM 509 C ASP A 32 42.229 22.565 14.082 1.00 0.00 C ATOM 510 O ASP A 32 43.437 22.394 14.244 1.00 0.00 O ATOM 511 CB ASP A 32 41.079 21.397 12.196 1.00 0.00 C ATOM 512 CG ASP A 32 42.383 21.132 11.450 1.00 0.00 C ATOM 513 OD1 ASP A 32 42.751 19.974 11.334 1.00 0.00 O ATOM 514 OD2 ASP A 32 42.996 22.090 11.007 1.00 0.00 O ATOM 0 H ASP A 32 39.232 21.413 13.813 1.00 0.00 H new ATOM 0 HA ASP A 32 41.835 20.466 13.996 1.00 0.00 H new ATOM 0 HB2 ASP A 32 40.341 20.639 11.935 1.00 0.00 H new ATOM 0 HB3 ASP A 32 40.667 22.360 11.894 1.00 0.00 H new ATOM 519 N LYS A 33 41.651 23.762 14.192 1.00 0.00 N ATOM 520 CA LYS A 33 42.446 24.954 14.513 1.00 0.00 C ATOM 521 C LYS A 33 42.640 25.158 16.022 1.00 0.00 C ATOM 522 O LYS A 33 43.704 25.605 16.451 1.00 0.00 O ATOM 523 CB LYS A 33 41.781 26.194 13.916 1.00 0.00 C ATOM 524 CG LYS A 33 41.746 26.073 12.390 1.00 0.00 C ATOM 525 CD LYS A 33 41.317 27.411 11.780 1.00 0.00 C ATOM 526 CE LYS A 33 41.346 27.312 10.253 1.00 0.00 C ATOM 527 NZ LYS A 33 40.994 28.635 9.661 1.00 0.00 N ATOM 0 H LYS A 33 40.653 23.934 14.067 1.00 0.00 H new ATOM 0 HA LYS A 33 43.434 24.800 14.079 1.00 0.00 H new ATOM 0 HB2 LYS A 33 40.769 26.300 14.306 1.00 0.00 H new ATOM 0 HB3 LYS A 33 42.330 27.089 14.208 1.00 0.00 H new ATOM 0 HG2 LYS A 33 42.729 25.789 12.015 1.00 0.00 H new ATOM 0 HG3 LYS A 33 41.052 25.287 12.093 1.00 0.00 H new ATOM 0 HD2 LYS A 33 40.314 27.672 12.119 1.00 0.00 H new ATOM 0 HD3 LYS A 33 41.983 28.206 12.116 1.00 0.00 H new ATOM 0 HE2 LYS A 33 42.336 27.003 9.917 1.00 0.00 H new ATOM 0 HE3 LYS A 33 40.643 26.551 9.914 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 41.014 28.567 8.623 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 40.041 28.912 9.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 41.682 29.350 9.974 1.00 0.00 H new ATOM 541 N GLU A 34 41.615 24.871 16.827 1.00 0.00 N ATOM 542 CA GLU A 34 41.708 25.078 18.282 1.00 0.00 C ATOM 543 C GLU A 34 42.014 23.782 19.036 1.00 0.00 C ATOM 544 O GLU A 34 42.320 23.812 20.228 1.00 0.00 O ATOM 545 CB GLU A 34 40.396 25.670 18.809 1.00 0.00 C ATOM 546 CG GLU A 34 40.062 26.949 18.037 1.00 0.00 C ATOM 547 CD GLU A 34 41.046 28.056 18.400 1.00 0.00 C ATOM 548 OE1 GLU A 34 41.256 28.271 19.583 1.00 0.00 O ATOM 549 OE2 GLU A 34 41.574 28.674 17.490 1.00 0.00 O ATOM 0 H GLU A 34 40.721 24.499 16.507 1.00 0.00 H new ATOM 0 HA GLU A 34 42.534 25.768 18.456 1.00 0.00 H new ATOM 0 HB2 GLU A 34 39.589 24.946 18.699 1.00 0.00 H new ATOM 0 HB3 GLU A 34 40.486 25.889 19.873 1.00 0.00 H new ATOM 0 HG2 GLU A 34 40.100 26.756 16.965 1.00 0.00 H new ATOM 0 HG3 GLU A 34 39.045 27.266 18.268 1.00 0.00 H new ATOM 556 N GLY A 35 41.968 22.650 18.343 1.00 0.00 N ATOM 557 CA GLY A 35 42.276 21.365 18.971 1.00 0.00 C ATOM 558 C GLY A 35 41.264 20.982 20.053 1.00 0.00 C ATOM 559 O GLY A 35 41.474 20.017 20.790 1.00 0.00 O ATOM 0 H GLY A 35 41.723 22.592 17.355 1.00 0.00 H new ATOM 0 HA2 GLY A 35 42.298 20.587 18.207 1.00 0.00 H new ATOM 0 HA3 GLY A 35 43.273 21.409 19.410 1.00 0.00 H new ATOM 563 N ILE A 36 40.164 21.728 20.149 1.00 0.00 N ATOM 564 CA ILE A 36 39.137 21.440 21.146 1.00 0.00 C ATOM 565 C ILE A 36 38.084 20.471 20.575 1.00 0.00 C ATOM 566 O ILE A 36 37.347 20.843 19.660 1.00 0.00 O ATOM 567 CB ILE A 36 38.453 22.746 21.551 1.00 0.00 C ATOM 568 CG1 ILE A 36 39.517 23.784 21.917 1.00 0.00 C ATOM 569 CG2 ILE A 36 37.559 22.497 22.761 1.00 0.00 C ATOM 570 CD1 ILE A 36 38.847 25.101 22.322 1.00 0.00 C ATOM 0 H ILE A 36 39.963 22.531 19.552 1.00 0.00 H new ATOM 0 HA ILE A 36 39.607 20.975 22.013 1.00 0.00 H new ATOM 0 HB ILE A 36 37.851 23.113 20.720 1.00 0.00 H new ATOM 0 HG12 ILE A 36 40.132 23.413 22.736 1.00 0.00 H new ATOM 0 HG13 ILE A 36 40.182 23.950 21.069 1.00 0.00 H new ATOM 0 HG21 ILE A 36 37.071 23.428 23.050 1.00 0.00 H new ATOM 0 HG22 ILE A 36 36.803 21.754 22.508 1.00 0.00 H new ATOM 0 HG23 ILE A 36 38.164 22.131 23.591 1.00 0.00 H new ATOM 0 HD11 ILE A 36 39.611 25.834 22.581 1.00 0.00 H new ATOM 0 HD12 ILE A 36 38.251 25.477 21.490 1.00 0.00 H new ATOM 0 HD13 ILE A 36 38.201 24.931 23.183 1.00 0.00 H new ATOM 582 N PRO A 37 37.982 19.252 21.076 1.00 0.00 N ATOM 583 CA PRO A 37 36.975 18.269 20.566 1.00 0.00 C ATOM 584 C PRO A 37 35.586 18.903 20.393 1.00 0.00 C ATOM 585 O PRO A 37 35.239 19.849 21.103 1.00 0.00 O ATOM 586 CB PRO A 37 36.959 17.181 21.648 1.00 0.00 C ATOM 587 CG PRO A 37 38.331 17.212 22.241 1.00 0.00 C ATOM 588 CD PRO A 37 38.803 18.669 22.160 1.00 0.00 C ATOM 0 HA PRO A 37 37.231 17.887 19.578 1.00 0.00 H new ATOM 0 HB2 PRO A 37 36.198 17.384 22.401 1.00 0.00 H new ATOM 0 HB3 PRO A 37 36.734 16.203 21.222 1.00 0.00 H new ATOM 0 HG2 PRO A 37 38.316 16.865 23.274 1.00 0.00 H new ATOM 0 HG3 PRO A 37 39.006 16.554 21.694 1.00 0.00 H new ATOM 0 HD2 PRO A 37 38.647 19.192 23.104 1.00 0.00 H new ATOM 0 HD3 PRO A 37 39.867 18.732 21.932 1.00 0.00 H new ATOM 596 N PRO A 38 34.788 18.406 19.475 1.00 0.00 N ATOM 597 CA PRO A 38 33.420 18.953 19.218 1.00 0.00 C ATOM 598 C PRO A 38 32.442 18.618 20.342 1.00 0.00 C ATOM 599 O PRO A 38 31.385 19.235 20.459 1.00 0.00 O ATOM 600 CB PRO A 38 33.014 18.284 17.902 1.00 0.00 C ATOM 601 CG PRO A 38 33.738 16.984 17.921 1.00 0.00 C ATOM 602 CD PRO A 38 35.085 17.270 18.584 1.00 0.00 C ATOM 0 HA PRO A 38 33.410 20.042 19.166 1.00 0.00 H new ATOM 0 HB2 PRO A 38 31.935 18.139 17.844 1.00 0.00 H new ATOM 0 HB3 PRO A 38 33.301 18.888 17.042 1.00 0.00 H new ATOM 0 HG2 PRO A 38 33.179 16.233 18.479 1.00 0.00 H new ATOM 0 HG3 PRO A 38 33.873 16.596 16.911 1.00 0.00 H new ATOM 0 HD2 PRO A 38 35.451 16.407 19.140 1.00 0.00 H new ATOM 0 HD3 PRO A 38 35.849 17.524 17.850 1.00 0.00 H new ATOM 610 N ASP A 39 32.800 17.636 21.160 1.00 0.00 N ATOM 611 CA ASP A 39 31.939 17.231 22.263 1.00 0.00 C ATOM 612 C ASP A 39 32.071 18.198 23.433 1.00 0.00 C ATOM 613 O ASP A 39 31.275 18.157 24.371 1.00 0.00 O ATOM 614 CB ASP A 39 32.304 15.819 22.723 1.00 0.00 C ATOM 615 CG ASP A 39 32.062 14.823 21.593 1.00 0.00 C ATOM 616 OD1 ASP A 39 30.909 14.608 21.258 1.00 0.00 O ATOM 617 OD2 ASP A 39 33.032 14.290 21.081 1.00 0.00 O ATOM 0 H ASP A 39 33.671 17.111 21.082 1.00 0.00 H new ATOM 0 HA ASP A 39 30.907 17.243 21.912 1.00 0.00 H new ATOM 0 HB2 ASP A 39 33.349 15.786 23.030 1.00 0.00 H new ATOM 0 HB3 ASP A 39 31.708 15.546 23.594 1.00 0.00 H new ATOM 622 N GLN A 40 33.087 19.067 23.385 1.00 0.00 N ATOM 623 CA GLN A 40 33.316 20.035 24.459 1.00 0.00 C ATOM 624 C GLN A 40 32.865 21.429 24.040 1.00 0.00 C ATOM 625 O GLN A 40 32.819 22.343 24.864 1.00 0.00 O ATOM 626 CB GLN A 40 34.808 20.076 24.800 1.00 0.00 C ATOM 627 CG GLN A 40 35.276 18.688 25.240 1.00 0.00 C ATOM 628 CD GLN A 40 34.608 18.304 26.555 1.00 0.00 C ATOM 629 OE1 GLN A 40 33.808 17.370 26.598 1.00 0.00 O ATOM 630 NE2 GLN A 40 34.890 18.975 27.639 1.00 0.00 N ATOM 0 H GLN A 40 33.758 19.119 22.619 1.00 0.00 H new ATOM 0 HA GLN A 40 32.738 19.725 25.329 1.00 0.00 H new ATOM 0 HB2 GLN A 40 35.380 20.405 23.932 1.00 0.00 H new ATOM 0 HB3 GLN A 40 34.989 20.800 25.594 1.00 0.00 H new ATOM 0 HG2 GLN A 40 35.034 17.953 24.472 1.00 0.00 H new ATOM 0 HG3 GLN A 40 36.360 18.681 25.358 1.00 0.00 H new ATOM 0 HE21 GLN A 40 35.553 19.749 27.602 1.00 0.00 H new ATOM 0 HE22 GLN A 40 34.447 18.725 28.523 1.00 0.00 H new ATOM 639 N GLN A 41 32.566 21.600 22.750 1.00 0.00 N ATOM 640 CA GLN A 41 32.152 22.907 22.230 1.00 0.00 C ATOM 641 C GLN A 41 30.683 22.916 21.823 1.00 0.00 C ATOM 642 O GLN A 41 30.184 21.973 21.208 1.00 0.00 O ATOM 643 CB GLN A 41 33.004 23.266 21.012 1.00 0.00 C ATOM 644 CG GLN A 41 34.483 23.269 21.401 1.00 0.00 C ATOM 645 CD GLN A 41 35.342 23.530 20.169 1.00 0.00 C ATOM 646 OE1 GLN A 41 35.894 24.619 20.015 1.00 0.00 O ATOM 647 NE2 GLN A 41 35.488 22.590 19.275 1.00 0.00 N ATOM 0 H GLN A 41 32.602 20.858 22.051 1.00 0.00 H new ATOM 0 HA GLN A 41 32.291 23.638 23.026 1.00 0.00 H new ATOM 0 HB2 GLN A 41 32.830 22.548 20.210 1.00 0.00 H new ATOM 0 HB3 GLN A 41 32.716 24.246 20.631 1.00 0.00 H new ATOM 0 HG2 GLN A 41 34.669 24.035 22.154 1.00 0.00 H new ATOM 0 HG3 GLN A 41 34.753 22.312 21.847 1.00 0.00 H new ATOM 0 HE21 GLN A 41 35.030 21.688 19.404 1.00 0.00 H new ATOM 0 HE22 GLN A 41 36.060 22.758 18.447 1.00 0.00 H new ATOM 656 N ARG A 42 30.017 24.019 22.147 1.00 0.00 N ATOM 657 CA ARG A 42 28.608 24.218 21.807 1.00 0.00 C ATOM 658 C ARG A 42 28.472 25.555 21.083 1.00 0.00 C ATOM 659 O ARG A 42 29.057 26.554 21.507 1.00 0.00 O ATOM 660 CB ARG A 42 27.750 24.224 23.078 1.00 0.00 C ATOM 661 CG ARG A 42 27.914 22.892 23.837 1.00 0.00 C ATOM 662 CD ARG A 42 26.958 21.836 23.266 1.00 0.00 C ATOM 663 NE ARG A 42 27.069 20.587 24.019 1.00 0.00 N ATOM 664 CZ ARG A 42 26.441 19.484 23.618 1.00 0.00 C ATOM 665 NH1 ARG A 42 26.547 18.382 24.312 1.00 0.00 N ATOM 666 NH2 ARG A 42 25.718 19.501 22.531 1.00 0.00 N ATOM 0 H ARG A 42 30.435 24.800 22.652 1.00 0.00 H new ATOM 0 HA ARG A 42 28.265 23.406 21.166 1.00 0.00 H new ATOM 0 HB2 ARG A 42 28.043 25.055 23.720 1.00 0.00 H new ATOM 0 HB3 ARG A 42 26.703 24.376 22.818 1.00 0.00 H new ATOM 0 HG2 ARG A 42 28.943 22.543 23.756 1.00 0.00 H new ATOM 0 HG3 ARG A 42 27.711 23.042 24.897 1.00 0.00 H new ATOM 0 HD2 ARG A 42 25.933 22.204 23.308 1.00 0.00 H new ATOM 0 HD3 ARG A 42 27.189 21.657 22.216 1.00 0.00 H new ATOM 0 HE ARG A 42 27.637 20.561 24.866 1.00 0.00 H new ATOM 0 HH11 ARG A 42 27.111 18.367 25.162 1.00 0.00 H new ATOM 0 HH12 ARG A 42 26.065 17.537 24.004 1.00 0.00 H new ATOM 0 HH21 ARG A 42 25.634 20.360 21.988 1.00 0.00 H new ATOM 0 HH22 ARG A 42 25.237 18.655 22.225 1.00 0.00 H new ATOM 680 N LEU A 43 27.723 25.582 19.977 1.00 0.00 N ATOM 681 CA LEU A 43 27.552 26.816 19.200 1.00 0.00 C ATOM 682 C LEU A 43 26.137 27.365 19.356 1.00 0.00 C ATOM 683 O LEU A 43 25.158 26.664 19.096 1.00 0.00 O ATOM 684 CB LEU A 43 27.825 26.527 17.716 1.00 0.00 C ATOM 685 CG LEU A 43 29.205 25.872 17.551 1.00 0.00 C ATOM 686 CD1 LEU A 43 29.358 25.365 16.114 1.00 0.00 C ATOM 687 CD2 LEU A 43 30.310 26.896 17.848 1.00 0.00 C ATOM 0 H LEU A 43 27.229 24.773 19.601 1.00 0.00 H new ATOM 0 HA LEU A 43 28.256 27.560 19.572 1.00 0.00 H new ATOM 0 HB2 LEU A 43 27.052 25.870 17.317 1.00 0.00 H new ATOM 0 HB3 LEU A 43 27.783 27.453 17.143 1.00 0.00 H new ATOM 0 HG LEU A 43 29.291 25.039 18.248 1.00 0.00 H new ATOM 0 HD11 LEU A 43 30.336 24.900 15.995 1.00 0.00 H new ATOM 0 HD12 LEU A 43 28.579 24.632 15.902 1.00 0.00 H new ATOM 0 HD13 LEU A 43 29.267 26.202 15.421 1.00 0.00 H new ATOM 0 HD21 LEU A 43 31.285 26.424 17.729 1.00 0.00 H new ATOM 0 HD22 LEU A 43 30.225 27.734 17.156 1.00 0.00 H new ATOM 0 HD23 LEU A 43 30.205 27.258 18.871 1.00 0.00 H new ATOM 699 N ILE A 44 26.033 28.629 19.786 1.00 0.00 N ATOM 700 CA ILE A 44 24.729 29.275 19.979 1.00 0.00 C ATOM 701 C ILE A 44 24.646 30.597 19.209 1.00 0.00 C ATOM 702 O ILE A 44 25.618 31.352 19.119 1.00 0.00 O ATOM 703 CB ILE A 44 24.493 29.532 21.471 1.00 0.00 C ATOM 704 CG1 ILE A 44 24.809 28.249 22.251 1.00 0.00 C ATOM 705 CG2 ILE A 44 23.032 29.935 21.695 1.00 0.00 C ATOM 706 CD1 ILE A 44 24.362 28.394 23.709 1.00 0.00 C ATOM 0 H ILE A 44 26.833 29.222 20.006 1.00 0.00 H new ATOM 0 HA ILE A 44 23.959 28.606 19.594 1.00 0.00 H new ATOM 0 HB ILE A 44 25.139 30.338 21.818 1.00 0.00 H new ATOM 0 HG12 ILE A 44 24.303 27.401 21.790 1.00 0.00 H new ATOM 0 HG13 ILE A 44 25.879 28.043 22.209 1.00 0.00 H new ATOM 0 HG21 ILE A 44 22.864 30.118 22.756 1.00 0.00 H new ATOM 0 HG22 ILE A 44 22.814 30.842 21.131 1.00 0.00 H new ATOM 0 HG23 ILE A 44 22.377 29.132 21.357 1.00 0.00 H new ATOM 0 HD11 ILE A 44 24.591 27.478 24.253 1.00 0.00 H new ATOM 0 HD12 ILE A 44 24.888 29.230 24.169 1.00 0.00 H new ATOM 0 HD13 ILE A 44 23.288 28.577 23.744 1.00 0.00 H new ATOM 718 N PHE A 45 23.458 30.866 18.667 1.00 0.00 N ATOM 719 CA PHE A 45 23.193 32.088 17.905 1.00 0.00 C ATOM 720 C PHE A 45 21.724 32.457 18.075 1.00 0.00 C ATOM 721 O PHE A 45 20.872 31.576 18.179 1.00 0.00 O ATOM 722 CB PHE A 45 23.488 31.857 16.421 1.00 0.00 C ATOM 723 CG PHE A 45 23.261 33.137 15.643 1.00 0.00 C ATOM 724 CD1 PHE A 45 24.147 34.213 15.787 1.00 0.00 C ATOM 725 CD2 PHE A 45 22.171 33.243 14.766 1.00 0.00 C ATOM 726 CE1 PHE A 45 23.940 35.393 15.061 1.00 0.00 C ATOM 727 CE2 PHE A 45 21.965 34.424 14.042 1.00 0.00 C ATOM 728 CZ PHE A 45 22.852 35.497 14.187 1.00 0.00 C ATOM 0 H PHE A 45 22.653 30.244 18.743 1.00 0.00 H new ATOM 0 HA PHE A 45 23.832 32.892 18.270 1.00 0.00 H new ATOM 0 HB2 PHE A 45 24.518 31.522 16.294 1.00 0.00 H new ATOM 0 HB3 PHE A 45 22.846 31.067 16.033 1.00 0.00 H new ATOM 0 HD1 PHE A 45 24.990 34.133 16.458 1.00 0.00 H new ATOM 0 HD2 PHE A 45 21.490 32.413 14.649 1.00 0.00 H new ATOM 0 HE1 PHE A 45 24.621 36.223 15.176 1.00 0.00 H new ATOM 0 HE2 PHE A 45 21.122 34.507 13.372 1.00 0.00 H new ATOM 0 HZ PHE A 45 22.697 36.406 13.624 1.00 0.00 H new ATOM 738 N ALA A 46 21.414 33.749 18.111 1.00 0.00 N ATOM 739 CA ALA A 46 20.026 34.161 18.286 1.00 0.00 C ATOM 740 C ALA A 46 19.432 33.419 19.480 1.00 0.00 C ATOM 741 O ALA A 46 18.265 33.025 19.477 1.00 0.00 O ATOM 742 CB ALA A 46 19.222 33.859 17.019 1.00 0.00 C ATOM 0 H ALA A 46 22.086 34.512 18.024 1.00 0.00 H new ATOM 0 HA ALA A 46 19.985 35.235 18.470 1.00 0.00 H new ATOM 0 HB1 ALA A 46 18.187 34.171 17.162 1.00 0.00 H new ATOM 0 HB2 ALA A 46 19.652 34.402 16.177 1.00 0.00 H new ATOM 0 HB3 ALA A 46 19.253 32.789 16.815 1.00 0.00 H new ATOM 748 N GLY A 47 20.266 33.250 20.502 1.00 0.00 N ATOM 749 CA GLY A 47 19.874 32.581 21.738 1.00 0.00 C ATOM 750 C GLY A 47 19.462 31.121 21.535 1.00 0.00 C ATOM 751 O GLY A 47 18.874 30.522 22.436 1.00 0.00 O ATOM 0 H GLY A 47 21.233 33.573 20.496 1.00 0.00 H new ATOM 0 HA2 GLY A 47 20.704 32.622 22.443 1.00 0.00 H new ATOM 0 HA3 GLY A 47 19.045 33.125 22.190 1.00 0.00 H new ATOM 755 N LYS A 48 19.764 30.537 20.367 1.00 0.00 N ATOM 756 CA LYS A 48 19.400 29.133 20.103 1.00 0.00 C ATOM 757 C LYS A 48 20.625 28.266 19.823 1.00 0.00 C ATOM 758 O LYS A 48 21.561 28.690 19.147 1.00 0.00 O ATOM 759 CB LYS A 48 18.460 29.043 18.897 1.00 0.00 C ATOM 760 CG LYS A 48 17.769 27.666 18.876 1.00 0.00 C ATOM 761 CD LYS A 48 16.475 27.745 19.689 1.00 0.00 C ATOM 762 CE LYS A 48 15.787 26.384 19.710 1.00 0.00 C ATOM 763 NZ LYS A 48 14.496 26.499 20.445 1.00 0.00 N ATOM 0 H LYS A 48 20.250 31.003 19.601 1.00 0.00 H new ATOM 0 HA LYS A 48 18.906 28.763 21.001 1.00 0.00 H new ATOM 0 HB2 LYS A 48 17.712 29.835 18.947 1.00 0.00 H new ATOM 0 HB3 LYS A 48 19.021 29.193 17.975 1.00 0.00 H new ATOM 0 HG2 LYS A 48 17.551 27.370 17.850 1.00 0.00 H new ATOM 0 HG3 LYS A 48 18.430 26.907 19.294 1.00 0.00 H new ATOM 0 HD2 LYS A 48 16.695 28.066 20.707 1.00 0.00 H new ATOM 0 HD3 LYS A 48 15.809 28.491 19.256 1.00 0.00 H new ATOM 0 HE2 LYS A 48 15.610 26.037 18.692 1.00 0.00 H new ATOM 0 HE3 LYS A 48 16.429 25.646 20.191 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 14.023 25.573 20.462 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 14.678 26.813 21.420 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 13.885 27.191 19.967 1.00 0.00 H new ATOM 777 N GLN A 49 20.587 27.038 20.336 1.00 0.00 N ATOM 778 CA GLN A 49 21.669 26.088 20.136 1.00 0.00 C ATOM 779 C GLN A 49 21.525 25.415 18.772 1.00 0.00 C ATOM 780 O GLN A 49 20.442 24.953 18.415 1.00 0.00 O ATOM 781 CB GLN A 49 21.633 25.028 21.239 1.00 0.00 C ATOM 782 CG GLN A 49 22.945 24.243 21.247 1.00 0.00 C ATOM 783 CD GLN A 49 22.815 23.020 22.150 1.00 0.00 C ATOM 784 OE1 GLN A 49 23.576 22.062 22.013 1.00 0.00 O ATOM 785 NE2 GLN A 49 21.890 22.995 23.072 1.00 0.00 N ATOM 0 H GLN A 49 19.813 26.680 20.895 1.00 0.00 H new ATOM 0 HA GLN A 49 22.621 26.618 20.174 1.00 0.00 H new ATOM 0 HB2 GLN A 49 21.477 25.503 22.208 1.00 0.00 H new ATOM 0 HB3 GLN A 49 20.794 24.351 21.078 1.00 0.00 H new ATOM 0 HG2 GLN A 49 23.199 23.932 20.234 1.00 0.00 H new ATOM 0 HG3 GLN A 49 23.757 24.880 21.598 1.00 0.00 H new ATOM 0 HE21 GLN A 49 21.260 23.789 23.184 1.00 0.00 H new ATOM 0 HE22 GLN A 49 21.797 22.181 23.680 1.00 0.00 H new ATOM 794 N LEU A 50 22.612 25.370 18.013 1.00 0.00 N ATOM 795 CA LEU A 50 22.575 24.755 16.687 1.00 0.00 C ATOM 796 C LEU A 50 22.565 23.230 16.789 1.00 0.00 C ATOM 797 O LEU A 50 23.356 22.638 17.525 1.00 0.00 O ATOM 798 CB LEU A 50 23.779 25.217 15.863 1.00 0.00 C ATOM 799 CG LEU A 50 23.934 26.736 15.995 1.00 0.00 C ATOM 800 CD1 LEU A 50 25.126 27.204 15.155 1.00 0.00 C ATOM 801 CD2 LEU A 50 22.659 27.432 15.504 1.00 0.00 C ATOM 0 H LEU A 50 23.520 25.746 18.285 1.00 0.00 H new ATOM 0 HA LEU A 50 21.657 25.069 16.191 1.00 0.00 H new ATOM 0 HB2 LEU A 50 24.684 24.717 16.209 1.00 0.00 H new ATOM 0 HB3 LEU A 50 23.644 24.944 14.816 1.00 0.00 H new ATOM 0 HG LEU A 50 24.103 26.990 17.041 1.00 0.00 H new ATOM 0 HD11 LEU A 50 25.236 28.284 15.249 1.00 0.00 H new ATOM 0 HD12 LEU A 50 26.034 26.715 15.508 1.00 0.00 H new ATOM 0 HD13 LEU A 50 24.958 26.946 14.109 1.00 0.00 H new ATOM 0 HD21 LEU A 50 22.774 28.512 15.600 1.00 0.00 H new ATOM 0 HD22 LEU A 50 22.485 27.177 14.459 1.00 0.00 H new ATOM 0 HD23 LEU A 50 21.811 27.103 16.104 1.00 0.00 H new ATOM 813 N GLU A 51 21.644 22.604 16.054 1.00 0.00 N ATOM 814 CA GLU A 51 21.505 21.147 16.067 1.00 0.00 C ATOM 815 C GLU A 51 22.389 20.484 15.013 1.00 0.00 C ATOM 816 O GLU A 51 22.481 20.937 13.867 1.00 0.00 O ATOM 817 CB GLU A 51 20.040 20.761 15.808 1.00 0.00 C ATOM 818 CG GLU A 51 19.244 20.848 17.113 1.00 0.00 C ATOM 819 CD GLU A 51 17.792 20.448 16.871 1.00 0.00 C ATOM 820 OE1 GLU A 51 17.301 20.702 15.784 1.00 0.00 O ATOM 821 OE2 GLU A 51 17.193 19.891 17.777 1.00 0.00 O ATOM 0 H GLU A 51 20.983 23.083 15.442 1.00 0.00 H new ATOM 0 HA GLU A 51 21.821 20.796 17.049 1.00 0.00 H new ATOM 0 HB2 GLU A 51 19.606 21.425 15.061 1.00 0.00 H new ATOM 0 HB3 GLU A 51 19.986 19.750 15.405 1.00 0.00 H new ATOM 0 HG2 GLU A 51 19.689 20.194 17.863 1.00 0.00 H new ATOM 0 HG3 GLU A 51 19.288 21.863 17.508 1.00 0.00 H new ATOM 828 N ASP A 52 23.016 19.390 15.414 1.00 0.00 N ATOM 829 CA ASP A 52 23.871 18.638 14.518 1.00 0.00 C ATOM 830 C ASP A 52 23.060 18.067 13.357 1.00 0.00 C ATOM 831 O ASP A 52 21.941 17.586 13.546 1.00 0.00 O ATOM 832 CB ASP A 52 24.546 17.498 15.281 1.00 0.00 C ATOM 833 CG ASP A 52 25.509 18.063 16.317 1.00 0.00 C ATOM 834 OD1 ASP A 52 25.557 19.275 16.454 1.00 0.00 O ATOM 835 OD2 ASP A 52 26.188 17.278 16.957 1.00 0.00 O ATOM 0 H ASP A 52 22.947 19.005 16.356 1.00 0.00 H new ATOM 0 HA ASP A 52 24.631 19.310 14.119 1.00 0.00 H new ATOM 0 HB2 ASP A 52 23.793 16.881 15.771 1.00 0.00 H new ATOM 0 HB3 ASP A 52 25.084 16.853 14.586 1.00 0.00 H new ATOM 840 N GLY A 53 23.633 18.115 12.155 1.00 0.00 N ATOM 841 CA GLY A 53 22.960 17.589 10.964 1.00 0.00 C ATOM 842 C GLY A 53 22.301 18.699 10.146 1.00 0.00 C ATOM 843 O GLY A 53 21.911 18.477 8.999 1.00 0.00 O ATOM 0 H GLY A 53 24.557 18.510 11.979 1.00 0.00 H new ATOM 0 HA2 GLY A 53 23.682 17.060 10.343 1.00 0.00 H new ATOM 0 HA3 GLY A 53 22.205 16.862 11.264 1.00 0.00 H new ATOM 847 N ARG A 54 22.191 19.903 10.720 1.00 0.00 N ATOM 848 CA ARG A 54 21.589 21.028 9.994 1.00 0.00 C ATOM 849 C ARG A 54 22.663 21.862 9.298 1.00 0.00 C ATOM 850 O ARG A 54 23.830 21.840 9.683 1.00 0.00 O ATOM 851 CB ARG A 54 20.803 21.918 10.961 1.00 0.00 C ATOM 852 CG ARG A 54 19.556 21.175 11.446 1.00 0.00 C ATOM 853 CD ARG A 54 18.630 22.154 12.168 1.00 0.00 C ATOM 854 NE ARG A 54 17.393 21.486 12.557 1.00 0.00 N ATOM 855 CZ ARG A 54 16.374 22.172 13.064 1.00 0.00 C ATOM 856 NH1 ARG A 54 15.289 21.551 13.440 1.00 0.00 N ATOM 857 NH2 ARG A 54 16.456 23.470 13.176 1.00 0.00 N ATOM 0 H ARG A 54 22.504 20.122 11.666 1.00 0.00 H new ATOM 0 HA ARG A 54 20.914 20.622 9.240 1.00 0.00 H new ATOM 0 HB2 ARG A 54 21.429 22.191 11.810 1.00 0.00 H new ATOM 0 HB3 ARG A 54 20.516 22.846 10.466 1.00 0.00 H new ATOM 0 HG2 ARG A 54 19.037 20.723 10.601 1.00 0.00 H new ATOM 0 HG3 ARG A 54 19.840 20.364 12.117 1.00 0.00 H new ATOM 0 HD2 ARG A 54 19.129 22.554 13.051 1.00 0.00 H new ATOM 0 HD3 ARG A 54 18.406 23.000 11.518 1.00 0.00 H new ATOM 0 HE ARG A 54 17.309 20.476 12.438 1.00 0.00 H new ATOM 0 HH11 ARG A 54 15.222 20.538 13.345 1.00 0.00 H new ATOM 0 HH12 ARG A 54 14.508 22.079 13.829 1.00 0.00 H new ATOM 0 HH21 ARG A 54 17.301 23.956 12.875 1.00 0.00 H new ATOM 0 HH22 ARG A 54 15.675 23.999 13.565 1.00 0.00 H new ATOM 871 N THR A 55 22.257 22.604 8.266 1.00 0.00 N ATOM 872 CA THR A 55 23.181 23.459 7.513 1.00 0.00 C ATOM 873 C THR A 55 23.026 24.906 7.964 1.00 0.00 C ATOM 874 O THR A 55 22.004 25.265 8.544 1.00 0.00 O ATOM 875 CB THR A 55 22.884 23.355 6.015 1.00 0.00 C ATOM 876 OG1 THR A 55 21.489 23.519 5.800 1.00 0.00 O ATOM 877 CG2 THR A 55 23.325 21.985 5.491 1.00 0.00 C ATOM 0 H THR A 55 21.294 22.631 7.931 1.00 0.00 H new ATOM 0 HA THR A 55 24.203 23.129 7.700 1.00 0.00 H new ATOM 0 HB THR A 55 23.431 24.134 5.484 1.00 0.00 H new ATOM 0 HG1 THR A 55 21.296 23.454 4.841 1.00 0.00 H new ATOM 0 HG21 THR A 55 23.111 21.917 4.424 1.00 0.00 H new ATOM 0 HG22 THR A 55 24.395 21.860 5.655 1.00 0.00 H new ATOM 0 HG23 THR A 55 22.783 21.201 6.020 1.00 0.00 H new ATOM 885 N LEU A 56 24.024 25.743 7.690 1.00 0.00 N ATOM 886 CA LEU A 56 23.932 27.145 8.087 1.00 0.00 C ATOM 887 C LEU A 56 22.705 27.788 7.435 1.00 0.00 C ATOM 888 O LEU A 56 22.004 28.570 8.077 1.00 0.00 O ATOM 889 CB LEU A 56 25.223 27.915 7.711 1.00 0.00 C ATOM 890 CG LEU A 56 26.226 27.900 8.882 1.00 0.00 C ATOM 891 CD1 LEU A 56 26.756 26.478 9.095 1.00 0.00 C ATOM 892 CD2 LEU A 56 27.395 28.843 8.566 1.00 0.00 C ATOM 0 H LEU A 56 24.885 25.484 7.207 1.00 0.00 H new ATOM 0 HA LEU A 56 23.823 27.195 9.170 1.00 0.00 H new ATOM 0 HB2 LEU A 56 25.678 27.463 6.830 1.00 0.00 H new ATOM 0 HB3 LEU A 56 24.976 28.944 7.450 1.00 0.00 H new ATOM 0 HG LEU A 56 25.724 28.234 9.790 1.00 0.00 H new ATOM 0 HD11 LEU A 56 27.464 26.474 9.924 1.00 0.00 H new ATOM 0 HD12 LEU A 56 25.925 25.811 9.324 1.00 0.00 H new ATOM 0 HD13 LEU A 56 27.256 26.137 8.189 1.00 0.00 H new ATOM 0 HD21 LEU A 56 28.104 28.833 9.393 1.00 0.00 H new ATOM 0 HD22 LEU A 56 27.894 28.511 7.656 1.00 0.00 H new ATOM 0 HD23 LEU A 56 27.017 29.856 8.424 1.00 0.00 H new ATOM 904 N SER A 57 22.447 27.470 6.164 1.00 0.00 N ATOM 905 CA SER A 57 21.295 28.043 5.467 1.00 0.00 C ATOM 906 C SER A 57 20.056 27.968 6.346 1.00 0.00 C ATOM 907 O SER A 57 19.249 28.897 6.378 1.00 0.00 O ATOM 908 CB SER A 57 21.027 27.290 4.162 1.00 0.00 C ATOM 909 OG SER A 57 20.095 28.028 3.378 1.00 0.00 O ATOM 0 H SER A 57 23.010 26.829 5.605 1.00 0.00 H new ATOM 0 HA SER A 57 21.521 29.085 5.242 1.00 0.00 H new ATOM 0 HB2 SER A 57 21.957 27.153 3.610 1.00 0.00 H new ATOM 0 HB3 SER A 57 20.634 26.296 4.376 1.00 0.00 H new ATOM 0 HG SER A 57 19.921 27.550 2.540 1.00 0.00 H new ATOM 915 N ASP A 58 19.913 26.862 7.071 1.00 0.00 N ATOM 916 CA ASP A 58 18.770 26.692 7.951 1.00 0.00 C ATOM 917 C ASP A 58 18.662 27.895 8.876 1.00 0.00 C ATOM 918 O ASP A 58 17.582 28.451 9.078 1.00 0.00 O ATOM 919 CB ASP A 58 18.935 25.415 8.784 1.00 0.00 C ATOM 920 CG ASP A 58 19.055 24.198 7.870 1.00 0.00 C ATOM 921 OD1 ASP A 58 18.537 24.256 6.767 1.00 0.00 O ATOM 922 OD2 ASP A 58 19.661 23.224 8.287 1.00 0.00 O ATOM 0 H ASP A 58 20.568 26.080 7.065 1.00 0.00 H new ATOM 0 HA ASP A 58 17.864 26.609 7.351 1.00 0.00 H new ATOM 0 HB2 ASP A 58 19.822 25.495 9.413 1.00 0.00 H new ATOM 0 HB3 ASP A 58 18.081 25.295 9.451 1.00 0.00 H new ATOM 927 N TYR A 59 19.810 28.299 9.413 1.00 0.00 N ATOM 928 CA TYR A 59 19.899 29.450 10.309 1.00 0.00 C ATOM 929 C TYR A 59 20.464 30.653 9.553 1.00 0.00 C ATOM 930 O TYR A 59 21.648 30.669 9.257 1.00 0.00 O ATOM 931 CB TYR A 59 20.843 29.106 11.464 1.00 0.00 C ATOM 932 CG TYR A 59 20.295 27.939 12.248 1.00 0.00 C ATOM 933 CD1 TYR A 59 20.747 26.637 11.985 1.00 0.00 C ATOM 934 CD2 TYR A 59 19.339 28.158 13.244 1.00 0.00 C ATOM 935 CE1 TYR A 59 20.239 25.558 12.721 1.00 0.00 C ATOM 936 CE2 TYR A 59 18.830 27.080 13.978 1.00 0.00 C ATOM 937 CZ TYR A 59 19.280 25.781 13.717 1.00 0.00 C ATOM 938 OH TYR A 59 18.778 24.719 14.443 1.00 0.00 O ATOM 0 H TYR A 59 20.704 27.839 9.240 1.00 0.00 H new ATOM 0 HA TYR A 59 18.906 29.692 10.688 1.00 0.00 H new ATOM 0 HB2 TYR A 59 21.832 28.862 11.076 1.00 0.00 H new ATOM 0 HB3 TYR A 59 20.962 29.970 12.118 1.00 0.00 H new ATOM 0 HD1 TYR A 59 21.486 26.466 11.216 1.00 0.00 H new ATOM 0 HD2 TYR A 59 18.992 29.160 13.448 1.00 0.00 H new ATOM 0 HE1 TYR A 59 20.587 24.555 12.520 1.00 0.00 H new ATOM 0 HE2 TYR A 59 18.090 27.251 14.746 1.00 0.00 H new ATOM 0 HH TYR A 59 18.123 25.048 15.094 1.00 0.00 H new ATOM 948 N ASN A 60 19.598 31.610 9.190 1.00 0.00 N ATOM 949 CA ASN A 60 20.010 32.792 8.405 1.00 0.00 C ATOM 950 C ASN A 60 21.280 33.482 8.942 1.00 0.00 C ATOM 951 O ASN A 60 21.237 34.630 9.389 1.00 0.00 O ATOM 952 CB ASN A 60 18.866 33.812 8.353 1.00 0.00 C ATOM 953 CG ASN A 60 18.425 34.190 9.766 1.00 0.00 C ATOM 954 OD1 ASN A 60 17.362 34.784 9.943 1.00 0.00 O ATOM 955 ND2 ASN A 60 19.181 33.880 10.783 1.00 0.00 N ATOM 0 H ASN A 60 18.606 31.592 9.426 1.00 0.00 H new ATOM 0 HA ASN A 60 20.247 32.423 7.407 1.00 0.00 H new ATOM 0 HB2 ASN A 60 19.189 34.703 7.815 1.00 0.00 H new ATOM 0 HB3 ASN A 60 18.023 33.395 7.801 1.00 0.00 H new ATOM 0 HD21 ASN A 60 18.892 34.130 11.729 1.00 0.00 H new ATOM 0 HD22 ASN A 60 20.062 33.388 10.633 1.00 0.00 H new ATOM 962 N ILE A 61 22.404 32.771 8.868 1.00 0.00 N ATOM 963 CA ILE A 61 23.701 33.283 9.309 1.00 0.00 C ATOM 964 C ILE A 61 24.468 33.805 8.093 1.00 0.00 C ATOM 965 O ILE A 61 25.016 33.018 7.324 1.00 0.00 O ATOM 966 CB ILE A 61 24.509 32.147 9.951 1.00 0.00 C ATOM 967 CG1 ILE A 61 23.829 31.678 11.240 1.00 0.00 C ATOM 968 CG2 ILE A 61 25.926 32.630 10.272 1.00 0.00 C ATOM 969 CD1 ILE A 61 24.483 30.371 11.701 1.00 0.00 C ATOM 0 H ILE A 61 22.441 31.821 8.499 1.00 0.00 H new ATOM 0 HA ILE A 61 23.550 34.083 10.034 1.00 0.00 H new ATOM 0 HB ILE A 61 24.559 31.315 9.248 1.00 0.00 H new ATOM 0 HG12 ILE A 61 23.923 32.440 12.014 1.00 0.00 H new ATOM 0 HG13 ILE A 61 22.763 31.526 11.070 1.00 0.00 H new ATOM 0 HG21 ILE A 61 26.493 31.818 10.727 1.00 0.00 H new ATOM 0 HG22 ILE A 61 26.420 32.946 9.353 1.00 0.00 H new ATOM 0 HG23 ILE A 61 25.876 33.470 10.965 1.00 0.00 H new ATOM 0 HD11 ILE A 61 24.005 30.029 12.619 1.00 0.00 H new ATOM 0 HD12 ILE A 61 24.366 29.613 10.927 1.00 0.00 H new ATOM 0 HD13 ILE A 61 25.544 30.540 11.886 1.00 0.00 H new ATOM 981 N GLN A 62 24.488 35.122 7.898 1.00 0.00 N ATOM 982 CA GLN A 62 25.175 35.693 6.734 1.00 0.00 C ATOM 983 C GLN A 62 26.666 35.884 6.979 1.00 0.00 C ATOM 984 O GLN A 62 27.156 35.735 8.097 1.00 0.00 O ATOM 985 CB GLN A 62 24.549 37.030 6.344 1.00 0.00 C ATOM 986 CG GLN A 62 23.054 36.839 6.090 1.00 0.00 C ATOM 987 CD GLN A 62 22.845 35.938 4.879 1.00 0.00 C ATOM 988 OE1 GLN A 62 22.324 34.831 5.010 1.00 0.00 O ATOM 989 NE2 GLN A 62 23.223 36.350 3.700 1.00 0.00 N ATOM 0 H GLN A 62 24.047 35.804 8.515 1.00 0.00 H new ATOM 0 HA GLN A 62 25.057 34.979 5.919 1.00 0.00 H new ATOM 0 HB2 GLN A 62 24.703 37.761 7.138 1.00 0.00 H new ATOM 0 HB3 GLN A 62 25.033 37.423 5.450 1.00 0.00 H new ATOM 0 HG2 GLN A 62 22.580 36.399 6.968 1.00 0.00 H new ATOM 0 HG3 GLN A 62 22.578 37.805 5.922 1.00 0.00 H new ATOM 0 HE21 GLN A 62 23.655 37.268 3.595 1.00 0.00 H new ATOM 0 HE22 GLN A 62 23.087 35.754 2.884 1.00 0.00 H new ATOM 998 N LYS A 63 27.376 36.198 5.898 1.00 0.00 N ATOM 999 CA LYS A 63 28.819 36.389 5.965 1.00 0.00 C ATOM 1000 C LYS A 63 29.209 37.451 6.985 1.00 0.00 C ATOM 1001 O LYS A 63 28.513 38.451 7.173 1.00 0.00 O ATOM 1002 CB LYS A 63 29.385 36.743 4.580 1.00 0.00 C ATOM 1003 CG LYS A 63 28.828 38.078 4.072 1.00 0.00 C ATOM 1004 CD LYS A 63 29.374 38.328 2.660 1.00 0.00 C ATOM 1005 CE LYS A 63 28.908 39.692 2.145 1.00 0.00 C ATOM 1006 NZ LYS A 63 29.408 39.895 0.754 1.00 0.00 N ATOM 0 H LYS A 63 26.975 36.325 4.969 1.00 0.00 H new ATOM 0 HA LYS A 63 29.253 35.445 6.294 1.00 0.00 H new ATOM 0 HB2 LYS A 63 30.472 36.797 4.633 1.00 0.00 H new ATOM 0 HB3 LYS A 63 29.139 35.952 3.872 1.00 0.00 H new ATOM 0 HG2 LYS A 63 27.738 38.053 4.058 1.00 0.00 H new ATOM 0 HG3 LYS A 63 29.119 38.889 4.740 1.00 0.00 H new ATOM 0 HD2 LYS A 63 30.463 38.289 2.672 1.00 0.00 H new ATOM 0 HD3 LYS A 63 29.034 37.542 1.986 1.00 0.00 H new ATOM 0 HE2 LYS A 63 27.820 39.747 2.163 1.00 0.00 H new ATOM 0 HE3 LYS A 63 29.278 40.484 2.795 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 29.092 40.822 0.403 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 30.447 39.860 0.750 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 29.034 39.145 0.138 1.00 0.00 H new ATOM 1020 N GLU A 64 30.354 37.216 7.625 1.00 0.00 N ATOM 1021 CA GLU A 64 30.895 38.135 8.621 1.00 0.00 C ATOM 1022 C GLU A 64 29.924 38.372 9.776 1.00 0.00 C ATOM 1023 O GLU A 64 29.391 39.470 9.938 1.00 0.00 O ATOM 1024 CB GLU A 64 31.271 39.461 7.959 1.00 0.00 C ATOM 1025 CG GLU A 64 32.442 39.218 7.002 1.00 0.00 C ATOM 1026 CD GLU A 64 32.827 40.511 6.294 1.00 0.00 C ATOM 1027 OE1 GLU A 64 31.992 41.397 6.226 1.00 0.00 O ATOM 1028 OE2 GLU A 64 33.952 40.595 5.830 1.00 0.00 O ATOM 0 H GLU A 64 30.928 36.388 7.468 1.00 0.00 H new ATOM 0 HA GLU A 64 31.788 37.674 9.043 1.00 0.00 H new ATOM 0 HB2 GLU A 64 30.418 39.868 7.416 1.00 0.00 H new ATOM 0 HB3 GLU A 64 31.547 40.196 8.715 1.00 0.00 H new ATOM 0 HG2 GLU A 64 33.297 38.830 7.555 1.00 0.00 H new ATOM 0 HG3 GLU A 64 32.168 38.461 6.267 1.00 0.00 H new ATOM 1049 N THR A 66 29.164 37.166 14.183 1.00 0.00 N ATOM 1050 CA THR A 66 29.827 36.630 15.378 1.00 0.00 C ATOM 1051 C THR A 66 28.997 35.518 16.010 1.00 0.00 C ATOM 1052 O THR A 66 27.812 35.695 16.296 1.00 0.00 O ATOM 1053 CB THR A 66 30.043 37.746 16.402 1.00 0.00 C ATOM 1054 OG1 THR A 66 30.760 38.810 15.791 1.00 0.00 O ATOM 1055 CG2 THR A 66 30.849 37.199 17.585 1.00 0.00 C ATOM 0 HA THR A 66 30.790 36.219 15.074 1.00 0.00 H new ATOM 0 HB THR A 66 29.079 38.112 16.757 1.00 0.00 H new ATOM 0 HG1 THR A 66 30.508 38.874 14.846 1.00 0.00 H new ATOM 0 HG21 THR A 66 31.005 37.992 18.317 1.00 0.00 H new ATOM 0 HG22 THR A 66 30.302 36.379 18.050 1.00 0.00 H new ATOM 0 HG23 THR A 66 31.814 36.837 17.231 1.00 0.00 H new ATOM 1063 N LEU A 67 29.636 34.368 16.230 1.00 0.00 N ATOM 1064 CA LEU A 67 28.968 33.214 16.840 1.00 0.00 C ATOM 1065 C LEU A 67 29.405 33.088 18.299 1.00 0.00 C ATOM 1066 O LEU A 67 30.516 33.485 18.650 1.00 0.00 O ATOM 1067 CB LEU A 67 29.348 31.932 16.077 1.00 0.00 C ATOM 1068 CG LEU A 67 28.456 31.766 14.837 1.00 0.00 C ATOM 1069 CD1 LEU A 67 27.003 31.451 15.257 1.00 0.00 C ATOM 1070 CD2 LEU A 67 28.496 33.058 14.003 1.00 0.00 C ATOM 0 H LEU A 67 30.616 34.209 15.995 1.00 0.00 H new ATOM 0 HA LEU A 67 27.888 33.354 16.793 1.00 0.00 H new ATOM 0 HB2 LEU A 67 30.395 31.976 15.777 1.00 0.00 H new ATOM 0 HB3 LEU A 67 29.240 31.066 16.730 1.00 0.00 H new ATOM 0 HG LEU A 67 28.829 30.935 14.238 1.00 0.00 H new ATOM 0 HD11 LEU A 67 26.384 31.336 14.367 1.00 0.00 H new ATOM 0 HD12 LEU A 67 26.983 30.527 15.834 1.00 0.00 H new ATOM 0 HD13 LEU A 67 26.615 32.268 15.866 1.00 0.00 H new ATOM 0 HD21 LEU A 67 27.864 32.942 13.123 1.00 0.00 H new ATOM 0 HD22 LEU A 67 28.132 33.891 14.605 1.00 0.00 H new ATOM 0 HD23 LEU A 67 29.521 33.257 13.690 1.00 0.00 H new ATOM 1082 N HIS A 68 28.540 32.536 19.153 1.00 0.00 N ATOM 1083 CA HIS A 68 28.880 32.373 20.566 1.00 0.00 C ATOM 1084 C HIS A 68 29.359 30.944 20.834 1.00 0.00 C ATOM 1085 O HIS A 68 28.630 29.982 20.582 1.00 0.00 O ATOM 1086 CB HIS A 68 27.656 32.671 21.435 1.00 0.00 C ATOM 1087 CG HIS A 68 27.244 34.108 21.250 1.00 0.00 C ATOM 1088 ND1 HIS A 68 27.998 35.163 21.741 1.00 0.00 N ATOM 1089 CD2 HIS A 68 26.161 34.679 20.629 1.00 0.00 C ATOM 1090 CE1 HIS A 68 27.362 36.304 21.412 1.00 0.00 C ATOM 1091 NE2 HIS A 68 26.238 36.066 20.733 1.00 0.00 N ATOM 0 H HIS A 68 27.612 32.199 18.895 1.00 0.00 H new ATOM 0 HA HIS A 68 29.680 33.071 20.814 1.00 0.00 H new ATOM 0 HB2 HIS A 68 26.834 32.008 21.163 1.00 0.00 H new ATOM 0 HB3 HIS A 68 27.886 32.480 22.483 1.00 0.00 H new ATOM 0 HD2 HIS A 68 25.369 34.135 20.135 1.00 0.00 H new ATOM 0 HE1 HIS A 68 27.718 37.291 21.667 1.00 0.00 H new ATOM 0 HE2 HIS A 68 25.577 36.752 20.368 1.00 0.00 H new ATOM 1100 N LEU A 69 30.585 30.800 21.354 1.00 0.00 N ATOM 1101 CA LEU A 69 31.141 29.501 21.659 1.00 0.00 C ATOM 1102 C LEU A 69 31.148 29.314 23.161 1.00 0.00 C ATOM 1103 O LEU A 69 31.894 29.973 23.887 1.00 0.00 O ATOM 1104 CB LEU A 69 32.565 29.401 21.107 1.00 0.00 C ATOM 1105 CG LEU A 69 33.150 27.986 21.373 1.00 0.00 C ATOM 1106 CD1 LEU A 69 33.919 27.507 20.139 1.00 0.00 C ATOM 1107 CD2 LEU A 69 34.102 28.028 22.579 1.00 0.00 C ATOM 0 H LEU A 69 31.205 31.581 21.569 1.00 0.00 H new ATOM 0 HA LEU A 69 30.536 28.721 21.197 1.00 0.00 H new ATOM 0 HB2 LEU A 69 32.562 29.605 20.036 1.00 0.00 H new ATOM 0 HB3 LEU A 69 33.197 30.157 21.574 1.00 0.00 H new ATOM 0 HG LEU A 69 32.331 27.299 21.585 1.00 0.00 H new ATOM 0 HD11 LEU A 69 34.328 26.515 20.328 1.00 0.00 H new ATOM 0 HD12 LEU A 69 33.245 27.465 19.284 1.00 0.00 H new ATOM 0 HD13 LEU A 69 34.733 28.200 19.925 1.00 0.00 H new ATOM 0 HD21 LEU A 69 34.507 27.032 22.758 1.00 0.00 H new ATOM 0 HD22 LEU A 69 34.919 28.720 22.374 1.00 0.00 H new ATOM 0 HD23 LEU A 69 33.556 28.362 23.462 1.00 0.00 H new ATOM 1119 N VAL A 70 30.297 28.417 23.614 1.00 0.00 N ATOM 1120 CA VAL A 70 30.169 28.115 25.037 1.00 0.00 C ATOM 1121 C VAL A 70 30.767 26.746 25.325 1.00 0.00 C ATOM 1122 O VAL A 70 30.621 25.814 24.532 1.00 0.00 O ATOM 1123 CB VAL A 70 28.692 28.133 25.433 1.00 0.00 C ATOM 1124 CG1 VAL A 70 28.567 28.188 26.957 1.00 0.00 C ATOM 1125 CG2 VAL A 70 28.019 29.365 24.822 1.00 0.00 C ATOM 0 H VAL A 70 29.674 27.875 23.015 1.00 0.00 H new ATOM 0 HA VAL A 70 30.704 28.867 25.617 1.00 0.00 H new ATOM 0 HB VAL A 70 28.207 27.229 25.064 1.00 0.00 H new ATOM 0 HG11 VAL A 70 27.513 28.201 27.235 1.00 0.00 H new ATOM 0 HG12 VAL A 70 29.047 27.312 27.393 1.00 0.00 H new ATOM 0 HG13 VAL A 70 29.052 29.091 27.329 1.00 0.00 H new ATOM 0 HG21 VAL A 70 26.966 29.381 25.102 1.00 0.00 H new ATOM 0 HG22 VAL A 70 28.507 30.267 25.192 1.00 0.00 H new ATOM 0 HG23 VAL A 70 28.105 29.325 23.736 1.00 0.00 H new