USER MOD reduce.3.24.130724 H: found=0, std=0, add=587, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 586 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 7 THR OG1 : rot -82:sc= 1.06 USER MOD Set 1.2: A 9 THR OG1 : rot 180:sc= 0.0553 USER MOD Set 2.1: A 6 LYS NZ :NH3+ -166:sc= 0.445! (180deg=0) USER MOD Set 2.2: A 12 THR OG1 : rot -10:sc= 0.685 USER MOD Single : A 1 MET CE :methyl -166:sc= -0.0282 (180deg=-0.482) USER MOD Single : A 1 MET N :NH3+ 176:sc= 0.999 (180deg=0.992) USER MOD Single : A 2 GLN : amide:sc= -0.827 K(o=-0.83,f=0) USER MOD Single : A 11 LYS NZ :NH3+ -166:sc= 1.28 (180deg=1.14) USER MOD Single : A 14 THR OG1 : rot -62:sc= 0.0578 USER MOD Single : A 20 SER OG : rot -43:sc= 0.117 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.0853 USER MOD Single : A 25 ASN : amide:sc= 1.16 K(o=1.2,f=-0.93) USER MOD Single : A 27 LYS NZ :NH3+ -150:sc= 2.05 (180deg=0.366) USER MOD Single : A 29 LYS NZ :NH3+ 174:sc= 1.22 (180deg=1.12) USER MOD Single : A 31 GLN : amide:sc= 0 K(o=0,f=-0.78) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= -0.11 X(o=-0.11,f=0) USER MOD Single : A 41 GLN : amide:sc= -0.135 K(o=-0.13,f=-0.81) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= -0.153 K(o=-0.15,f=-1.1!) USER MOD Single : A 55 THR OG1 : rot -73:sc= 1.25 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 179:sc= 1.39 USER MOD Single : A 60 ASN : amide:sc= 0 X(o=0,f=-0.048) USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=-0.037) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 95:sc= 1.04 USER MOD Single : A 66 THR OG1 : rot 170:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= -0.0104 X(o=-0.01,f=-0.34) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 13.284 31.156 16.704 1.00 0.00 N ATOM 2 CA MET A 1 13.449 31.049 18.166 1.00 0.00 C ATOM 3 C MET A 1 14.876 31.477 18.528 1.00 0.00 C ATOM 4 O MET A 1 15.753 31.284 17.691 1.00 0.00 O ATOM 5 CB MET A 1 13.127 29.731 18.861 1.00 0.00 C ATOM 6 CG MET A 1 13.969 28.526 18.446 1.00 0.00 C ATOM 7 SD MET A 1 13.713 27.026 19.436 1.00 0.00 S ATOM 8 CE MET A 1 15.082 26.067 18.749 1.00 0.00 C ATOM 0 H1 MET A 1 12.343 30.805 16.434 1.00 0.00 H new ATOM 0 H2 MET A 1 13.378 32.151 16.416 1.00 0.00 H new ATOM 0 H3 MET A 1 14.015 30.588 16.230 1.00 0.00 H new ATOM 0 HA MET A 1 12.669 31.707 18.550 1.00 0.00 H new ATOM 0 HB2 MET A 1 13.240 29.874 19.936 1.00 0.00 H new ATOM 0 HB3 MET A 1 12.078 29.495 18.679 1.00 0.00 H new ATOM 0 HG2 MET A 1 13.754 28.295 17.403 1.00 0.00 H new ATOM 0 HG3 MET A 1 15.022 28.803 18.500 1.00 0.00 H new ATOM 0 HE1 MET A 1 14.970 25.020 19.030 1.00 0.00 H new ATOM 0 HE2 MET A 1 15.077 26.153 17.662 1.00 0.00 H new ATOM 0 HE3 MET A 1 16.025 26.449 19.139 1.00 0.00 H new ATOM 20 N GLN A 2 15.120 32.028 19.710 1.00 0.00 N ATOM 21 CA GLN A 2 16.446 32.260 20.235 1.00 0.00 C ATOM 22 C GLN A 2 16.975 31.248 21.259 1.00 0.00 C ATOM 23 O GLN A 2 16.143 30.576 21.878 1.00 0.00 O ATOM 24 CB GLN A 2 16.387 33.673 20.826 1.00 0.00 C ATOM 25 CG GLN A 2 16.284 34.859 19.877 1.00 0.00 C ATOM 26 CD GLN A 2 16.239 36.200 20.592 1.00 0.00 C ATOM 27 OE1 GLN A 2 16.075 37.246 19.964 1.00 0.00 O ATOM 28 NE2 GLN A 2 16.229 36.207 21.930 1.00 0.00 N ATOM 0 H GLN A 2 14.378 32.331 20.341 1.00 0.00 H new ATOM 0 HA GLN A 2 17.165 32.141 19.424 1.00 0.00 H new ATOM 0 HB2 GLN A 2 15.531 33.714 21.500 1.00 0.00 H new ATOM 0 HB3 GLN A 2 17.280 33.814 21.435 1.00 0.00 H new ATOM 0 HG2 GLN A 2 17.136 34.846 19.197 1.00 0.00 H new ATOM 0 HG3 GLN A 2 15.387 34.750 19.267 1.00 0.00 H new ATOM 0 HE21 GLN A 2 16.365 35.338 22.446 1.00 0.00 H new ATOM 0 HE22 GLN A 2 16.085 37.082 22.434 1.00 0.00 H new ATOM 37 N ILE A 3 18.291 31.245 21.443 1.00 0.00 N ATOM 38 CA ILE A 3 19.092 30.599 22.458 1.00 0.00 C ATOM 39 C ILE A 3 20.253 31.576 22.659 1.00 0.00 C ATOM 40 O ILE A 3 20.634 32.409 21.833 1.00 0.00 O ATOM 41 CB ILE A 3 19.411 29.141 22.122 1.00 0.00 C ATOM 42 CG1 ILE A 3 20.240 29.031 20.843 1.00 0.00 C ATOM 43 CG2 ILE A 3 18.208 28.194 22.022 1.00 0.00 C ATOM 44 CD1 ILE A 3 21.031 27.754 20.533 1.00 0.00 C ATOM 0 H ILE A 3 18.888 31.763 20.799 1.00 0.00 H new ATOM 0 HA ILE A 3 18.593 30.439 23.414 1.00 0.00 H new ATOM 0 HB ILE A 3 19.982 28.806 22.988 1.00 0.00 H new ATOM 0 HG12 ILE A 3 19.563 29.201 20.006 1.00 0.00 H new ATOM 0 HG13 ILE A 3 20.952 29.856 20.850 1.00 0.00 H new ATOM 0 HG21 ILE A 3 18.555 27.189 21.780 1.00 0.00 H new ATOM 0 HG22 ILE A 3 17.679 28.175 22.975 1.00 0.00 H new ATOM 0 HG23 ILE A 3 17.534 28.543 21.240 1.00 0.00 H new ATOM 0 HD11 ILE A 3 21.553 27.871 19.583 1.00 0.00 H new ATOM 0 HD12 ILE A 3 21.757 27.574 21.326 1.00 0.00 H new ATOM 0 HD13 ILE A 3 20.346 26.908 20.469 1.00 0.00 H new ATOM 56 N PHE A 4 20.864 31.437 23.825 1.00 0.00 N ATOM 57 CA PHE A 4 22.069 32.123 24.272 1.00 0.00 C ATOM 58 C PHE A 4 23.215 31.109 24.258 1.00 0.00 C ATOM 59 O PHE A 4 23.056 30.035 24.823 1.00 0.00 O ATOM 60 CB PHE A 4 21.830 32.578 25.709 1.00 0.00 C ATOM 61 CG PHE A 4 20.753 33.634 25.818 1.00 0.00 C ATOM 62 CD1 PHE A 4 20.675 34.685 24.899 1.00 0.00 C ATOM 63 CD2 PHE A 4 19.762 33.536 26.803 1.00 0.00 C ATOM 64 CE1 PHE A 4 19.705 35.699 24.997 1.00 0.00 C ATOM 65 CE2 PHE A 4 18.721 34.477 26.798 1.00 0.00 C ATOM 66 CZ PHE A 4 18.692 35.593 25.952 1.00 0.00 C ATOM 0 H PHE A 4 20.507 30.797 24.535 1.00 0.00 H new ATOM 0 HA PHE A 4 22.308 32.974 23.635 1.00 0.00 H new ATOM 0 HB2 PHE A 4 21.551 31.717 26.316 1.00 0.00 H new ATOM 0 HB3 PHE A 4 22.760 32.970 26.121 1.00 0.00 H new ATOM 0 HD1 PHE A 4 21.384 34.719 24.085 1.00 0.00 H new ATOM 0 HD2 PHE A 4 19.798 32.755 27.548 1.00 0.00 H new ATOM 0 HE1 PHE A 4 19.744 36.554 24.338 1.00 0.00 H new ATOM 0 HE2 PHE A 4 17.898 34.333 27.483 1.00 0.00 H new ATOM 0 HZ PHE A 4 17.918 36.341 26.035 1.00 0.00 H new ATOM 76 N VAL A 5 24.431 31.469 23.845 1.00 0.00 N ATOM 77 CA VAL A 5 25.650 30.695 23.961 1.00 0.00 C ATOM 78 C VAL A 5 26.613 31.555 24.779 1.00 0.00 C ATOM 79 O VAL A 5 27.203 32.565 24.410 1.00 0.00 O ATOM 80 CB VAL A 5 26.206 30.295 22.596 1.00 0.00 C ATOM 81 CG1 VAL A 5 27.370 29.297 22.710 1.00 0.00 C ATOM 82 CG2 VAL A 5 25.096 29.852 21.651 1.00 0.00 C ATOM 0 H VAL A 5 24.592 32.369 23.392 1.00 0.00 H new ATOM 0 HA VAL A 5 25.476 29.742 24.461 1.00 0.00 H new ATOM 0 HB VAL A 5 26.645 31.183 22.141 1.00 0.00 H new ATOM 0 HG11 VAL A 5 27.731 29.043 21.713 1.00 0.00 H new ATOM 0 HG12 VAL A 5 28.179 29.746 23.285 1.00 0.00 H new ATOM 0 HG13 VAL A 5 27.026 28.393 23.212 1.00 0.00 H new ATOM 0 HG21 VAL A 5 25.526 29.574 20.689 1.00 0.00 H new ATOM 0 HG22 VAL A 5 24.576 28.994 22.077 1.00 0.00 H new ATOM 0 HG23 VAL A 5 24.390 30.670 21.510 1.00 0.00 H new ATOM 92 N LYS A 6 26.998 31.035 25.942 1.00 0.00 N ATOM 93 CA LYS A 6 28.076 31.457 26.823 1.00 0.00 C ATOM 94 C LYS A 6 29.353 30.904 26.187 1.00 0.00 C ATOM 95 O LYS A 6 29.433 29.687 26.030 1.00 0.00 O ATOM 96 CB LYS A 6 27.910 30.890 28.235 1.00 0.00 C ATOM 97 CG LYS A 6 28.136 31.955 29.306 1.00 0.00 C ATOM 98 CD LYS A 6 27.134 33.105 29.301 1.00 0.00 C ATOM 99 CE LYS A 6 27.254 34.071 30.479 1.00 0.00 C ATOM 100 NZ LYS A 6 26.110 34.992 30.540 1.00 0.00 N ATOM 0 H LYS A 6 26.511 30.226 26.326 1.00 0.00 H new ATOM 0 HA LYS A 6 28.092 32.542 26.928 1.00 0.00 H new ATOM 0 HB2 LYS A 6 26.909 30.473 28.343 1.00 0.00 H new ATOM 0 HB3 LYS A 6 28.614 30.071 28.383 1.00 0.00 H new ATOM 0 HG2 LYS A 6 28.109 31.475 30.284 1.00 0.00 H new ATOM 0 HG3 LYS A 6 29.138 32.367 29.181 1.00 0.00 H new ATOM 0 HD2 LYS A 6 27.254 33.668 28.375 1.00 0.00 H new ATOM 0 HD3 LYS A 6 26.126 32.689 29.293 1.00 0.00 H new ATOM 0 HE2 LYS A 6 27.317 33.506 31.409 1.00 0.00 H new ATOM 0 HE3 LYS A 6 28.178 34.642 30.390 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 26.329 35.775 31.189 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 25.919 35.372 29.591 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 25.271 34.482 30.883 1.00 0.00 H new ATOM 114 N THR A 7 30.192 31.840 25.760 1.00 0.00 N ATOM 115 CA THR A 7 31.562 31.682 25.327 1.00 0.00 C ATOM 116 C THR A 7 32.472 31.748 26.560 1.00 0.00 C ATOM 117 O THR A 7 32.084 32.136 27.656 1.00 0.00 O ATOM 118 CB THR A 7 31.928 32.812 24.357 1.00 0.00 C ATOM 119 OG1 THR A 7 31.589 34.068 24.914 1.00 0.00 O ATOM 120 CG2 THR A 7 31.250 32.770 22.992 1.00 0.00 C ATOM 0 H THR A 7 29.897 32.815 25.706 1.00 0.00 H new ATOM 0 HA THR A 7 31.687 30.725 24.820 1.00 0.00 H new ATOM 0 HB THR A 7 32.998 32.669 24.205 1.00 0.00 H new ATOM 0 HG1 THR A 7 30.637 34.247 24.763 1.00 0.00 H new ATOM 0 HG21 THR A 7 31.585 33.617 22.393 1.00 0.00 H new ATOM 0 HG22 THR A 7 31.511 31.841 22.485 1.00 0.00 H new ATOM 0 HG23 THR A 7 30.169 32.822 23.121 1.00 0.00 H new ATOM 128 N LEU A 8 33.664 31.194 26.363 1.00 0.00 N ATOM 129 CA LEU A 8 34.664 31.186 27.409 1.00 0.00 C ATOM 130 C LEU A 8 35.163 32.576 27.803 1.00 0.00 C ATOM 131 O LEU A 8 35.512 32.731 28.978 1.00 0.00 O ATOM 132 CB LEU A 8 35.811 30.292 26.922 1.00 0.00 C ATOM 133 CG LEU A 8 36.583 29.640 28.057 1.00 0.00 C ATOM 134 CD1 LEU A 8 35.955 28.410 28.718 1.00 0.00 C ATOM 135 CD2 LEU A 8 38.008 29.277 27.628 1.00 0.00 C ATOM 0 H LEU A 8 33.954 30.749 25.492 1.00 0.00 H new ATOM 0 HA LEU A 8 34.216 30.798 28.324 1.00 0.00 H new ATOM 0 HB2 LEU A 8 35.407 29.515 26.272 1.00 0.00 H new ATOM 0 HB3 LEU A 8 36.497 30.887 26.319 1.00 0.00 H new ATOM 0 HG LEU A 8 36.568 30.421 28.817 1.00 0.00 H new ATOM 0 HD11 LEU A 8 36.611 28.048 29.510 1.00 0.00 H new ATOM 0 HD12 LEU A 8 34.988 28.679 29.143 1.00 0.00 H new ATOM 0 HD13 LEU A 8 35.819 27.626 27.973 1.00 0.00 H new ATOM 0 HD21 LEU A 8 38.532 28.813 28.463 1.00 0.00 H new ATOM 0 HD22 LEU A 8 37.970 28.580 26.791 1.00 0.00 H new ATOM 0 HD23 LEU A 8 38.538 30.180 27.324 1.00 0.00 H new ATOM 147 N THR A 9 35.213 33.571 26.928 1.00 0.00 N ATOM 148 CA THR A 9 35.387 34.985 27.200 1.00 0.00 C ATOM 149 C THR A 9 34.170 35.674 27.811 1.00 0.00 C ATOM 150 O THR A 9 34.105 36.886 27.995 1.00 0.00 O ATOM 151 CB THR A 9 35.747 35.628 25.858 1.00 0.00 C ATOM 152 OG1 THR A 9 34.834 35.275 24.849 1.00 0.00 O ATOM 153 CG2 THR A 9 37.156 35.266 25.380 1.00 0.00 C ATOM 0 H THR A 9 35.125 33.391 25.928 1.00 0.00 H new ATOM 0 HA THR A 9 36.164 35.103 27.956 1.00 0.00 H new ATOM 0 HB THR A 9 35.705 36.702 26.039 1.00 0.00 H new ATOM 0 HG1 THR A 9 35.094 35.705 24.008 1.00 0.00 H new ATOM 0 HG21 THR A 9 37.352 35.752 24.424 1.00 0.00 H new ATOM 0 HG22 THR A 9 37.887 35.603 26.115 1.00 0.00 H new ATOM 0 HG23 THR A 9 37.233 34.185 25.260 1.00 0.00 H new ATOM 161 N GLY A 10 33.110 34.932 28.125 1.00 0.00 N ATOM 162 CA GLY A 10 31.958 35.450 28.843 1.00 0.00 C ATOM 163 C GLY A 10 30.994 36.253 27.968 1.00 0.00 C ATOM 164 O GLY A 10 30.178 36.918 28.602 1.00 0.00 O ATOM 0 H GLY A 10 33.031 33.944 27.883 1.00 0.00 H new ATOM 0 HA2 GLY A 10 31.417 34.617 29.293 1.00 0.00 H new ATOM 0 HA3 GLY A 10 32.305 36.083 29.660 1.00 0.00 H new ATOM 168 N LYS A 11 31.002 36.188 26.636 1.00 0.00 N ATOM 169 CA LYS A 11 30.018 36.832 25.792 1.00 0.00 C ATOM 170 C LYS A 11 28.854 35.834 25.713 1.00 0.00 C ATOM 171 O LYS A 11 29.019 34.642 25.430 1.00 0.00 O ATOM 172 CB LYS A 11 30.581 37.019 24.385 1.00 0.00 C ATOM 173 CG LYS A 11 31.901 37.785 24.441 1.00 0.00 C ATOM 174 CD LYS A 11 32.463 38.333 23.128 1.00 0.00 C ATOM 175 CE LYS A 11 33.943 38.715 23.223 1.00 0.00 C ATOM 176 NZ LYS A 11 34.517 38.786 21.875 1.00 0.00 N ATOM 0 H LYS A 11 31.710 35.674 26.112 1.00 0.00 H new ATOM 0 HA LYS A 11 29.727 37.807 26.183 1.00 0.00 H new ATOM 0 HB2 LYS A 11 30.736 36.048 23.916 1.00 0.00 H new ATOM 0 HB3 LYS A 11 29.864 37.561 23.768 1.00 0.00 H new ATOM 0 HG2 LYS A 11 31.773 38.623 25.126 1.00 0.00 H new ATOM 0 HG3 LYS A 11 32.652 37.127 24.878 1.00 0.00 H new ATOM 0 HD2 LYS A 11 32.336 37.585 22.345 1.00 0.00 H new ATOM 0 HD3 LYS A 11 31.886 39.208 22.830 1.00 0.00 H new ATOM 0 HE2 LYS A 11 34.050 39.676 23.727 1.00 0.00 H new ATOM 0 HE3 LYS A 11 34.482 37.980 23.821 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 35.555 38.809 21.940 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 34.223 37.952 21.328 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 34.181 39.648 21.400 1.00 0.00 H new ATOM 190 N THR A 12 27.686 36.283 26.139 1.00 0.00 N ATOM 191 CA THR A 12 26.403 35.623 26.064 1.00 0.00 C ATOM 192 C THR A 12 25.808 35.946 24.693 1.00 0.00 C ATOM 193 O THR A 12 24.839 36.691 24.554 1.00 0.00 O ATOM 194 CB THR A 12 25.476 36.232 27.115 1.00 0.00 C ATOM 195 OG1 THR A 12 26.018 36.380 28.410 1.00 0.00 O ATOM 196 CG2 THR A 12 24.193 35.539 27.581 1.00 0.00 C ATOM 0 H THR A 12 27.610 37.198 26.584 1.00 0.00 H new ATOM 0 HA THR A 12 26.511 34.550 26.222 1.00 0.00 H new ATOM 0 HB THR A 12 25.297 37.107 26.489 1.00 0.00 H new ATOM 0 HG1 THR A 12 26.876 35.909 28.461 1.00 0.00 H new ATOM 0 HG21 THR A 12 23.698 36.156 28.330 1.00 0.00 H new ATOM 0 HG22 THR A 12 23.527 35.397 26.730 1.00 0.00 H new ATOM 0 HG23 THR A 12 24.440 34.570 28.015 1.00 0.00 H new ATOM 204 N ILE A 13 26.488 35.483 23.647 1.00 0.00 N ATOM 205 CA ILE A 13 26.083 35.539 22.258 1.00 0.00 C ATOM 206 C ILE A 13 24.664 35.004 22.054 1.00 0.00 C ATOM 207 O ILE A 13 24.390 33.834 22.327 1.00 0.00 O ATOM 208 CB ILE A 13 27.105 34.668 21.536 1.00 0.00 C ATOM 209 CG1 ILE A 13 28.518 35.241 21.688 1.00 0.00 C ATOM 210 CG2 ILE A 13 26.859 34.489 20.038 1.00 0.00 C ATOM 211 CD1 ILE A 13 28.891 36.446 20.824 1.00 0.00 C ATOM 0 H ILE A 13 27.395 35.031 23.762 1.00 0.00 H new ATOM 0 HA ILE A 13 26.059 36.562 21.882 1.00 0.00 H new ATOM 0 HB ILE A 13 26.998 33.695 22.015 1.00 0.00 H new ATOM 0 HG12 ILE A 13 28.656 35.521 22.732 1.00 0.00 H new ATOM 0 HG13 ILE A 13 29.229 34.442 21.475 1.00 0.00 H new ATOM 0 HG21 ILE A 13 27.638 33.855 19.615 1.00 0.00 H new ATOM 0 HG22 ILE A 13 25.886 34.022 19.882 1.00 0.00 H new ATOM 0 HG23 ILE A 13 26.877 35.462 19.547 1.00 0.00 H new ATOM 0 HD11 ILE A 13 29.918 36.743 21.037 1.00 0.00 H new ATOM 0 HD12 ILE A 13 28.801 36.180 19.771 1.00 0.00 H new ATOM 0 HD13 ILE A 13 28.220 37.275 21.047 1.00 0.00 H new ATOM 223 N THR A 14 23.758 35.826 21.523 1.00 0.00 N ATOM 224 CA THR A 14 22.409 35.419 21.164 1.00 0.00 C ATOM 225 C THR A 14 22.495 34.912 19.719 1.00 0.00 C ATOM 226 O THR A 14 23.154 35.532 18.885 1.00 0.00 O ATOM 227 CB THR A 14 21.489 36.639 21.152 1.00 0.00 C ATOM 228 OG1 THR A 14 21.581 37.260 22.416 1.00 0.00 O ATOM 229 CG2 THR A 14 20.024 36.318 20.861 1.00 0.00 C ATOM 0 H THR A 14 23.949 36.809 21.329 1.00 0.00 H new ATOM 0 HA THR A 14 22.029 34.675 21.864 1.00 0.00 H new ATOM 0 HB THR A 14 21.821 37.286 20.340 1.00 0.00 H new ATOM 0 HG1 THR A 14 21.271 36.640 23.109 1.00 0.00 H new ATOM 0 HG21 THR A 14 19.441 37.239 20.871 1.00 0.00 H new ATOM 0 HG22 THR A 14 19.942 35.847 19.881 1.00 0.00 H new ATOM 0 HG23 THR A 14 19.642 35.638 21.623 1.00 0.00 H new ATOM 237 N LEU A 15 21.836 33.790 19.434 1.00 0.00 N ATOM 238 CA LEU A 15 21.742 33.162 18.126 1.00 0.00 C ATOM 239 C LEU A 15 20.260 33.075 17.779 1.00 0.00 C ATOM 240 O LEU A 15 19.539 32.429 18.543 1.00 0.00 O ATOM 241 CB LEU A 15 22.417 31.798 18.068 1.00 0.00 C ATOM 242 CG LEU A 15 23.953 31.859 18.122 1.00 0.00 C ATOM 243 CD1 LEU A 15 24.599 30.482 17.949 1.00 0.00 C ATOM 244 CD2 LEU A 15 24.538 32.721 17.001 1.00 0.00 C ATOM 0 H LEU A 15 21.328 33.271 20.150 1.00 0.00 H new ATOM 0 HA LEU A 15 22.279 33.764 17.393 1.00 0.00 H new ATOM 0 HB2 LEU A 15 22.058 31.190 18.899 1.00 0.00 H new ATOM 0 HB3 LEU A 15 22.115 31.293 17.150 1.00 0.00 H new ATOM 0 HG LEU A 15 24.170 32.278 19.104 1.00 0.00 H new ATOM 0 HD11 LEU A 15 25.684 30.581 17.995 1.00 0.00 H new ATOM 0 HD12 LEU A 15 24.261 29.819 18.745 1.00 0.00 H new ATOM 0 HD13 LEU A 15 24.313 30.065 16.983 1.00 0.00 H new ATOM 0 HD21 LEU A 15 25.625 32.733 17.081 1.00 0.00 H new ATOM 0 HD22 LEU A 15 24.250 32.306 16.035 1.00 0.00 H new ATOM 0 HD23 LEU A 15 24.156 33.738 17.087 1.00 0.00 H new ATOM 256 N GLU A 16 19.887 33.334 16.528 1.00 0.00 N ATOM 257 CA GLU A 16 18.591 33.060 15.954 1.00 0.00 C ATOM 258 C GLU A 16 18.689 31.617 15.452 1.00 0.00 C ATOM 259 O GLU A 16 19.608 31.314 14.682 1.00 0.00 O ATOM 260 CB GLU A 16 18.271 33.960 14.762 1.00 0.00 C ATOM 261 CG GLU A 16 17.979 35.424 15.073 1.00 0.00 C ATOM 262 CD GLU A 16 19.161 36.332 15.366 1.00 0.00 C ATOM 263 OE1 GLU A 16 20.309 35.890 15.189 1.00 0.00 O ATOM 264 OE2 GLU A 16 18.913 37.534 15.582 1.00 0.00 O ATOM 0 H GLU A 16 20.524 33.765 15.858 1.00 0.00 H new ATOM 0 HA GLU A 16 17.808 33.230 16.693 1.00 0.00 H new ATOM 0 HB2 GLU A 16 19.111 33.920 14.069 1.00 0.00 H new ATOM 0 HB3 GLU A 16 17.409 33.543 14.242 1.00 0.00 H new ATOM 0 HG2 GLU A 16 17.434 35.844 14.228 1.00 0.00 H new ATOM 0 HG3 GLU A 16 17.309 35.457 15.932 1.00 0.00 H new ATOM 271 N VAL A 17 17.763 30.723 15.781 1.00 0.00 N ATOM 272 CA VAL A 17 17.682 29.322 15.422 1.00 0.00 C ATOM 273 C VAL A 17 16.267 28.838 15.105 1.00 0.00 C ATOM 274 O VAL A 17 15.305 29.535 15.427 1.00 0.00 O ATOM 275 CB VAL A 17 18.565 28.453 16.325 1.00 0.00 C ATOM 276 CG1 VAL A 17 20.027 28.872 16.360 1.00 0.00 C ATOM 277 CG2 VAL A 17 17.901 28.409 17.708 1.00 0.00 C ATOM 0 H VAL A 17 16.973 30.995 16.365 1.00 0.00 H new ATOM 0 HA VAL A 17 18.140 29.192 14.441 1.00 0.00 H new ATOM 0 HB VAL A 17 18.624 27.447 15.910 1.00 0.00 H new ATOM 0 HG11 VAL A 17 20.581 28.206 17.022 1.00 0.00 H new ATOM 0 HG12 VAL A 17 20.446 28.816 15.355 1.00 0.00 H new ATOM 0 HG13 VAL A 17 20.104 29.895 16.728 1.00 0.00 H new ATOM 0 HG21 VAL A 17 18.502 27.798 18.381 1.00 0.00 H new ATOM 0 HG22 VAL A 17 17.825 29.420 18.107 1.00 0.00 H new ATOM 0 HG23 VAL A 17 16.904 27.978 17.619 1.00 0.00 H new ATOM 287 N GLU A 18 16.200 27.783 14.293 1.00 0.00 N ATOM 288 CA GLU A 18 14.994 27.047 13.991 1.00 0.00 C ATOM 289 C GLU A 18 15.113 25.601 14.469 1.00 0.00 C ATOM 290 O GLU A 18 16.253 25.269 14.792 1.00 0.00 O ATOM 291 CB GLU A 18 14.840 27.270 12.486 1.00 0.00 C ATOM 292 CG GLU A 18 13.965 28.467 12.100 1.00 0.00 C ATOM 293 CD GLU A 18 12.491 28.090 12.186 1.00 0.00 C ATOM 294 OE1 GLU A 18 11.954 27.396 11.303 1.00 0.00 O ATOM 295 OE2 GLU A 18 11.816 28.482 13.158 1.00 0.00 O ATOM 0 H GLU A 18 17.021 27.412 13.815 1.00 0.00 H new ATOM 0 HA GLU A 18 14.090 27.371 14.506 1.00 0.00 H new ATOM 0 HB2 GLU A 18 15.830 27.406 12.050 1.00 0.00 H new ATOM 0 HB3 GLU A 18 14.416 26.370 12.041 1.00 0.00 H new ATOM 0 HG2 GLU A 18 14.172 29.307 12.763 1.00 0.00 H new ATOM 0 HG3 GLU A 18 14.206 28.792 11.088 1.00 0.00 H new ATOM 302 N PRO A 19 14.072 24.769 14.457 1.00 0.00 N ATOM 303 CA PRO A 19 14.228 23.497 15.127 1.00 0.00 C ATOM 304 C PRO A 19 14.971 22.374 14.395 1.00 0.00 C ATOM 305 O PRO A 19 15.748 21.650 15.012 1.00 0.00 O ATOM 306 CB PRO A 19 12.779 23.049 15.346 1.00 0.00 C ATOM 307 CG PRO A 19 12.085 23.620 14.098 1.00 0.00 C ATOM 308 CD PRO A 19 12.796 24.934 13.805 1.00 0.00 C ATOM 0 HA PRO A 19 14.854 23.657 16.005 1.00 0.00 H new ATOM 0 HB2 PRO A 19 12.690 21.964 15.404 1.00 0.00 H new ATOM 0 HB3 PRO A 19 12.361 23.453 16.268 1.00 0.00 H new ATOM 0 HG2 PRO A 19 12.165 22.933 13.255 1.00 0.00 H new ATOM 0 HG3 PRO A 19 11.022 23.780 14.278 1.00 0.00 H new ATOM 0 HD2 PRO A 19 12.909 25.101 12.734 1.00 0.00 H new ATOM 0 HD3 PRO A 19 12.247 25.787 14.204 1.00 0.00 H new ATOM 316 N SER A 20 14.971 22.337 13.072 1.00 0.00 N ATOM 317 CA SER A 20 15.682 21.313 12.344 1.00 0.00 C ATOM 318 C SER A 20 17.158 21.587 12.048 1.00 0.00 C ATOM 319 O SER A 20 17.873 20.860 11.352 1.00 0.00 O ATOM 320 CB SER A 20 14.853 21.083 11.079 1.00 0.00 C ATOM 321 OG SER A 20 15.186 19.818 10.543 1.00 0.00 O ATOM 0 H SER A 20 14.482 23.011 12.483 1.00 0.00 H new ATOM 0 HA SER A 20 15.766 20.422 12.967 1.00 0.00 H new ATOM 0 HB2 SER A 20 13.789 21.127 11.311 1.00 0.00 H new ATOM 0 HB3 SER A 20 15.052 21.867 10.349 1.00 0.00 H new ATOM 0 HG SER A 20 16.158 19.697 10.571 1.00 0.00 H new ATOM 327 N ASP A 21 17.572 22.803 12.396 1.00 0.00 N ATOM 328 CA ASP A 21 18.905 23.347 12.280 1.00 0.00 C ATOM 329 C ASP A 21 19.882 22.425 13.002 1.00 0.00 C ATOM 330 O ASP A 21 19.705 22.043 14.152 1.00 0.00 O ATOM 331 CB ASP A 21 19.164 24.692 12.981 1.00 0.00 C ATOM 332 CG ASP A 21 18.976 25.833 11.993 1.00 0.00 C ATOM 333 OD1 ASP A 21 19.613 25.695 10.922 1.00 0.00 O ATOM 334 OD2 ASP A 21 18.109 26.704 12.242 1.00 0.00 O ATOM 0 H ASP A 21 16.924 23.481 12.798 1.00 0.00 H new ATOM 0 HA ASP A 21 19.027 23.461 11.203 1.00 0.00 H new ATOM 0 HB2 ASP A 21 18.481 24.811 13.822 1.00 0.00 H new ATOM 0 HB3 ASP A 21 20.176 24.713 13.386 1.00 0.00 H new ATOM 339 N THR A 22 20.914 21.899 12.335 1.00 0.00 N ATOM 340 CA THR A 22 21.872 21.007 12.953 1.00 0.00 C ATOM 341 C THR A 22 22.983 21.793 13.637 1.00 0.00 C ATOM 342 O THR A 22 23.024 23.014 13.529 1.00 0.00 O ATOM 343 CB THR A 22 22.489 20.136 11.863 1.00 0.00 C ATOM 344 OG1 THR A 22 22.775 20.945 10.742 1.00 0.00 O ATOM 345 CG2 THR A 22 21.482 19.072 11.439 1.00 0.00 C ATOM 0 H THR A 22 21.100 22.087 11.350 1.00 0.00 H new ATOM 0 HA THR A 22 21.362 20.400 13.701 1.00 0.00 H new ATOM 0 HB THR A 22 23.397 19.666 12.240 1.00 0.00 H new ATOM 0 HG1 THR A 22 23.174 20.396 10.035 1.00 0.00 H new ATOM 0 HG21 THR A 22 21.919 18.447 10.660 1.00 0.00 H new ATOM 0 HG22 THR A 22 21.223 18.453 12.298 1.00 0.00 H new ATOM 0 HG23 THR A 22 20.583 19.554 11.055 1.00 0.00 H new ATOM 353 N ILE A 23 23.772 21.043 14.402 1.00 0.00 N ATOM 354 CA ILE A 23 24.917 21.517 15.159 1.00 0.00 C ATOM 355 C ILE A 23 25.981 22.097 14.236 1.00 0.00 C ATOM 356 O ILE A 23 26.726 22.990 14.650 1.00 0.00 O ATOM 357 CB ILE A 23 25.411 20.377 16.046 1.00 0.00 C ATOM 358 CG1 ILE A 23 24.328 19.704 16.904 1.00 0.00 C ATOM 359 CG2 ILE A 23 26.617 20.668 16.939 1.00 0.00 C ATOM 360 CD1 ILE A 23 24.748 18.285 17.301 1.00 0.00 C ATOM 0 H ILE A 23 23.619 20.041 14.513 1.00 0.00 H new ATOM 0 HA ILE A 23 24.638 22.344 15.812 1.00 0.00 H new ATOM 0 HB ILE A 23 25.742 19.687 15.270 1.00 0.00 H new ATOM 0 HG12 ILE A 23 24.147 20.298 17.800 1.00 0.00 H new ATOM 0 HG13 ILE A 23 23.390 19.668 16.350 1.00 0.00 H new ATOM 0 HG21 ILE A 23 26.865 19.778 17.516 1.00 0.00 H new ATOM 0 HG22 ILE A 23 27.469 20.948 16.320 1.00 0.00 H new ATOM 0 HG23 ILE A 23 26.378 21.486 17.619 1.00 0.00 H new ATOM 0 HD11 ILE A 23 23.965 17.830 17.908 1.00 0.00 H new ATOM 0 HD12 ILE A 23 24.905 17.687 16.403 1.00 0.00 H new ATOM 0 HD13 ILE A 23 25.674 18.327 17.875 1.00 0.00 H new ATOM 372 N GLU A 24 26.085 21.658 12.988 1.00 0.00 N ATOM 373 CA GLU A 24 26.994 22.245 12.012 1.00 0.00 C ATOM 374 C GLU A 24 26.484 23.643 11.700 1.00 0.00 C ATOM 375 O GLU A 24 27.238 24.612 11.584 1.00 0.00 O ATOM 376 CB GLU A 24 27.028 21.509 10.680 1.00 0.00 C ATOM 377 CG GLU A 24 27.579 20.081 10.765 1.00 0.00 C ATOM 378 CD GLU A 24 29.075 19.920 10.540 1.00 0.00 C ATOM 379 OE1 GLU A 24 29.489 19.787 9.364 1.00 0.00 O ATOM 380 OE2 GLU A 24 29.803 20.151 11.527 1.00 0.00 O ATOM 0 H GLU A 24 25.537 20.879 12.622 1.00 0.00 H new ATOM 0 HA GLU A 24 27.992 22.210 12.449 1.00 0.00 H new ATOM 0 HB2 GLU A 24 26.018 21.473 10.272 1.00 0.00 H new ATOM 0 HB3 GLU A 24 27.636 22.080 9.978 1.00 0.00 H new ATOM 0 HG2 GLU A 24 27.336 19.679 11.748 1.00 0.00 H new ATOM 0 HG3 GLU A 24 27.055 19.468 10.032 1.00 0.00 H new ATOM 387 N ASN A 25 25.174 23.823 11.514 1.00 0.00 N ATOM 388 CA ASN A 25 24.557 25.136 11.451 1.00 0.00 C ATOM 389 C ASN A 25 24.808 26.087 12.622 1.00 0.00 C ATOM 390 O ASN A 25 25.104 27.258 12.366 1.00 0.00 O ATOM 391 CB ASN A 25 23.088 25.153 11.036 1.00 0.00 C ATOM 392 CG ASN A 25 22.843 24.725 9.593 1.00 0.00 C ATOM 393 OD1 ASN A 25 23.743 24.273 8.889 1.00 0.00 O ATOM 394 ND2 ASN A 25 21.586 24.734 9.157 1.00 0.00 N ATOM 0 H ASN A 25 24.514 23.053 11.403 1.00 0.00 H new ATOM 0 HA ASN A 25 25.131 25.553 10.624 1.00 0.00 H new ATOM 0 HB2 ASN A 25 22.527 24.495 11.699 1.00 0.00 H new ATOM 0 HB3 ASN A 25 22.693 26.159 11.177 1.00 0.00 H new ATOM 0 HD21 ASN A 25 21.364 24.364 8.233 1.00 0.00 H new ATOM 0 HD22 ASN A 25 20.844 25.111 9.747 1.00 0.00 H new ATOM 401 N VAL A 26 24.769 25.557 13.841 1.00 0.00 N ATOM 402 CA VAL A 26 25.070 26.328 15.034 1.00 0.00 C ATOM 403 C VAL A 26 26.580 26.573 15.104 1.00 0.00 C ATOM 404 O VAL A 26 27.011 27.718 15.069 1.00 0.00 O ATOM 405 CB VAL A 26 24.486 25.626 16.264 1.00 0.00 C ATOM 406 CG1 VAL A 26 24.907 26.257 17.585 1.00 0.00 C ATOM 407 CG2 VAL A 26 22.965 25.666 16.152 1.00 0.00 C ATOM 0 H VAL A 26 24.528 24.583 14.025 1.00 0.00 H new ATOM 0 HA VAL A 26 24.599 27.310 15.002 1.00 0.00 H new ATOM 0 HB VAL A 26 24.871 24.606 16.274 1.00 0.00 H new ATOM 0 HG11 VAL A 26 24.456 25.707 18.411 1.00 0.00 H new ATOM 0 HG12 VAL A 26 25.993 26.221 17.676 1.00 0.00 H new ATOM 0 HG13 VAL A 26 24.574 27.295 17.615 1.00 0.00 H new ATOM 0 HG21 VAL A 26 22.523 25.172 17.017 1.00 0.00 H new ATOM 0 HG22 VAL A 26 22.630 26.703 16.116 1.00 0.00 H new ATOM 0 HG23 VAL A 26 22.654 25.152 15.242 1.00 0.00 H new ATOM 417 N LYS A 27 27.459 25.584 15.021 1.00 0.00 N ATOM 418 CA LYS A 27 28.891 25.764 14.833 1.00 0.00 C ATOM 419 C LYS A 27 29.339 26.781 13.784 1.00 0.00 C ATOM 420 O LYS A 27 30.214 27.556 14.171 1.00 0.00 O ATOM 421 CB LYS A 27 29.689 24.499 14.526 1.00 0.00 C ATOM 422 CG LYS A 27 29.745 23.571 15.738 1.00 0.00 C ATOM 423 CD LYS A 27 30.420 22.203 15.562 1.00 0.00 C ATOM 424 CE LYS A 27 29.974 21.359 14.365 1.00 0.00 C ATOM 425 NZ LYS A 27 30.680 20.097 14.097 1.00 0.00 N ATOM 0 H LYS A 27 27.186 24.603 15.085 1.00 0.00 H new ATOM 0 HA LYS A 27 29.112 26.141 15.831 1.00 0.00 H new ATOM 0 HB2 LYS A 27 29.235 23.975 13.685 1.00 0.00 H new ATOM 0 HB3 LYS A 27 30.701 24.769 14.225 1.00 0.00 H new ATOM 0 HG2 LYS A 27 30.261 24.098 16.540 1.00 0.00 H new ATOM 0 HG3 LYS A 27 28.723 23.399 16.076 1.00 0.00 H new ATOM 0 HD2 LYS A 27 31.495 22.363 15.482 1.00 0.00 H new ATOM 0 HD3 LYS A 27 30.251 21.622 16.469 1.00 0.00 H new ATOM 0 HE2 LYS A 27 28.917 21.127 14.498 1.00 0.00 H new ATOM 0 HE3 LYS A 27 30.054 21.980 13.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 30.663 19.900 13.076 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 31.666 20.176 14.418 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 30.211 19.322 14.607 1.00 0.00 H new ATOM 439 N ALA A 28 28.631 26.875 12.665 1.00 0.00 N ATOM 440 CA ALA A 28 28.976 27.866 11.670 1.00 0.00 C ATOM 441 C ALA A 28 28.513 29.268 12.080 1.00 0.00 C ATOM 442 O ALA A 28 29.264 30.200 11.816 1.00 0.00 O ATOM 443 CB ALA A 28 28.254 27.551 10.360 1.00 0.00 C ATOM 0 H ALA A 28 27.831 26.287 12.432 1.00 0.00 H new ATOM 0 HA ALA A 28 30.061 27.841 11.564 1.00 0.00 H new ATOM 0 HB1 ALA A 28 28.515 28.299 9.612 1.00 0.00 H new ATOM 0 HB2 ALA A 28 28.554 26.564 10.007 1.00 0.00 H new ATOM 0 HB3 ALA A 28 27.177 27.565 10.526 1.00 0.00 H new ATOM 449 N LYS A 29 27.331 29.328 12.703 1.00 0.00 N ATOM 450 CA LYS A 29 26.719 30.516 13.259 1.00 0.00 C ATOM 451 C LYS A 29 27.652 31.168 14.277 1.00 0.00 C ATOM 452 O LYS A 29 27.981 32.353 14.198 1.00 0.00 O ATOM 453 CB LYS A 29 25.294 30.352 13.789 1.00 0.00 C ATOM 454 CG LYS A 29 24.231 30.405 12.683 1.00 0.00 C ATOM 455 CD LYS A 29 22.770 30.179 13.075 1.00 0.00 C ATOM 456 CE LYS A 29 21.893 30.661 11.931 1.00 0.00 C ATOM 457 NZ LYS A 29 20.448 30.493 12.136 1.00 0.00 N ATOM 0 H LYS A 29 26.753 28.498 12.834 1.00 0.00 H new ATOM 0 HA LYS A 29 26.582 31.190 12.413 1.00 0.00 H new ATOM 0 HB2 LYS A 29 25.216 29.401 14.315 1.00 0.00 H new ATOM 0 HB3 LYS A 29 25.091 31.137 14.518 1.00 0.00 H new ATOM 0 HG2 LYS A 29 24.300 31.380 12.201 1.00 0.00 H new ATOM 0 HG3 LYS A 29 24.494 29.660 11.932 1.00 0.00 H new ATOM 0 HD2 LYS A 29 22.589 29.123 13.274 1.00 0.00 H new ATOM 0 HD3 LYS A 29 22.533 30.721 13.990 1.00 0.00 H new ATOM 0 HE2 LYS A 29 22.099 31.717 11.757 1.00 0.00 H new ATOM 0 HE3 LYS A 29 22.180 30.127 11.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 19.932 30.941 11.352 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 20.217 29.479 12.168 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 20.170 30.940 13.033 1.00 0.00 H new ATOM 471 N ILE A 30 28.159 30.365 15.217 1.00 0.00 N ATOM 472 CA ILE A 30 29.032 30.821 16.274 1.00 0.00 C ATOM 473 C ILE A 30 30.366 31.282 15.668 1.00 0.00 C ATOM 474 O ILE A 30 30.913 32.261 16.177 1.00 0.00 O ATOM 475 CB ILE A 30 29.250 29.782 17.371 1.00 0.00 C ATOM 476 CG1 ILE A 30 27.936 29.337 18.010 1.00 0.00 C ATOM 477 CG2 ILE A 30 30.310 30.056 18.445 1.00 0.00 C ATOM 478 CD1 ILE A 30 27.963 28.064 18.863 1.00 0.00 C ATOM 0 H ILE A 30 27.964 29.365 15.255 1.00 0.00 H new ATOM 0 HA ILE A 30 28.541 31.661 16.766 1.00 0.00 H new ATOM 0 HB ILE A 30 29.697 28.969 16.798 1.00 0.00 H new ATOM 0 HG12 ILE A 30 27.571 30.153 18.634 1.00 0.00 H new ATOM 0 HG13 ILE A 30 27.206 29.194 17.214 1.00 0.00 H new ATOM 0 HG21 ILE A 30 30.340 29.223 19.148 1.00 0.00 H new ATOM 0 HG22 ILE A 30 31.286 30.168 17.973 1.00 0.00 H new ATOM 0 HG23 ILE A 30 30.058 30.972 18.979 1.00 0.00 H new ATOM 0 HD11 ILE A 30 26.965 27.866 19.254 1.00 0.00 H new ATOM 0 HD12 ILE A 30 28.286 27.222 18.250 1.00 0.00 H new ATOM 0 HD13 ILE A 30 28.657 28.197 19.693 1.00 0.00 H new ATOM 490 N GLN A 31 30.852 30.717 14.565 1.00 0.00 N ATOM 491 CA GLN A 31 32.038 31.184 13.883 1.00 0.00 C ATOM 492 C GLN A 31 31.792 32.549 13.246 1.00 0.00 C ATOM 493 O GLN A 31 32.568 33.462 13.502 1.00 0.00 O ATOM 494 CB GLN A 31 32.339 30.124 12.819 1.00 0.00 C ATOM 495 CG GLN A 31 33.493 30.484 11.879 1.00 0.00 C ATOM 496 CD GLN A 31 33.693 29.435 10.796 1.00 0.00 C ATOM 497 OE1 GLN A 31 32.684 29.052 10.209 1.00 0.00 O ATOM 498 NE2 GLN A 31 34.948 29.107 10.473 1.00 0.00 N ATOM 0 H GLN A 31 30.419 29.908 14.119 1.00 0.00 H new ATOM 0 HA GLN A 31 32.877 31.313 14.567 1.00 0.00 H new ATOM 0 HB2 GLN A 31 32.571 29.182 13.317 1.00 0.00 H new ATOM 0 HB3 GLN A 31 31.441 29.957 12.225 1.00 0.00 H new ATOM 0 HG2 GLN A 31 33.295 31.451 11.416 1.00 0.00 H new ATOM 0 HG3 GLN A 31 34.412 30.589 12.456 1.00 0.00 H new ATOM 0 HE21 GLN A 31 35.728 29.474 11.019 1.00 0.00 H new ATOM 0 HE22 GLN A 31 35.126 28.490 9.680 1.00 0.00 H new ATOM 507 N ASP A 32 30.667 32.590 12.540 1.00 0.00 N ATOM 508 CA ASP A 32 30.035 33.769 11.997 1.00 0.00 C ATOM 509 C ASP A 32 29.990 34.957 12.964 1.00 0.00 C ATOM 510 O ASP A 32 30.288 36.095 12.614 1.00 0.00 O ATOM 511 CB ASP A 32 28.707 33.488 11.289 1.00 0.00 C ATOM 512 CG ASP A 32 28.052 34.729 10.705 1.00 0.00 C ATOM 513 OD1 ASP A 32 28.560 35.201 9.665 1.00 0.00 O ATOM 514 OD2 ASP A 32 27.112 35.228 11.367 1.00 0.00 O ATOM 0 H ASP A 32 30.145 31.741 12.322 1.00 0.00 H new ATOM 0 HA ASP A 32 30.705 34.097 11.202 1.00 0.00 H new ATOM 0 HB2 ASP A 32 28.877 32.767 10.489 1.00 0.00 H new ATOM 0 HB3 ASP A 32 28.020 33.024 11.996 1.00 0.00 H new ATOM 519 N LYS A 33 29.705 34.686 14.242 1.00 0.00 N ATOM 520 CA LYS A 33 29.757 35.613 15.348 1.00 0.00 C ATOM 521 C LYS A 33 31.161 35.901 15.874 1.00 0.00 C ATOM 522 O LYS A 33 31.614 37.026 16.009 1.00 0.00 O ATOM 523 CB LYS A 33 28.836 35.069 16.444 1.00 0.00 C ATOM 524 CG LYS A 33 27.429 35.673 16.442 1.00 0.00 C ATOM 525 CD LYS A 33 26.611 35.345 15.189 1.00 0.00 C ATOM 526 CE LYS A 33 25.238 35.973 15.400 1.00 0.00 C ATOM 527 NZ LYS A 33 24.473 36.010 14.148 1.00 0.00 N ATOM 0 H LYS A 33 29.416 33.753 14.536 1.00 0.00 H new ATOM 0 HA LYS A 33 29.417 36.586 14.994 1.00 0.00 H new ATOM 0 HB2 LYS A 33 28.755 33.988 16.331 1.00 0.00 H new ATOM 0 HB3 LYS A 33 29.297 35.254 17.414 1.00 0.00 H new ATOM 0 HG2 LYS A 33 26.890 35.315 17.319 1.00 0.00 H new ATOM 0 HG3 LYS A 33 27.510 36.756 16.537 1.00 0.00 H new ATOM 0 HD2 LYS A 33 27.089 35.747 14.296 1.00 0.00 H new ATOM 0 HD3 LYS A 33 26.529 34.267 15.049 1.00 0.00 H new ATOM 0 HE2 LYS A 33 24.687 35.405 16.149 1.00 0.00 H new ATOM 0 HE3 LYS A 33 25.354 36.985 15.788 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 23.543 36.442 14.322 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 24.990 36.572 13.442 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 24.343 35.042 13.792 1.00 0.00 H new ATOM 541 N GLU A 34 31.813 34.825 16.327 1.00 0.00 N ATOM 542 CA GLU A 34 32.970 34.934 17.197 1.00 0.00 C ATOM 543 C GLU A 34 34.347 34.758 16.567 1.00 0.00 C ATOM 544 O GLU A 34 35.327 35.278 17.083 1.00 0.00 O ATOM 545 CB GLU A 34 32.904 33.993 18.408 1.00 0.00 C ATOM 546 CG GLU A 34 32.755 34.640 19.778 1.00 0.00 C ATOM 547 CD GLU A 34 33.989 35.445 20.158 1.00 0.00 C ATOM 548 OE1 GLU A 34 35.083 34.925 20.477 1.00 0.00 O ATOM 549 OE2 GLU A 34 33.847 36.678 20.278 1.00 0.00 O ATOM 0 H GLU A 34 31.550 33.866 16.099 1.00 0.00 H new ATOM 0 HA GLU A 34 32.888 35.981 17.488 1.00 0.00 H new ATOM 0 HB2 GLU A 34 32.066 33.311 18.262 1.00 0.00 H new ATOM 0 HB3 GLU A 34 33.810 33.387 18.416 1.00 0.00 H new ATOM 0 HG2 GLU A 34 31.881 35.291 19.780 1.00 0.00 H new ATOM 0 HG3 GLU A 34 32.579 33.868 20.528 1.00 0.00 H new ATOM 556 N GLY A 35 34.381 34.104 15.408 1.00 0.00 N ATOM 557 CA GLY A 35 35.621 33.811 14.717 1.00 0.00 C ATOM 558 C GLY A 35 36.225 32.421 14.929 1.00 0.00 C ATOM 559 O GLY A 35 37.075 32.029 14.135 1.00 0.00 O ATOM 0 H GLY A 35 33.548 33.765 14.927 1.00 0.00 H new ATOM 0 HA2 GLY A 35 35.453 33.948 13.649 1.00 0.00 H new ATOM 0 HA3 GLY A 35 36.361 34.551 15.021 1.00 0.00 H new ATOM 563 N ILE A 36 35.809 31.564 15.860 1.00 0.00 N ATOM 564 CA ILE A 36 36.325 30.272 16.254 1.00 0.00 C ATOM 565 C ILE A 36 35.934 29.159 15.276 1.00 0.00 C ATOM 566 O ILE A 36 34.772 29.075 14.868 1.00 0.00 O ATOM 567 CB ILE A 36 35.627 30.058 17.595 1.00 0.00 C ATOM 568 CG1 ILE A 36 35.989 31.118 18.638 1.00 0.00 C ATOM 569 CG2 ILE A 36 36.139 28.715 18.103 1.00 0.00 C ATOM 570 CD1 ILE A 36 35.034 31.167 19.829 1.00 0.00 C ATOM 0 H ILE A 36 34.993 31.801 16.425 1.00 0.00 H new ATOM 0 HA ILE A 36 37.414 30.244 16.287 1.00 0.00 H new ATOM 0 HB ILE A 36 34.548 30.109 17.452 1.00 0.00 H new ATOM 0 HG12 ILE A 36 36.998 30.925 19.002 1.00 0.00 H new ATOM 0 HG13 ILE A 36 36.005 32.096 18.157 1.00 0.00 H new ATOM 0 HG21 ILE A 36 35.681 28.492 19.066 1.00 0.00 H new ATOM 0 HG22 ILE A 36 35.881 27.933 17.388 1.00 0.00 H new ATOM 0 HG23 ILE A 36 37.222 28.758 18.218 1.00 0.00 H new ATOM 0 HD11 ILE A 36 35.358 31.943 20.523 1.00 0.00 H new ATOM 0 HD12 ILE A 36 34.026 31.391 19.479 1.00 0.00 H new ATOM 0 HD13 ILE A 36 35.035 30.202 20.336 1.00 0.00 H new ATOM 582 N PRO A 37 36.870 28.383 14.746 1.00 0.00 N ATOM 583 CA PRO A 37 36.462 27.442 13.735 1.00 0.00 C ATOM 584 C PRO A 37 35.690 26.212 14.212 1.00 0.00 C ATOM 585 O PRO A 37 35.603 25.958 15.414 1.00 0.00 O ATOM 586 CB PRO A 37 37.800 27.114 13.068 1.00 0.00 C ATOM 587 CG PRO A 37 38.840 27.235 14.186 1.00 0.00 C ATOM 588 CD PRO A 37 38.285 28.346 15.080 1.00 0.00 C ATOM 0 HA PRO A 37 35.710 27.864 13.068 1.00 0.00 H new ATOM 0 HB2 PRO A 37 37.793 26.111 12.642 1.00 0.00 H new ATOM 0 HB3 PRO A 37 38.015 27.805 12.253 1.00 0.00 H new ATOM 0 HG2 PRO A 37 38.950 26.299 14.733 1.00 0.00 H new ATOM 0 HG3 PRO A 37 39.823 27.492 13.792 1.00 0.00 H new ATOM 0 HD2 PRO A 37 38.441 28.126 16.136 1.00 0.00 H new ATOM 0 HD3 PRO A 37 38.769 29.302 14.878 1.00 0.00 H new ATOM 596 N PRO A 38 35.080 25.418 13.335 1.00 0.00 N ATOM 597 CA PRO A 38 34.070 24.512 13.846 1.00 0.00 C ATOM 598 C PRO A 38 34.593 23.253 14.535 1.00 0.00 C ATOM 599 O PRO A 38 33.913 22.480 15.191 1.00 0.00 O ATOM 600 CB PRO A 38 33.179 24.260 12.630 1.00 0.00 C ATOM 601 CG PRO A 38 34.194 24.333 11.484 1.00 0.00 C ATOM 602 CD PRO A 38 35.146 25.465 11.886 1.00 0.00 C ATOM 0 HA PRO A 38 33.523 24.949 14.682 1.00 0.00 H new ATOM 0 HB2 PRO A 38 32.685 23.290 12.678 1.00 0.00 H new ATOM 0 HB3 PRO A 38 32.396 25.012 12.533 1.00 0.00 H new ATOM 0 HG2 PRO A 38 34.727 23.390 11.365 1.00 0.00 H new ATOM 0 HG3 PRO A 38 33.705 24.545 10.533 1.00 0.00 H new ATOM 0 HD2 PRO A 38 36.158 25.296 11.518 1.00 0.00 H new ATOM 0 HD3 PRO A 38 34.821 26.429 11.494 1.00 0.00 H new ATOM 610 N ASP A 39 35.825 22.864 14.209 1.00 0.00 N ATOM 611 CA ASP A 39 36.513 21.703 14.747 1.00 0.00 C ATOM 612 C ASP A 39 36.977 21.969 16.176 1.00 0.00 C ATOM 613 O ASP A 39 37.282 20.934 16.760 1.00 0.00 O ATOM 614 CB ASP A 39 37.668 21.340 13.809 1.00 0.00 C ATOM 615 CG ASP A 39 38.529 20.125 14.107 1.00 0.00 C ATOM 616 OD1 ASP A 39 38.081 18.978 13.849 1.00 0.00 O ATOM 617 OD2 ASP A 39 39.656 20.284 14.617 1.00 0.00 O ATOM 0 H ASP A 39 36.391 23.376 13.532 1.00 0.00 H new ATOM 0 HA ASP A 39 35.836 20.850 14.801 1.00 0.00 H new ATOM 0 HB2 ASP A 39 37.247 21.204 12.813 1.00 0.00 H new ATOM 0 HB3 ASP A 39 38.331 22.204 13.760 1.00 0.00 H new ATOM 622 N GLN A 40 37.098 23.230 16.593 1.00 0.00 N ATOM 623 CA GLN A 40 37.634 23.595 17.889 1.00 0.00 C ATOM 624 C GLN A 40 36.519 23.506 18.932 1.00 0.00 C ATOM 625 O GLN A 40 36.848 23.327 20.109 1.00 0.00 O ATOM 626 CB GLN A 40 38.089 25.046 17.811 1.00 0.00 C ATOM 627 CG GLN A 40 38.868 25.578 19.014 1.00 0.00 C ATOM 628 CD GLN A 40 40.378 25.365 18.983 1.00 0.00 C ATOM 629 OE1 GLN A 40 41.093 26.103 19.664 1.00 0.00 O ATOM 630 NE2 GLN A 40 40.965 24.554 18.106 1.00 0.00 N ATOM 0 H GLN A 40 36.820 24.032 16.027 1.00 0.00 H new ATOM 0 HA GLN A 40 38.457 22.934 18.160 1.00 0.00 H new ATOM 0 HB2 GLN A 40 38.710 25.162 16.923 1.00 0.00 H new ATOM 0 HB3 GLN A 40 37.209 25.673 17.669 1.00 0.00 H new ATOM 0 HG2 GLN A 40 38.674 26.647 19.103 1.00 0.00 H new ATOM 0 HG3 GLN A 40 38.473 25.107 19.914 1.00 0.00 H new ATOM 0 HE21 GLN A 40 40.399 23.932 17.529 1.00 0.00 H new ATOM 0 HE22 GLN A 40 41.981 24.554 18.011 1.00 0.00 H new ATOM 639 N GLN A 41 35.248 23.467 18.527 1.00 0.00 N ATOM 640 CA GLN A 41 34.192 23.570 19.509 1.00 0.00 C ATOM 641 C GLN A 41 33.598 22.221 19.907 1.00 0.00 C ATOM 642 O GLN A 41 33.298 21.337 19.104 1.00 0.00 O ATOM 643 CB GLN A 41 33.075 24.338 18.800 1.00 0.00 C ATOM 644 CG GLN A 41 33.466 25.761 18.399 1.00 0.00 C ATOM 645 CD GLN A 41 32.569 26.440 17.369 1.00 0.00 C ATOM 646 OE1 GLN A 41 31.352 26.232 17.402 1.00 0.00 O ATOM 647 NE2 GLN A 41 33.145 27.232 16.473 1.00 0.00 N ATOM 0 H GLN A 41 34.942 23.368 17.559 1.00 0.00 H new ATOM 0 HA GLN A 41 34.590 24.033 20.412 1.00 0.00 H new ATOM 0 HB2 GLN A 41 32.777 23.787 17.908 1.00 0.00 H new ATOM 0 HB3 GLN A 41 32.204 24.381 19.454 1.00 0.00 H new ATOM 0 HG2 GLN A 41 33.484 26.378 19.298 1.00 0.00 H new ATOM 0 HG3 GLN A 41 34.483 25.740 18.007 1.00 0.00 H new ATOM 0 HE21 GLN A 41 34.155 27.370 16.489 1.00 0.00 H new ATOM 0 HE22 GLN A 41 32.577 27.702 15.768 1.00 0.00 H new ATOM 656 N ARG A 42 33.376 22.090 21.213 1.00 0.00 N ATOM 657 CA ARG A 42 32.359 21.216 21.756 1.00 0.00 C ATOM 658 C ARG A 42 31.369 22.147 22.458 1.00 0.00 C ATOM 659 O ARG A 42 31.767 23.132 23.081 1.00 0.00 O ATOM 660 CB ARG A 42 32.923 20.268 22.813 1.00 0.00 C ATOM 661 CG ARG A 42 33.657 18.999 22.369 1.00 0.00 C ATOM 662 CD ARG A 42 34.084 18.074 23.501 1.00 0.00 C ATOM 663 NE ARG A 42 35.464 17.650 23.275 1.00 0.00 N ATOM 664 CZ ARG A 42 36.004 16.517 22.812 1.00 0.00 C ATOM 665 NH1 ARG A 42 35.212 15.509 22.405 1.00 0.00 N ATOM 666 NH2 ARG A 42 37.338 16.544 22.735 1.00 0.00 N ATOM 0 H ARG A 42 33.906 22.595 21.923 1.00 0.00 H new ATOM 0 HA ARG A 42 31.924 20.609 20.962 1.00 0.00 H new ATOM 0 HB2 ARG A 42 33.610 20.842 23.435 1.00 0.00 H new ATOM 0 HB3 ARG A 42 32.095 19.961 23.452 1.00 0.00 H new ATOM 0 HG2 ARG A 42 33.012 18.443 21.689 1.00 0.00 H new ATOM 0 HG3 ARG A 42 34.542 19.288 21.803 1.00 0.00 H new ATOM 0 HD2 ARG A 42 34.000 18.588 24.459 1.00 0.00 H new ATOM 0 HD3 ARG A 42 33.426 17.206 23.546 1.00 0.00 H new ATOM 0 HE ARG A 42 36.154 18.360 23.519 1.00 0.00 H new ATOM 0 HH11 ARG A 42 34.198 15.608 22.449 1.00 0.00 H new ATOM 0 HH12 ARG A 42 35.626 14.646 22.052 1.00 0.00 H new ATOM 0 HH21 ARG A 42 37.848 17.381 23.018 1.00 0.00 H new ATOM 0 HH22 ARG A 42 37.846 15.728 22.394 1.00 0.00 H new ATOM 680 N LEU A 43 30.072 21.858 22.376 1.00 0.00 N ATOM 681 CA LEU A 43 29.059 22.675 23.007 1.00 0.00 C ATOM 682 C LEU A 43 28.108 21.763 23.780 1.00 0.00 C ATOM 683 O LEU A 43 27.737 20.680 23.335 1.00 0.00 O ATOM 684 CB LEU A 43 28.342 23.504 21.944 1.00 0.00 C ATOM 685 CG LEU A 43 27.983 22.930 20.576 1.00 0.00 C ATOM 686 CD1 LEU A 43 26.661 23.459 20.006 1.00 0.00 C ATOM 687 CD2 LEU A 43 29.062 23.054 19.496 1.00 0.00 C ATOM 0 H LEU A 43 29.703 21.052 21.871 1.00 0.00 H new ATOM 0 HA LEU A 43 29.502 23.375 23.715 1.00 0.00 H new ATOM 0 HB2 LEU A 43 27.412 23.853 22.392 1.00 0.00 H new ATOM 0 HB3 LEU A 43 28.959 24.384 21.763 1.00 0.00 H new ATOM 0 HG LEU A 43 27.880 21.871 20.814 1.00 0.00 H new ATOM 0 HD11 LEU A 43 26.477 23.004 19.033 1.00 0.00 H new ATOM 0 HD12 LEU A 43 25.846 23.208 20.684 1.00 0.00 H new ATOM 0 HD13 LEU A 43 26.720 24.542 19.895 1.00 0.00 H new ATOM 0 HD21 LEU A 43 28.699 22.614 18.567 1.00 0.00 H new ATOM 0 HD22 LEU A 43 29.294 24.106 19.333 1.00 0.00 H new ATOM 0 HD23 LEU A 43 29.962 22.530 19.819 1.00 0.00 H new ATOM 699 N ILE A 44 27.717 22.192 24.974 1.00 0.00 N ATOM 700 CA ILE A 44 27.018 21.373 25.938 1.00 0.00 C ATOM 701 C ILE A 44 25.764 22.107 26.421 1.00 0.00 C ATOM 702 O ILE A 44 25.844 23.279 26.777 1.00 0.00 O ATOM 703 CB ILE A 44 27.963 20.933 27.049 1.00 0.00 C ATOM 704 CG1 ILE A 44 29.061 19.947 26.628 1.00 0.00 C ATOM 705 CG2 ILE A 44 27.226 20.485 28.308 1.00 0.00 C ATOM 706 CD1 ILE A 44 30.465 20.401 27.055 1.00 0.00 C ATOM 0 H ILE A 44 27.885 23.144 25.300 1.00 0.00 H new ATOM 0 HA ILE A 44 26.670 20.449 25.477 1.00 0.00 H new ATOM 0 HB ILE A 44 28.508 21.843 27.300 1.00 0.00 H new ATOM 0 HG12 ILE A 44 28.852 18.970 27.064 1.00 0.00 H new ATOM 0 HG13 ILE A 44 29.037 19.825 25.545 1.00 0.00 H new ATOM 0 HG21 ILE A 44 27.950 20.183 29.065 1.00 0.00 H new ATOM 0 HG22 ILE A 44 26.624 21.309 28.690 1.00 0.00 H new ATOM 0 HG23 ILE A 44 26.577 19.642 28.069 1.00 0.00 H new ATOM 0 HD11 ILE A 44 31.200 19.665 26.730 1.00 0.00 H new ATOM 0 HD12 ILE A 44 30.690 21.365 26.598 1.00 0.00 H new ATOM 0 HD13 ILE A 44 30.502 20.496 28.140 1.00 0.00 H new ATOM 718 N PHE A 45 24.653 21.382 26.485 1.00 0.00 N ATOM 719 CA PHE A 45 23.351 21.805 26.971 1.00 0.00 C ATOM 720 C PHE A 45 23.291 21.490 28.468 1.00 0.00 C ATOM 721 O PHE A 45 24.243 21.089 29.123 1.00 0.00 O ATOM 722 CB PHE A 45 22.316 21.091 26.113 1.00 0.00 C ATOM 723 CG PHE A 45 20.841 21.215 26.429 1.00 0.00 C ATOM 724 CD1 PHE A 45 20.166 22.417 26.705 1.00 0.00 C ATOM 725 CD2 PHE A 45 20.086 20.046 26.519 1.00 0.00 C ATOM 726 CE1 PHE A 45 18.853 22.444 27.185 1.00 0.00 C ATOM 727 CE2 PHE A 45 18.770 20.056 27.015 1.00 0.00 C ATOM 728 CZ PHE A 45 18.137 21.251 27.377 1.00 0.00 C ATOM 0 H PHE A 45 24.642 20.411 26.174 1.00 0.00 H new ATOM 0 HA PHE A 45 23.155 22.874 26.883 1.00 0.00 H new ATOM 0 HB2 PHE A 45 22.456 21.434 25.088 1.00 0.00 H new ATOM 0 HB3 PHE A 45 22.561 20.029 26.130 1.00 0.00 H new ATOM 0 HD1 PHE A 45 20.680 23.353 26.540 1.00 0.00 H new ATOM 0 HD2 PHE A 45 20.522 19.111 26.200 1.00 0.00 H new ATOM 0 HE1 PHE A 45 18.385 23.391 27.410 1.00 0.00 H new ATOM 0 HE2 PHE A 45 18.237 19.123 27.119 1.00 0.00 H new ATOM 0 HZ PHE A 45 17.138 21.255 27.787 1.00 0.00 H new ATOM 738 N ALA A 46 22.150 21.722 29.101 1.00 0.00 N ATOM 739 CA ALA A 46 21.627 21.654 30.451 1.00 0.00 C ATOM 740 C ALA A 46 22.473 20.734 31.346 1.00 0.00 C ATOM 741 O ALA A 46 23.082 21.139 32.333 1.00 0.00 O ATOM 742 CB ALA A 46 20.158 21.240 30.461 1.00 0.00 C ATOM 0 H ALA A 46 21.383 22.045 28.511 1.00 0.00 H new ATOM 0 HA ALA A 46 21.690 22.659 30.869 1.00 0.00 H new ATOM 0 HB1 ALA A 46 19.798 21.199 31.489 1.00 0.00 H new ATOM 0 HB2 ALA A 46 19.571 21.967 29.900 1.00 0.00 H new ATOM 0 HB3 ALA A 46 20.054 20.257 30.001 1.00 0.00 H new ATOM 748 N GLY A 47 22.625 19.481 30.943 1.00 0.00 N ATOM 749 CA GLY A 47 23.494 18.501 31.552 1.00 0.00 C ATOM 750 C GLY A 47 24.145 17.524 30.573 1.00 0.00 C ATOM 751 O GLY A 47 24.699 16.533 31.048 1.00 0.00 O ATOM 0 H GLY A 47 22.117 19.108 30.141 1.00 0.00 H new ATOM 0 HA2 GLY A 47 24.279 19.023 32.099 1.00 0.00 H new ATOM 0 HA3 GLY A 47 22.920 17.932 32.283 1.00 0.00 H new ATOM 755 N LYS A 48 24.023 17.774 29.272 1.00 0.00 N ATOM 756 CA LYS A 48 24.320 16.773 28.258 1.00 0.00 C ATOM 757 C LYS A 48 24.999 17.492 27.089 1.00 0.00 C ATOM 758 O LYS A 48 24.501 18.504 26.599 1.00 0.00 O ATOM 759 CB LYS A 48 23.078 16.009 27.817 1.00 0.00 C ATOM 760 CG LYS A 48 23.222 14.862 26.811 1.00 0.00 C ATOM 761 CD LYS A 48 22.078 14.771 25.805 1.00 0.00 C ATOM 762 CE LYS A 48 22.191 13.697 24.721 1.00 0.00 C ATOM 763 NZ LYS A 48 21.960 12.331 25.215 1.00 0.00 N ATOM 0 H LYS A 48 23.717 18.671 28.895 1.00 0.00 H new ATOM 0 HA LYS A 48 24.986 16.015 28.670 1.00 0.00 H new ATOM 0 HB2 LYS A 48 22.608 15.602 28.713 1.00 0.00 H new ATOM 0 HB3 LYS A 48 22.382 16.732 27.392 1.00 0.00 H new ATOM 0 HG2 LYS A 48 24.160 14.983 26.269 1.00 0.00 H new ATOM 0 HG3 LYS A 48 23.288 13.920 27.356 1.00 0.00 H new ATOM 0 HD2 LYS A 48 21.154 14.599 26.357 1.00 0.00 H new ATOM 0 HD3 LYS A 48 21.981 15.739 25.314 1.00 0.00 H new ATOM 0 HE2 LYS A 48 21.473 13.914 23.931 1.00 0.00 H new ATOM 0 HE3 LYS A 48 23.183 13.749 24.273 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 22.052 11.657 24.428 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 22.661 12.104 25.949 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 21.003 12.265 25.617 1.00 0.00 H new ATOM 777 N GLN A 49 26.130 16.908 26.705 1.00 0.00 N ATOM 778 CA GLN A 49 27.009 17.332 25.634 1.00 0.00 C ATOM 779 C GLN A 49 26.374 16.966 24.293 1.00 0.00 C ATOM 780 O GLN A 49 25.746 15.910 24.223 1.00 0.00 O ATOM 781 CB GLN A 49 28.383 16.667 25.752 1.00 0.00 C ATOM 782 CG GLN A 49 29.387 17.132 24.701 1.00 0.00 C ATOM 783 CD GLN A 49 30.652 16.302 24.887 1.00 0.00 C ATOM 784 OE1 GLN A 49 31.079 16.303 26.034 1.00 0.00 O ATOM 785 NE2 GLN A 49 31.340 15.706 23.916 1.00 0.00 N ATOM 0 H GLN A 49 26.475 16.068 27.170 1.00 0.00 H new ATOM 0 HA GLN A 49 27.148 18.411 25.702 1.00 0.00 H new ATOM 0 HB2 GLN A 49 28.790 16.869 26.743 1.00 0.00 H new ATOM 0 HB3 GLN A 49 28.261 15.587 25.671 1.00 0.00 H new ATOM 0 HG2 GLN A 49 28.983 16.998 23.697 1.00 0.00 H new ATOM 0 HG3 GLN A 49 29.603 18.194 24.819 1.00 0.00 H new ATOM 0 HE21 GLN A 49 30.981 15.707 22.961 1.00 0.00 H new ATOM 0 HE22 GLN A 49 32.227 15.248 24.126 1.00 0.00 H new ATOM 794 N LEU A 50 26.433 17.788 23.261 1.00 0.00 N ATOM 795 CA LEU A 50 25.851 17.438 21.979 1.00 0.00 C ATOM 796 C LEU A 50 26.918 16.887 21.034 1.00 0.00 C ATOM 797 O LEU A 50 28.110 17.130 21.196 1.00 0.00 O ATOM 798 CB LEU A 50 25.306 18.701 21.295 1.00 0.00 C ATOM 799 CG LEU A 50 24.460 19.678 22.110 1.00 0.00 C ATOM 800 CD1 LEU A 50 24.002 20.886 21.278 1.00 0.00 C ATOM 801 CD2 LEU A 50 23.209 18.955 22.593 1.00 0.00 C ATOM 0 H LEU A 50 26.879 18.705 23.286 1.00 0.00 H new ATOM 0 HA LEU A 50 25.070 16.701 22.168 1.00 0.00 H new ATOM 0 HB2 LEU A 50 26.158 19.254 20.899 1.00 0.00 H new ATOM 0 HB3 LEU A 50 24.709 18.381 20.441 1.00 0.00 H new ATOM 0 HG LEU A 50 25.076 20.035 22.935 1.00 0.00 H new ATOM 0 HD11 LEU A 50 23.404 21.551 21.901 1.00 0.00 H new ATOM 0 HD12 LEU A 50 24.874 21.424 20.906 1.00 0.00 H new ATOM 0 HD13 LEU A 50 23.402 20.541 20.436 1.00 0.00 H new ATOM 0 HD21 LEU A 50 22.595 19.641 23.177 1.00 0.00 H new ATOM 0 HD22 LEU A 50 22.640 18.600 21.734 1.00 0.00 H new ATOM 0 HD23 LEU A 50 23.496 18.107 23.214 1.00 0.00 H new ATOM 813 N GLU A 51 26.453 16.129 20.045 1.00 0.00 N ATOM 814 CA GLU A 51 27.286 15.443 19.074 1.00 0.00 C ATOM 815 C GLU A 51 26.530 15.363 17.755 1.00 0.00 C ATOM 816 O GLU A 51 25.327 15.150 17.688 1.00 0.00 O ATOM 817 CB GLU A 51 27.557 13.983 19.435 1.00 0.00 C ATOM 818 CG GLU A 51 28.468 13.146 18.553 1.00 0.00 C ATOM 819 CD GLU A 51 29.897 13.661 18.569 1.00 0.00 C ATOM 820 OE1 GLU A 51 30.620 13.454 19.578 1.00 0.00 O ATOM 821 OE2 GLU A 51 30.235 14.436 17.650 1.00 0.00 O ATOM 0 H GLU A 51 25.456 15.973 19.897 1.00 0.00 H new ATOM 0 HA GLU A 51 28.220 16.003 19.033 1.00 0.00 H new ATOM 0 HB2 GLU A 51 27.975 13.969 20.441 1.00 0.00 H new ATOM 0 HB3 GLU A 51 26.594 13.475 19.483 1.00 0.00 H new ATOM 0 HG2 GLU A 51 28.451 12.110 18.892 1.00 0.00 H new ATOM 0 HG3 GLU A 51 28.091 13.153 17.530 1.00 0.00 H new ATOM 828 N ASP A 52 27.270 15.590 16.664 1.00 0.00 N ATOM 829 CA ASP A 52 26.836 15.909 15.315 1.00 0.00 C ATOM 830 C ASP A 52 25.942 14.831 14.706 1.00 0.00 C ATOM 831 O ASP A 52 26.098 13.646 14.999 1.00 0.00 O ATOM 832 CB ASP A 52 28.001 16.096 14.344 1.00 0.00 C ATOM 833 CG ASP A 52 28.658 17.473 14.365 1.00 0.00 C ATOM 834 OD1 ASP A 52 27.885 18.463 14.344 1.00 0.00 O ATOM 835 OD2 ASP A 52 29.903 17.580 14.392 1.00 0.00 O ATOM 0 H ASP A 52 28.288 15.549 16.718 1.00 0.00 H new ATOM 0 HA ASP A 52 26.284 16.841 15.437 1.00 0.00 H new ATOM 0 HB2 ASP A 52 28.761 15.347 14.566 1.00 0.00 H new ATOM 0 HB3 ASP A 52 27.644 15.898 13.333 1.00 0.00 H new ATOM 840 N GLY A 53 24.990 15.330 13.931 1.00 0.00 N ATOM 841 CA GLY A 53 24.140 14.585 13.029 1.00 0.00 C ATOM 842 C GLY A 53 22.644 14.547 13.355 1.00 0.00 C ATOM 843 O GLY A 53 21.850 13.893 12.681 1.00 0.00 O ATOM 0 H GLY A 53 24.782 16.328 13.919 1.00 0.00 H new ATOM 0 HA2 GLY A 53 24.258 15.003 12.029 1.00 0.00 H new ATOM 0 HA3 GLY A 53 24.504 13.558 12.990 1.00 0.00 H new ATOM 847 N ARG A 54 22.258 15.406 14.292 1.00 0.00 N ATOM 848 CA ARG A 54 20.930 15.631 14.821 1.00 0.00 C ATOM 849 C ARG A 54 20.689 17.141 14.945 1.00 0.00 C ATOM 850 O ARG A 54 21.604 17.966 15.032 1.00 0.00 O ATOM 851 CB ARG A 54 20.764 14.868 16.134 1.00 0.00 C ATOM 852 CG ARG A 54 20.604 13.378 15.869 1.00 0.00 C ATOM 853 CD ARG A 54 20.728 12.518 17.131 1.00 0.00 C ATOM 854 NE ARG A 54 20.529 11.133 16.692 1.00 0.00 N ATOM 855 CZ ARG A 54 20.501 10.038 17.459 1.00 0.00 C ATOM 856 NH1 ARG A 54 20.937 10.078 18.722 1.00 0.00 N ATOM 857 NH2 ARG A 54 19.960 8.894 17.018 1.00 0.00 N ATOM 0 H ARG A 54 22.939 16.019 14.740 1.00 0.00 H new ATOM 0 HA ARG A 54 20.165 15.245 14.147 1.00 0.00 H new ATOM 0 HB2 ARG A 54 21.631 15.039 16.772 1.00 0.00 H new ATOM 0 HB3 ARG A 54 19.893 15.243 16.672 1.00 0.00 H new ATOM 0 HG2 ARG A 54 19.631 13.200 15.412 1.00 0.00 H new ATOM 0 HG3 ARG A 54 21.358 13.062 15.148 1.00 0.00 H new ATOM 0 HD2 ARG A 54 21.706 12.644 17.596 1.00 0.00 H new ATOM 0 HD3 ARG A 54 19.983 12.804 17.874 1.00 0.00 H new ATOM 0 HE ARG A 54 20.397 10.989 15.691 1.00 0.00 H new ATOM 0 HH11 ARG A 54 21.296 10.950 19.110 1.00 0.00 H new ATOM 0 HH12 ARG A 54 20.911 9.236 19.298 1.00 0.00 H new ATOM 0 HH21 ARG A 54 19.559 8.847 16.081 1.00 0.00 H new ATOM 0 HH22 ARG A 54 19.949 8.070 17.619 1.00 0.00 H new ATOM 871 N THR A 55 19.395 17.443 14.993 1.00 0.00 N ATOM 872 CA THR A 55 18.888 18.782 15.171 1.00 0.00 C ATOM 873 C THR A 55 18.802 19.134 16.654 1.00 0.00 C ATOM 874 O THR A 55 18.996 18.346 17.574 1.00 0.00 O ATOM 875 CB THR A 55 17.540 18.824 14.465 1.00 0.00 C ATOM 876 OG1 THR A 55 16.512 18.123 15.134 1.00 0.00 O ATOM 877 CG2 THR A 55 17.585 18.227 13.055 1.00 0.00 C ATOM 0 H THR A 55 18.660 16.741 14.906 1.00 0.00 H new ATOM 0 HA THR A 55 19.550 19.533 14.740 1.00 0.00 H new ATOM 0 HB THR A 55 17.321 19.892 14.445 1.00 0.00 H new ATOM 0 HG1 THR A 55 16.658 17.159 15.039 1.00 0.00 H new ATOM 0 HG21 THR A 55 16.595 18.286 12.603 1.00 0.00 H new ATOM 0 HG22 THR A 55 18.295 18.786 12.446 1.00 0.00 H new ATOM 0 HG23 THR A 55 17.897 17.184 13.111 1.00 0.00 H new ATOM 885 N LEU A 56 18.408 20.382 16.933 1.00 0.00 N ATOM 886 CA LEU A 56 18.053 20.893 18.239 1.00 0.00 C ATOM 887 C LEU A 56 16.827 20.141 18.761 1.00 0.00 C ATOM 888 O LEU A 56 16.763 19.805 19.936 1.00 0.00 O ATOM 889 CB LEU A 56 17.669 22.357 18.028 1.00 0.00 C ATOM 890 CG LEU A 56 18.817 23.340 17.788 1.00 0.00 C ATOM 891 CD1 LEU A 56 18.298 24.641 17.174 1.00 0.00 C ATOM 892 CD2 LEU A 56 19.586 23.666 19.071 1.00 0.00 C ATOM 0 H LEU A 56 18.328 21.092 16.205 1.00 0.00 H new ATOM 0 HA LEU A 56 18.872 20.778 18.949 1.00 0.00 H new ATOM 0 HB2 LEU A 56 16.990 22.412 17.177 1.00 0.00 H new ATOM 0 HB3 LEU A 56 17.111 22.692 18.902 1.00 0.00 H new ATOM 0 HG LEU A 56 19.501 22.849 17.096 1.00 0.00 H new ATOM 0 HD11 LEU A 56 19.131 25.325 17.012 1.00 0.00 H new ATOM 0 HD12 LEU A 56 17.815 24.426 16.221 1.00 0.00 H new ATOM 0 HD13 LEU A 56 17.578 25.101 17.851 1.00 0.00 H new ATOM 0 HD21 LEU A 56 20.389 24.367 18.845 1.00 0.00 H new ATOM 0 HD22 LEU A 56 18.908 24.113 19.798 1.00 0.00 H new ATOM 0 HD23 LEU A 56 20.009 22.750 19.484 1.00 0.00 H new ATOM 904 N SER A 57 15.775 19.986 17.953 1.00 0.00 N ATOM 905 CA SER A 57 14.567 19.213 18.169 1.00 0.00 C ATOM 906 C SER A 57 14.807 17.806 18.700 1.00 0.00 C ATOM 907 O SER A 57 14.087 17.396 19.606 1.00 0.00 O ATOM 908 CB SER A 57 13.699 19.204 16.902 1.00 0.00 C ATOM 909 OG SER A 57 12.376 18.782 17.084 1.00 0.00 O ATOM 0 H SER A 57 15.754 20.448 17.044 1.00 0.00 H new ATOM 0 HA SER A 57 14.024 19.719 18.967 1.00 0.00 H new ATOM 0 HB2 SER A 57 13.687 20.210 16.483 1.00 0.00 H new ATOM 0 HB3 SER A 57 14.171 18.556 16.163 1.00 0.00 H new ATOM 0 HG SER A 57 11.903 18.811 16.226 1.00 0.00 H new ATOM 915 N ASP A 58 15.859 17.144 18.223 1.00 0.00 N ATOM 916 CA ASP A 58 16.183 15.763 18.523 1.00 0.00 C ATOM 917 C ASP A 58 16.812 15.803 19.918 1.00 0.00 C ATOM 918 O ASP A 58 16.781 14.737 20.535 1.00 0.00 O ATOM 919 CB ASP A 58 17.249 15.185 17.592 1.00 0.00 C ATOM 920 CG ASP A 58 16.612 14.827 16.254 1.00 0.00 C ATOM 921 OD1 ASP A 58 15.801 13.876 16.269 1.00 0.00 O ATOM 922 OD2 ASP A 58 17.042 15.457 15.265 1.00 0.00 O ATOM 0 H ASP A 58 16.532 17.578 17.592 1.00 0.00 H new ATOM 0 HA ASP A 58 15.285 15.153 18.426 1.00 0.00 H new ATOM 0 HB2 ASP A 58 18.050 15.909 17.444 1.00 0.00 H new ATOM 0 HB3 ASP A 58 17.699 14.300 18.042 1.00 0.00 H new ATOM 927 N TYR A 59 17.506 16.872 20.287 1.00 0.00 N ATOM 928 CA TYR A 59 18.265 16.983 21.520 1.00 0.00 C ATOM 929 C TYR A 59 17.376 17.665 22.553 1.00 0.00 C ATOM 930 O TYR A 59 17.679 17.703 23.745 1.00 0.00 O ATOM 931 CB TYR A 59 19.560 17.691 21.119 1.00 0.00 C ATOM 932 CG TYR A 59 20.681 16.725 20.785 1.00 0.00 C ATOM 933 CD1 TYR A 59 21.153 15.844 21.763 1.00 0.00 C ATOM 934 CD2 TYR A 59 21.425 16.947 19.618 1.00 0.00 C ATOM 935 CE1 TYR A 59 22.316 15.125 21.481 1.00 0.00 C ATOM 936 CE2 TYR A 59 22.535 16.138 19.363 1.00 0.00 C ATOM 937 CZ TYR A 59 22.988 15.160 20.253 1.00 0.00 C ATOM 938 OH TYR A 59 24.129 14.414 20.094 1.00 0.00 O ATOM 0 H TYR A 59 17.556 17.714 19.713 1.00 0.00 H new ATOM 0 HA TYR A 59 18.555 16.051 22.005 1.00 0.00 H new ATOM 0 HB2 TYR A 59 19.367 18.329 20.256 1.00 0.00 H new ATOM 0 HB3 TYR A 59 19.879 18.343 21.932 1.00 0.00 H new ATOM 0 HD1 TYR A 59 20.636 15.724 22.704 1.00 0.00 H new ATOM 0 HD2 TYR A 59 21.145 17.730 18.928 1.00 0.00 H new ATOM 0 HE1 TYR A 59 22.724 14.500 22.262 1.00 0.00 H new ATOM 0 HE2 TYR A 59 23.069 16.275 18.434 1.00 0.00 H new ATOM 0 HH TYR A 59 24.471 14.529 19.183 1.00 0.00 H new ATOM 948 N ASN A 60 16.139 18.078 22.262 1.00 0.00 N ATOM 949 CA ASN A 60 15.152 18.579 23.198 1.00 0.00 C ATOM 950 C ASN A 60 15.300 20.008 23.691 1.00 0.00 C ATOM 951 O ASN A 60 15.025 20.262 24.854 1.00 0.00 O ATOM 952 CB ASN A 60 14.723 17.664 24.348 1.00 0.00 C ATOM 953 CG ASN A 60 14.260 16.297 23.859 1.00 0.00 C ATOM 954 OD1 ASN A 60 13.285 16.253 23.110 1.00 0.00 O ATOM 955 ND2 ASN A 60 14.902 15.221 24.303 1.00 0.00 N ATOM 0 H ASN A 60 15.787 18.067 21.305 1.00 0.00 H new ATOM 0 HA ASN A 60 14.327 18.583 22.486 1.00 0.00 H new ATOM 0 HB2 ASN A 60 15.557 17.537 25.038 1.00 0.00 H new ATOM 0 HB3 ASN A 60 13.917 18.140 24.906 1.00 0.00 H new ATOM 0 HD21 ASN A 60 14.592 14.290 24.024 1.00 0.00 H new ATOM 0 HD22 ASN A 60 15.705 15.326 24.923 1.00 0.00 H new ATOM 962 N ILE A 61 15.917 20.863 22.869 1.00 0.00 N ATOM 963 CA ILE A 61 16.373 22.212 23.121 1.00 0.00 C ATOM 964 C ILE A 61 15.298 23.052 22.426 1.00 0.00 C ATOM 965 O ILE A 61 15.128 23.084 21.208 1.00 0.00 O ATOM 966 CB ILE A 61 17.716 22.344 22.397 1.00 0.00 C ATOM 967 CG1 ILE A 61 18.767 21.339 22.848 1.00 0.00 C ATOM 968 CG2 ILE A 61 18.279 23.733 22.683 1.00 0.00 C ATOM 969 CD1 ILE A 61 20.050 21.362 22.007 1.00 0.00 C ATOM 0 H ILE A 61 16.126 20.585 21.910 1.00 0.00 H new ATOM 0 HA ILE A 61 16.506 22.495 24.165 1.00 0.00 H new ATOM 0 HB ILE A 61 17.515 22.163 21.341 1.00 0.00 H new ATOM 0 HG12 ILE A 61 19.023 21.538 23.889 1.00 0.00 H new ATOM 0 HG13 ILE A 61 18.338 20.338 22.811 1.00 0.00 H new ATOM 0 HG21 ILE A 61 19.237 23.849 22.176 1.00 0.00 H new ATOM 0 HG22 ILE A 61 17.583 24.489 22.321 1.00 0.00 H new ATOM 0 HG23 ILE A 61 18.420 23.854 23.757 1.00 0.00 H new ATOM 0 HD11 ILE A 61 20.749 20.619 22.390 1.00 0.00 H new ATOM 0 HD12 ILE A 61 19.809 21.132 20.969 1.00 0.00 H new ATOM 0 HD13 ILE A 61 20.505 22.351 22.064 1.00 0.00 H new ATOM 981 N GLN A 62 14.710 23.917 23.244 1.00 0.00 N ATOM 982 CA GLN A 62 13.715 24.939 23.010 1.00 0.00 C ATOM 983 C GLN A 62 14.165 26.332 23.446 1.00 0.00 C ATOM 984 O GLN A 62 15.198 26.468 24.104 1.00 0.00 O ATOM 985 CB GLN A 62 12.419 24.603 23.762 1.00 0.00 C ATOM 986 CG GLN A 62 11.797 23.225 23.554 1.00 0.00 C ATOM 987 CD GLN A 62 11.497 22.809 22.125 1.00 0.00 C ATOM 988 OE1 GLN A 62 11.321 23.609 21.216 1.00 0.00 O ATOM 989 NE2 GLN A 62 11.440 21.486 21.942 1.00 0.00 N ATOM 0 H GLN A 62 14.965 23.908 24.232 1.00 0.00 H new ATOM 0 HA GLN A 62 13.555 24.955 21.932 1.00 0.00 H new ATOM 0 HB2 GLN A 62 12.613 24.723 24.828 1.00 0.00 H new ATOM 0 HB3 GLN A 62 11.673 25.349 23.488 1.00 0.00 H new ATOM 0 HG2 GLN A 62 12.467 22.483 23.989 1.00 0.00 H new ATOM 0 HG3 GLN A 62 10.866 23.185 24.120 1.00 0.00 H new ATOM 0 HE21 GLN A 62 11.593 20.855 22.729 1.00 0.00 H new ATOM 0 HE22 GLN A 62 11.243 21.107 21.016 1.00 0.00 H new ATOM 998 N LYS A 63 13.366 27.334 23.084 1.00 0.00 N ATOM 999 CA LYS A 63 13.633 28.752 23.138 1.00 0.00 C ATOM 1000 C LYS A 63 13.974 29.204 24.559 1.00 0.00 C ATOM 1001 O LYS A 63 13.303 28.823 25.518 1.00 0.00 O ATOM 1002 CB LYS A 63 12.347 29.442 22.704 1.00 0.00 C ATOM 1003 CG LYS A 63 12.272 30.972 22.749 1.00 0.00 C ATOM 1004 CD LYS A 63 10.925 31.496 22.236 1.00 0.00 C ATOM 1005 CE LYS A 63 10.474 32.760 22.964 1.00 0.00 C ATOM 1006 NZ LYS A 63 9.104 33.247 22.730 1.00 0.00 N ATOM 0 H LYS A 63 12.434 27.147 22.714 1.00 0.00 H new ATOM 0 HA LYS A 63 14.482 28.998 22.500 1.00 0.00 H new ATOM 0 HB2 LYS A 63 12.137 29.132 21.680 1.00 0.00 H new ATOM 0 HB3 LYS A 63 11.540 29.055 23.326 1.00 0.00 H new ATOM 0 HG2 LYS A 63 12.428 31.313 23.773 1.00 0.00 H new ATOM 0 HG3 LYS A 63 13.078 31.392 22.147 1.00 0.00 H new ATOM 0 HD2 LYS A 63 11.002 31.703 21.169 1.00 0.00 H new ATOM 0 HD3 LYS A 63 10.168 30.721 22.356 1.00 0.00 H new ATOM 0 HE2 LYS A 63 10.587 32.586 24.034 1.00 0.00 H new ATOM 0 HE3 LYS A 63 11.162 33.562 22.697 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 8.942 34.109 23.289 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 8.979 33.461 21.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 8.422 32.516 23.016 1.00 0.00 H new ATOM 1020 N GLU A 64 15.013 30.032 24.644 1.00 0.00 N ATOM 1021 CA GLU A 64 15.618 30.608 25.830 1.00 0.00 C ATOM 1022 C GLU A 64 16.612 29.755 26.621 1.00 0.00 C ATOM 1023 O GLU A 64 16.934 30.052 27.778 1.00 0.00 O ATOM 1024 CB GLU A 64 14.647 31.350 26.748 1.00 0.00 C ATOM 1025 CG GLU A 64 14.890 32.856 26.843 1.00 0.00 C ATOM 1026 CD GLU A 64 14.626 33.618 25.558 1.00 0.00 C ATOM 1027 OE1 GLU A 64 13.614 33.349 24.889 1.00 0.00 O ATOM 1028 OE2 GLU A 64 15.542 34.406 25.211 1.00 0.00 O ATOM 0 H GLU A 64 15.494 30.342 23.800 1.00 0.00 H new ATOM 0 HA GLU A 64 16.257 31.352 25.354 1.00 0.00 H new ATOM 0 HB2 GLU A 64 13.630 31.180 26.394 1.00 0.00 H new ATOM 0 HB3 GLU A 64 14.712 30.921 27.748 1.00 0.00 H new ATOM 0 HG2 GLU A 64 14.256 33.265 27.630 1.00 0.00 H new ATOM 0 HG3 GLU A 64 15.923 33.026 27.146 1.00 0.00 H new ATOM 1035 N SER A 65 16.976 28.593 26.098 1.00 0.00 N ATOM 1036 CA SER A 65 18.049 27.765 26.596 1.00 0.00 C ATOM 1037 C SER A 65 19.403 28.436 26.354 1.00 0.00 C ATOM 1038 O SER A 65 19.668 29.161 25.392 1.00 0.00 O ATOM 1039 CB SER A 65 17.971 26.412 25.879 1.00 0.00 C ATOM 1040 OG SER A 65 16.808 25.710 26.245 1.00 0.00 O ATOM 0 H SER A 65 16.510 28.192 25.284 1.00 0.00 H new ATOM 0 HA SER A 65 17.948 27.622 27.672 1.00 0.00 H new ATOM 0 HB2 SER A 65 17.981 26.568 24.800 1.00 0.00 H new ATOM 0 HB3 SER A 65 18.851 25.817 26.123 1.00 0.00 H new ATOM 0 HG SER A 65 16.102 25.881 25.587 1.00 0.00 H new ATOM 1046 N THR A 66 20.209 28.276 27.393 1.00 0.00 N ATOM 1047 CA THR A 66 21.618 28.622 27.406 1.00 0.00 C ATOM 1048 C THR A 66 22.394 27.333 27.117 1.00 0.00 C ATOM 1049 O THR A 66 22.167 26.271 27.688 1.00 0.00 O ATOM 1050 CB THR A 66 21.941 29.154 28.801 1.00 0.00 C ATOM 1051 OG1 THR A 66 21.149 30.255 29.175 1.00 0.00 O ATOM 1052 CG2 THR A 66 23.324 29.727 29.086 1.00 0.00 C ATOM 0 H THR A 66 19.887 27.888 28.280 1.00 0.00 H new ATOM 0 HA THR A 66 21.880 29.378 26.666 1.00 0.00 H new ATOM 0 HB THR A 66 21.787 28.216 29.334 1.00 0.00 H new ATOM 0 HG1 THR A 66 21.285 30.448 30.126 1.00 0.00 H new ATOM 0 HG21 THR A 66 23.375 30.056 30.124 1.00 0.00 H new ATOM 0 HG22 THR A 66 24.079 28.960 28.911 1.00 0.00 H new ATOM 0 HG23 THR A 66 23.509 30.575 28.427 1.00 0.00 H new ATOM 1060 N LEU A 67 23.238 27.421 26.104 1.00 0.00 N ATOM 1061 CA LEU A 67 24.295 26.508 25.723 1.00 0.00 C ATOM 1062 C LEU A 67 25.591 27.056 26.324 1.00 0.00 C ATOM 1063 O LEU A 67 25.693 28.255 26.557 1.00 0.00 O ATOM 1064 CB LEU A 67 24.386 26.231 24.217 1.00 0.00 C ATOM 1065 CG LEU A 67 23.248 25.567 23.447 1.00 0.00 C ATOM 1066 CD1 LEU A 67 23.615 25.392 21.971 1.00 0.00 C ATOM 1067 CD2 LEU A 67 22.977 24.205 24.087 1.00 0.00 C ATOM 0 H LEU A 67 23.193 28.215 25.465 1.00 0.00 H new ATOM 0 HA LEU A 67 24.079 25.517 26.122 1.00 0.00 H new ATOM 0 HB2 LEU A 67 24.577 27.188 23.732 1.00 0.00 H new ATOM 0 HB3 LEU A 67 25.271 25.614 24.064 1.00 0.00 H new ATOM 0 HG LEU A 67 22.358 26.195 23.492 1.00 0.00 H new ATOM 0 HD11 LEU A 67 22.788 24.917 21.444 1.00 0.00 H new ATOM 0 HD12 LEU A 67 23.815 26.367 21.528 1.00 0.00 H new ATOM 0 HD13 LEU A 67 24.504 24.767 21.889 1.00 0.00 H new ATOM 0 HD21 LEU A 67 22.166 23.708 23.555 1.00 0.00 H new ATOM 0 HD22 LEU A 67 23.877 23.592 24.032 1.00 0.00 H new ATOM 0 HD23 LEU A 67 22.695 24.343 25.131 1.00 0.00 H new ATOM 1079 N HIS A 68 26.590 26.248 26.672 1.00 0.00 N ATOM 1080 CA HIS A 68 27.936 26.587 27.097 1.00 0.00 C ATOM 1081 C HIS A 68 28.974 25.854 26.243 1.00 0.00 C ATOM 1082 O HIS A 68 28.861 24.655 26.001 1.00 0.00 O ATOM 1083 CB HIS A 68 28.124 26.452 28.599 1.00 0.00 C ATOM 1084 CG HIS A 68 28.240 25.111 29.278 1.00 0.00 C ATOM 1085 ND1 HIS A 68 29.402 24.338 29.341 1.00 0.00 N ATOM 1086 CD2 HIS A 68 27.144 24.427 29.743 1.00 0.00 C ATOM 1087 CE1 HIS A 68 28.992 23.243 29.980 1.00 0.00 C ATOM 1088 NE2 HIS A 68 27.665 23.246 30.233 1.00 0.00 N ATOM 0 H HIS A 68 26.457 25.237 26.660 1.00 0.00 H new ATOM 0 HA HIS A 68 28.102 27.649 26.914 1.00 0.00 H new ATOM 0 HB2 HIS A 68 29.025 27.011 28.853 1.00 0.00 H new ATOM 0 HB3 HIS A 68 27.286 26.968 29.067 1.00 0.00 H new ATOM 0 HD2 HIS A 68 26.111 24.741 29.729 1.00 0.00 H new ATOM 0 HE1 HIS A 68 29.652 22.437 30.266 1.00 0.00 H new ATOM 0 HE2 HIS A 68 27.141 22.507 30.702 1.00 0.00 H new ATOM 1096 N LEU A 69 29.928 26.651 25.774 1.00 0.00 N ATOM 1097 CA LEU A 69 31.033 26.268 24.914 1.00 0.00 C ATOM 1098 C LEU A 69 32.236 25.754 25.722 1.00 0.00 C ATOM 1099 O LEU A 69 32.510 26.274 26.794 1.00 0.00 O ATOM 1100 CB LEU A 69 31.422 27.515 24.133 1.00 0.00 C ATOM 1101 CG LEU A 69 32.183 27.251 22.832 1.00 0.00 C ATOM 1102 CD1 LEU A 69 31.189 26.895 21.732 1.00 0.00 C ATOM 1103 CD2 LEU A 69 33.158 28.387 22.511 1.00 0.00 C ATOM 0 H LEU A 69 29.948 27.645 26.001 1.00 0.00 H new ATOM 0 HA LEU A 69 30.732 25.453 24.256 1.00 0.00 H new ATOM 0 HB2 LEU A 69 30.517 28.076 23.900 1.00 0.00 H new ATOM 0 HB3 LEU A 69 32.035 28.150 24.773 1.00 0.00 H new ATOM 0 HG LEU A 69 32.835 26.384 22.935 1.00 0.00 H new ATOM 0 HD11 LEU A 69 31.727 26.706 20.803 1.00 0.00 H new ATOM 0 HD12 LEU A 69 30.634 26.002 22.018 1.00 0.00 H new ATOM 0 HD13 LEU A 69 30.495 27.723 21.587 1.00 0.00 H new ATOM 0 HD21 LEU A 69 33.681 28.166 21.581 1.00 0.00 H new ATOM 0 HD22 LEU A 69 32.606 29.321 22.404 1.00 0.00 H new ATOM 0 HD23 LEU A 69 33.882 28.484 23.320 1.00 0.00 H new ATOM 1115 N VAL A 70 32.890 24.735 25.185 1.00 0.00 N ATOM 1116 CA VAL A 70 34.091 24.061 25.661 1.00 0.00 C ATOM 1117 C VAL A 70 34.959 24.034 24.398 1.00 0.00 C ATOM 1118 O VAL A 70 34.463 23.678 23.331 1.00 0.00 O ATOM 1119 CB VAL A 70 33.757 22.655 26.153 1.00 0.00 C ATOM 1120 CG1 VAL A 70 35.004 21.884 26.570 1.00 0.00 C ATOM 1121 CG2 VAL A 70 32.840 22.820 27.359 1.00 0.00 C ATOM 0 H VAL A 70 32.559 24.316 24.316 1.00 0.00 H new ATOM 0 HA VAL A 70 34.578 24.547 26.507 1.00 0.00 H new ATOM 0 HB VAL A 70 33.286 22.089 25.349 1.00 0.00 H new ATOM 0 HG11 VAL A 70 34.719 20.889 26.913 1.00 0.00 H new ATOM 0 HG12 VAL A 70 35.678 21.795 25.718 1.00 0.00 H new ATOM 0 HG13 VAL A 70 35.508 22.416 27.377 1.00 0.00 H new ATOM 0 HG21 VAL A 70 32.572 21.838 27.749 1.00 0.00 H new ATOM 0 HG22 VAL A 70 33.355 23.389 28.133 1.00 0.00 H new ATOM 0 HG23 VAL A 70 31.936 23.351 27.059 1.00 0.00 H new ATOM 1131 N LEU A 71 36.239 24.391 24.428 1.00 0.00 N ATOM 1132 CA LEU A 71 37.206 24.339 23.351 1.00 0.00 C ATOM 1133 C LEU A 71 38.240 23.216 23.337 1.00 0.00 C ATOM 1134 O LEU A 71 38.834 22.999 24.399 1.00 0.00 O ATOM 1135 CB LEU A 71 38.010 25.646 23.345 1.00 0.00 C ATOM 1136 CG LEU A 71 37.227 26.950 23.174 1.00 0.00 C ATOM 1137 CD1 LEU A 71 38.165 28.091 23.570 1.00 0.00 C ATOM 1138 CD2 LEU A 71 36.707 27.158 21.756 1.00 0.00 C ATOM 0 H LEU A 71 36.657 24.755 25.284 1.00 0.00 H new ATOM 0 HA LEU A 71 36.572 24.158 22.483 1.00 0.00 H new ATOM 0 HB2 LEU A 71 38.564 25.706 24.282 1.00 0.00 H new ATOM 0 HB3 LEU A 71 38.745 25.586 22.543 1.00 0.00 H new ATOM 0 HG LEU A 71 36.340 26.915 23.807 1.00 0.00 H new ATOM 0 HD11 LEU A 71 37.645 29.043 23.463 1.00 0.00 H new ATOM 0 HD12 LEU A 71 38.477 27.963 24.607 1.00 0.00 H new ATOM 0 HD13 LEU A 71 39.042 28.082 22.923 1.00 0.00 H new ATOM 0 HD21 LEU A 71 36.161 28.100 21.703 1.00 0.00 H new ATOM 0 HD22 LEU A 71 37.546 27.185 21.061 1.00 0.00 H new ATOM 0 HD23 LEU A 71 36.041 26.338 21.489 1.00 0.00 H new