USER MOD reduce.3.24.130724 H: found=0, std=0, add=545, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 544 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 42 THR OG1 : rot -55:sc= 2 USER MOD Set 1.2: A 71 LYS NZ :NH3+ 169:sc= 2.12 (180deg=1.04) USER MOD Set 2.1: A 14 CYS SG : rot -129:sc= 1.47 USER MOD Set 2.2: A 17 CYS SG : rot 96:sc= 0.069! USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 MET CE :methyl -163:sc= -2.74! (180deg=-3.67!) USER MOD Single : A 13 THR OG1 : rot 57:sc= 0.122 USER MOD Single : A 19 ASN : amide:sc= 1.16 K(o=1.2,f=-0.12) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 ASN : amide:sc= 1.11 K(o=1.1,f=-0.0013) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 ASN : amide:sc= 0.811 K(o=0.81,f=-0.58) USER MOD Single : A 37 ASN : amide:sc= -0.726 K(o=-0.73,f=-1.8!) USER MOD Single : A 44 THR OG1 : rot 51:sc= 0.0919 USER MOD Single : A 47 TYR OH : rot 41:sc= 1.23 USER MOD Single : A 48 ASN : amide:sc= 0 K(o=0,f=-0.89) USER MOD Single : A 50 LYS NZ :NH3+ 143:sc= 0.693 (180deg=-1.91!) USER MOD Single : A 53 SER OG : rot 101:sc= 1.28 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ -177:sc= 1.04 (180deg=1.03) USER MOD Single : A 66 TYR OH : rot 114:sc= -0.947! USER MOD Single : A 67 LYS NZ :NH3+ 167:sc=-0.00261 (180deg=-0.0985) USER MOD Single : A 69 LYS NZ :NH3+ -156:sc= 1.17 (180deg=1.04) USER MOD ----------------------------------------------------------------- ATOM 34 N GLU A 3 2.619 13.153 4.748 1.00 10.00 N ATOM 35 CA GLU A 3 2.848 12.939 3.348 1.00 10.00 C ATOM 36 C GLU A 3 1.761 11.939 2.980 1.00 10.00 C ATOM 37 O GLU A 3 1.564 10.956 3.695 1.00 10.00 O ATOM 38 CB GLU A 3 4.258 12.343 3.197 1.00 10.00 C ATOM 39 CG GLU A 3 4.411 11.425 1.981 1.00 10.00 C ATOM 40 CD GLU A 3 5.786 10.772 1.917 1.00 10.00 C ATOM 41 OE1 GLU A 3 6.458 10.747 2.969 1.00 10.00 O ATOM 42 OE2 GLU A 3 6.125 10.238 0.837 1.00 10.00 O ATOM 0 HA GLU A 3 2.805 13.827 2.717 1.00 10.00 H new ATOM 0 HB2 GLU A 3 4.980 13.156 3.121 1.00 10.00 H new ATOM 0 HB3 GLU A 3 4.504 11.782 4.098 1.00 10.00 H new ATOM 0 HG2 GLU A 3 3.645 10.650 2.015 1.00 10.00 H new ATOM 0 HG3 GLU A 3 4.242 12.001 1.071 1.00 10.00 H new ATOM 49 N LYS A 4 1.060 12.214 1.885 1.00 10.00 N ATOM 50 CA LYS A 4 0.148 11.294 1.229 1.00 10.00 C ATOM 51 C LYS A 4 0.756 10.938 -0.124 1.00 10.00 C ATOM 52 O LYS A 4 0.930 11.819 -0.961 1.00 10.00 O ATOM 53 CB LYS A 4 -1.235 11.917 1.045 1.00 10.00 C ATOM 54 CG LYS A 4 -1.778 12.612 2.303 1.00 10.00 C ATOM 55 CD LYS A 4 -1.737 14.129 2.115 1.00 10.00 C ATOM 56 CE LYS A 4 -2.372 14.863 3.304 1.00 10.00 C ATOM 57 NZ LYS A 4 -3.527 15.680 2.876 1.00 10.00 N ATOM 0 H LYS A 4 1.116 13.118 1.416 1.00 10.00 H new ATOM 0 HA LYS A 4 0.014 10.403 1.842 1.00 10.00 H new ATOM 0 HB2 LYS A 4 -1.191 12.642 0.232 1.00 10.00 H new ATOM 0 HB3 LYS A 4 -1.935 11.139 0.741 1.00 10.00 H new ATOM 0 HG2 LYS A 4 -2.801 12.288 2.496 1.00 10.00 H new ATOM 0 HG3 LYS A 4 -1.184 12.328 3.172 1.00 10.00 H new ATOM 0 HD2 LYS A 4 -0.703 14.454 1.996 1.00 10.00 H new ATOM 0 HD3 LYS A 4 -2.263 14.397 1.198 1.00 10.00 H new ATOM 0 HE2 LYS A 4 -2.694 14.138 4.052 1.00 10.00 H new ATOM 0 HE3 LYS A 4 -1.628 15.502 3.779 1.00 10.00 H new ATOM 0 HZ1 LYS A 4 -3.935 16.164 3.701 1.00 10.00 H new ATOM 0 HZ2 LYS A 4 -3.214 16.387 2.180 1.00 10.00 H new ATOM 0 HZ3 LYS A 4 -4.246 15.065 2.445 1.00 10.00 H new ATOM 71 N ALA A 5 1.078 9.665 -0.320 1.00 10.00 N ATOM 72 CA ALA A 5 1.740 9.097 -1.481 1.00 10.00 C ATOM 73 C ALA A 5 0.748 8.164 -2.169 1.00 10.00 C ATOM 74 O ALA A 5 -0.082 7.576 -1.474 1.00 10.00 O ATOM 75 CB ALA A 5 2.941 8.316 -0.962 1.00 10.00 C ATOM 0 H ALA A 5 0.867 8.954 0.380 1.00 10.00 H new ATOM 0 HA ALA A 5 2.068 9.854 -2.193 1.00 10.00 H new ATOM 0 HB1 ALA A 5 3.474 7.868 -1.801 1.00 10.00 H new ATOM 0 HB2 ALA A 5 3.609 8.990 -0.426 1.00 10.00 H new ATOM 0 HB3 ALA A 5 2.600 7.531 -0.287 1.00 10.00 H new ATOM 81 N GLU A 6 0.791 8.022 -3.500 1.00 10.00 N ATOM 82 CA GLU A 6 -0.226 7.301 -4.227 1.00 10.00 C ATOM 83 C GLU A 6 0.510 6.296 -5.080 1.00 10.00 C ATOM 84 O GLU A 6 1.502 6.657 -5.719 1.00 10.00 O ATOM 85 CB GLU A 6 -1.047 8.257 -5.093 1.00 10.00 C ATOM 86 CG GLU A 6 -2.323 7.564 -5.566 1.00 10.00 C ATOM 87 CD GLU A 6 -3.118 8.424 -6.534 1.00 10.00 C ATOM 88 OE1 GLU A 6 -2.573 8.678 -7.628 1.00 10.00 O ATOM 89 OE2 GLU A 6 -4.267 8.758 -6.183 1.00 10.00 O ATOM 0 H GLU A 6 1.532 8.406 -4.087 1.00 10.00 H new ATOM 0 HA GLU A 6 -0.928 6.809 -3.554 1.00 10.00 H new ATOM 0 HB2 GLU A 6 -1.298 9.152 -4.524 1.00 10.00 H new ATOM 0 HB3 GLU A 6 -0.458 8.580 -5.952 1.00 10.00 H new ATOM 0 HG2 GLU A 6 -2.065 6.621 -6.048 1.00 10.00 H new ATOM 0 HG3 GLU A 6 -2.944 7.322 -4.704 1.00 10.00 H new ATOM 96 N PHE A 7 0.030 5.057 -5.068 1.00 10.00 N ATOM 97 CA PHE A 7 0.638 3.924 -5.728 1.00 10.00 C ATOM 98 C PHE A 7 -0.408 3.204 -6.568 1.00 10.00 C ATOM 99 O PHE A 7 -1.601 3.311 -6.286 1.00 10.00 O ATOM 100 CB PHE A 7 1.226 2.997 -4.664 1.00 10.00 C ATOM 101 CG PHE A 7 2.091 3.672 -3.611 1.00 10.00 C ATOM 102 CD1 PHE A 7 3.000 4.672 -3.990 1.00 10.00 C ATOM 103 CD2 PHE A 7 2.002 3.310 -2.256 1.00 10.00 C ATOM 104 CE1 PHE A 7 3.711 5.402 -3.031 1.00 10.00 C ATOM 105 CE2 PHE A 7 2.776 3.992 -1.299 1.00 10.00 C ATOM 106 CZ PHE A 7 3.594 5.065 -1.676 1.00 10.00 C ATOM 0 H PHE A 7 -0.829 4.812 -4.576 1.00 10.00 H new ATOM 0 HA PHE A 7 1.438 4.251 -6.393 1.00 10.00 H new ATOM 0 HB2 PHE A 7 0.406 2.484 -4.161 1.00 10.00 H new ATOM 0 HB3 PHE A 7 1.822 2.233 -5.163 1.00 10.00 H new ATOM 0 HD1 PHE A 7 3.153 4.881 -5.038 1.00 10.00 H new ATOM 0 HD2 PHE A 7 1.342 2.512 -1.950 1.00 10.00 H new ATOM 0 HE1 PHE A 7 4.347 6.221 -3.334 1.00 10.00 H new ATOM 0 HE2 PHE A 7 2.739 3.685 -0.264 1.00 10.00 H new ATOM 0 HZ PHE A 7 4.131 5.629 -0.927 1.00 10.00 H new ATOM 116 N ASP A 8 0.042 2.473 -7.586 1.00 10.00 N ATOM 117 CA ASP A 8 -0.773 1.649 -8.471 1.00 10.00 C ATOM 118 C ASP A 8 -0.590 0.244 -7.932 1.00 10.00 C ATOM 119 O ASP A 8 0.552 -0.081 -7.595 1.00 10.00 O ATOM 120 CB ASP A 8 -0.178 1.702 -9.893 1.00 10.00 C ATOM 121 CG ASP A 8 -1.160 1.656 -11.049 1.00 10.00 C ATOM 122 OD1 ASP A 8 -2.354 1.952 -10.836 1.00 10.00 O ATOM 123 OD2 ASP A 8 -0.646 1.466 -12.174 1.00 10.00 O ATOM 0 H ASP A 8 1.033 2.439 -7.826 1.00 10.00 H new ATOM 0 HA ASP A 8 -1.814 1.969 -8.511 1.00 10.00 H new ATOM 0 HB2 ASP A 8 0.408 2.617 -9.982 1.00 10.00 H new ATOM 0 HB3 ASP A 8 0.515 0.868 -10.003 1.00 10.00 H new ATOM 128 N ILE A 9 -1.641 -0.570 -7.857 1.00 10.00 N ATOM 129 CA ILE A 9 -1.489 -1.993 -7.587 1.00 10.00 C ATOM 130 C ILE A 9 -1.888 -2.758 -8.847 1.00 10.00 C ATOM 131 O ILE A 9 -2.759 -2.300 -9.581 1.00 10.00 O ATOM 132 CB ILE A 9 -2.303 -2.447 -6.360 1.00 10.00 C ATOM 133 CG1 ILE A 9 -2.201 -1.502 -5.154 1.00 10.00 C ATOM 134 CG2 ILE A 9 -1.761 -3.779 -5.849 1.00 10.00 C ATOM 135 CD1 ILE A 9 -3.330 -0.489 -5.168 1.00 10.00 C ATOM 0 H ILE A 9 -2.607 -0.266 -7.980 1.00 10.00 H new ATOM 0 HA ILE A 9 -0.449 -2.204 -7.338 1.00 10.00 H new ATOM 0 HB ILE A 9 -3.334 -2.487 -6.712 1.00 10.00 H new ATOM 0 HG12 ILE A 9 -2.235 -2.079 -4.230 1.00 10.00 H new ATOM 0 HG13 ILE A 9 -1.242 -0.985 -5.171 1.00 10.00 H new ATOM 0 HG21 ILE A 9 -2.338 -4.098 -4.981 1.00 10.00 H new ATOM 0 HG22 ILE A 9 -1.842 -4.530 -6.635 1.00 10.00 H new ATOM 0 HG23 ILE A 9 -0.715 -3.662 -5.566 1.00 10.00 H new ATOM 0 HD11 ILE A 9 -3.238 0.170 -4.305 1.00 10.00 H new ATOM 0 HD12 ILE A 9 -3.278 0.101 -6.083 1.00 10.00 H new ATOM 0 HD13 ILE A 9 -4.287 -1.010 -5.127 1.00 10.00 H new ATOM 147 N GLU A 10 -1.254 -3.908 -9.088 1.00 10.00 N ATOM 148 CA GLU A 10 -1.711 -4.874 -10.073 1.00 10.00 C ATOM 149 C GLU A 10 -1.818 -6.243 -9.413 1.00 10.00 C ATOM 150 O GLU A 10 -0.849 -6.729 -8.822 1.00 10.00 O ATOM 151 CB GLU A 10 -0.749 -4.955 -11.261 1.00 10.00 C ATOM 152 CG GLU A 10 -0.789 -3.678 -12.116 1.00 10.00 C ATOM 153 CD GLU A 10 0.020 -3.800 -13.401 1.00 10.00 C ATOM 154 OE1 GLU A 10 -0.232 -4.774 -14.142 1.00 10.00 O ATOM 155 OE2 GLU A 10 0.877 -2.910 -13.622 1.00 10.00 O ATOM 0 H GLU A 10 -0.405 -4.191 -8.599 1.00 10.00 H new ATOM 0 HA GLU A 10 -2.684 -4.554 -10.446 1.00 10.00 H new ATOM 0 HB2 GLU A 10 0.266 -5.117 -10.897 1.00 10.00 H new ATOM 0 HB3 GLU A 10 -1.007 -5.815 -11.879 1.00 10.00 H new ATOM 0 HG2 GLU A 10 -1.824 -3.446 -12.365 1.00 10.00 H new ATOM 0 HG3 GLU A 10 -0.407 -2.842 -11.530 1.00 10.00 H new ATOM 162 N GLY A 11 -2.989 -6.866 -9.564 1.00 10.00 N ATOM 163 CA GLY A 11 -3.222 -8.277 -9.279 1.00 10.00 C ATOM 164 C GLY A 11 -4.367 -8.514 -8.299 1.00 10.00 C ATOM 165 O GLY A 11 -4.772 -9.657 -8.094 1.00 10.00 O ATOM 0 H GLY A 11 -3.824 -6.385 -9.898 1.00 10.00 H new ATOM 0 HA2 GLY A 11 -3.438 -8.798 -10.212 1.00 10.00 H new ATOM 0 HA3 GLY A 11 -2.310 -8.714 -8.873 1.00 10.00 H new ATOM 169 N MET A 12 -4.895 -7.466 -7.666 1.00 10.00 N ATOM 170 CA MET A 12 -5.780 -7.626 -6.521 1.00 10.00 C ATOM 171 C MET A 12 -7.231 -7.909 -6.922 1.00 10.00 C ATOM 172 O MET A 12 -8.166 -7.359 -6.345 1.00 10.00 O ATOM 173 CB MET A 12 -5.676 -6.378 -5.653 1.00 10.00 C ATOM 174 CG MET A 12 -5.984 -5.094 -6.442 1.00 10.00 C ATOM 175 SD MET A 12 -6.809 -3.815 -5.476 1.00 10.00 S ATOM 176 CE MET A 12 -5.637 -3.773 -4.122 1.00 10.00 C ATOM 0 H MET A 12 -4.722 -6.496 -7.931 1.00 10.00 H new ATOM 0 HA MET A 12 -5.461 -8.503 -5.957 1.00 10.00 H new ATOM 0 HB2 MET A 12 -6.368 -6.462 -4.815 1.00 10.00 H new ATOM 0 HB3 MET A 12 -4.672 -6.312 -5.233 1.00 10.00 H new ATOM 0 HG2 MET A 12 -5.052 -4.691 -6.837 1.00 10.00 H new ATOM 0 HG3 MET A 12 -6.609 -5.348 -7.298 1.00 10.00 H new ATOM 0 HE1 MET A 12 -6.090 -3.276 -3.264 1.00 10.00 H new ATOM 0 HE2 MET A 12 -5.362 -4.791 -3.848 1.00 10.00 H new ATOM 0 HE3 MET A 12 -4.745 -3.226 -4.429 1.00 10.00 H new ATOM 186 N THR A 13 -7.459 -8.802 -7.874 1.00 10.00 N ATOM 187 CA THR A 13 -8.780 -9.083 -8.419 1.00 10.00 C ATOM 188 C THR A 13 -9.483 -10.072 -7.490 1.00 10.00 C ATOM 189 O THR A 13 -9.805 -11.187 -7.897 1.00 10.00 O ATOM 190 CB THR A 13 -8.620 -9.620 -9.847 1.00 10.00 C ATOM 191 OG1 THR A 13 -7.712 -10.703 -9.837 1.00 10.00 O ATOM 192 CG2 THR A 13 -8.087 -8.533 -10.786 1.00 10.00 C ATOM 0 H THR A 13 -6.719 -9.362 -8.297 1.00 10.00 H new ATOM 0 HA THR A 13 -9.395 -8.185 -8.476 1.00 10.00 H new ATOM 0 HB THR A 13 -9.597 -9.943 -10.206 1.00 10.00 H new ATOM 0 HG1 THR A 13 -8.034 -11.394 -9.222 1.00 10.00 H new ATOM 0 HG21 THR A 13 -7.983 -8.940 -11.792 1.00 10.00 H new ATOM 0 HG22 THR A 13 -8.783 -7.695 -10.804 1.00 10.00 H new ATOM 0 HG23 THR A 13 -7.115 -8.190 -10.431 1.00 10.00 H new ATOM 200 N CYS A 14 -9.646 -9.670 -6.227 1.00 10.00 N ATOM 201 CA CYS A 14 -9.985 -10.553 -5.121 1.00 10.00 C ATOM 202 C CYS A 14 -10.668 -9.806 -3.960 1.00 10.00 C ATOM 203 O CYS A 14 -11.472 -10.393 -3.239 1.00 10.00 O ATOM 204 CB CYS A 14 -8.716 -11.297 -4.679 1.00 10.00 C ATOM 205 SG CYS A 14 -8.763 -12.078 -3.043 1.00 10.00 S ATOM 0 H CYS A 14 -9.542 -8.696 -5.944 1.00 10.00 H new ATOM 0 HA CYS A 14 -10.723 -11.281 -5.458 1.00 10.00 H new ATOM 0 HB2 CYS A 14 -8.497 -12.067 -5.418 1.00 10.00 H new ATOM 0 HB3 CYS A 14 -7.884 -10.593 -4.697 1.00 10.00 H new ATOM 0 HG CYS A 14 -7.714 -11.722 -2.362 1.00 10.00 H new ATOM 210 N ALA A 15 -10.356 -8.519 -3.745 1.00 10.00 N ATOM 211 CA ALA A 15 -10.921 -7.686 -2.676 1.00 10.00 C ATOM 212 C ALA A 15 -10.328 -8.037 -1.308 1.00 10.00 C ATOM 213 O ALA A 15 -9.735 -7.182 -0.649 1.00 10.00 O ATOM 214 CB ALA A 15 -12.457 -7.691 -2.673 1.00 10.00 C ATOM 0 H ALA A 15 -9.685 -8.017 -4.327 1.00 10.00 H new ATOM 0 HA ALA A 15 -10.628 -6.658 -2.891 1.00 10.00 H new ATOM 0 HB1 ALA A 15 -12.821 -7.059 -1.863 1.00 10.00 H new ATOM 0 HB2 ALA A 15 -12.824 -7.308 -3.625 1.00 10.00 H new ATOM 0 HB3 ALA A 15 -12.817 -8.710 -2.529 1.00 10.00 H new ATOM 220 N ALA A 16 -10.414 -9.302 -0.894 1.00 10.00 N ATOM 221 CA ALA A 16 -9.759 -9.766 0.326 1.00 10.00 C ATOM 222 C ALA A 16 -8.250 -9.485 0.268 1.00 10.00 C ATOM 223 O ALA A 16 -7.629 -9.160 1.285 1.00 10.00 O ATOM 224 CB ALA A 16 -10.059 -11.252 0.539 1.00 10.00 C ATOM 0 H ALA A 16 -10.934 -10.026 -1.390 1.00 10.00 H new ATOM 0 HA ALA A 16 -10.153 -9.218 1.182 1.00 10.00 H new ATOM 0 HB1 ALA A 16 -9.569 -11.595 1.450 1.00 10.00 H new ATOM 0 HB2 ALA A 16 -11.136 -11.396 0.630 1.00 10.00 H new ATOM 0 HB3 ALA A 16 -9.686 -11.824 -0.311 1.00 10.00 H new ATOM 230 N CYS A 17 -7.676 -9.596 -0.932 1.00 10.00 N ATOM 231 CA CYS A 17 -6.341 -9.141 -1.287 1.00 10.00 C ATOM 232 C CYS A 17 -6.145 -7.663 -0.950 1.00 10.00 C ATOM 233 O CYS A 17 -5.159 -7.297 -0.315 1.00 10.00 O ATOM 234 CB CYS A 17 -6.132 -9.371 -2.785 1.00 10.00 C ATOM 235 SG CYS A 17 -5.637 -11.062 -3.217 1.00 10.00 S ATOM 0 H CYS A 17 -8.160 -10.029 -1.719 1.00 10.00 H new ATOM 0 HA CYS A 17 -5.609 -9.706 -0.710 1.00 10.00 H new ATOM 0 HB2 CYS A 17 -7.056 -9.130 -3.310 1.00 10.00 H new ATOM 0 HB3 CYS A 17 -5.371 -8.679 -3.145 1.00 10.00 H new ATOM 0 HG CYS A 17 -6.687 -11.748 -3.559 1.00 10.00 H new ATOM 240 N ALA A 18 -7.073 -6.809 -1.381 1.00 10.00 N ATOM 241 CA ALA A 18 -6.989 -5.376 -1.152 1.00 10.00 C ATOM 242 C ALA A 18 -6.953 -5.095 0.350 1.00 10.00 C ATOM 243 O ALA A 18 -6.040 -4.438 0.848 1.00 10.00 O ATOM 244 CB ALA A 18 -8.126 -4.663 -1.882 1.00 10.00 C ATOM 0 H ALA A 18 -7.903 -7.097 -1.899 1.00 10.00 H new ATOM 0 HA ALA A 18 -6.063 -4.977 -1.565 1.00 10.00 H new ATOM 0 HB1 ALA A 18 -8.056 -3.590 -1.705 1.00 10.00 H new ATOM 0 HB2 ALA A 18 -8.052 -4.860 -2.951 1.00 10.00 H new ATOM 0 HB3 ALA A 18 -9.083 -5.030 -1.511 1.00 10.00 H new ATOM 250 N ASN A 19 -7.903 -5.666 1.091 1.00 10.00 N ATOM 251 CA ASN A 19 -7.906 -5.540 2.548 1.00 10.00 C ATOM 252 C ASN A 19 -6.589 -6.029 3.162 1.00 10.00 C ATOM 253 O ASN A 19 -6.106 -5.470 4.147 1.00 10.00 O ATOM 254 CB ASN A 19 -9.094 -6.275 3.178 1.00 10.00 C ATOM 255 CG ASN A 19 -10.444 -5.645 2.846 1.00 10.00 C ATOM 256 OD1 ASN A 19 -11.323 -6.324 2.326 1.00 10.00 O ATOM 257 ND2 ASN A 19 -10.646 -4.368 3.158 1.00 10.00 N ATOM 0 H ASN A 19 -8.674 -6.215 0.711 1.00 10.00 H new ATOM 0 HA ASN A 19 -8.009 -4.478 2.770 1.00 10.00 H new ATOM 0 HB2 ASN A 19 -9.092 -7.311 2.839 1.00 10.00 H new ATOM 0 HB3 ASN A 19 -8.967 -6.294 4.260 1.00 10.00 H new ATOM 0 HD21 ASN A 19 -11.548 -3.932 2.965 1.00 10.00 H new ATOM 0 HD22 ASN A 19 -9.899 -3.824 3.590 1.00 10.00 H new ATOM 264 N ARG A 20 -5.977 -7.074 2.595 1.00 10.00 N ATOM 265 CA ARG A 20 -4.690 -7.559 3.041 1.00 10.00 C ATOM 266 C ARG A 20 -3.606 -6.494 2.872 1.00 10.00 C ATOM 267 O ARG A 20 -2.721 -6.400 3.724 1.00 10.00 O ATOM 268 CB ARG A 20 -4.388 -8.866 2.302 1.00 10.00 C ATOM 269 CG ARG A 20 -4.732 -10.073 3.178 1.00 10.00 C ATOM 270 CD ARG A 20 -5.182 -11.283 2.344 1.00 10.00 C ATOM 271 NE ARG A 20 -5.943 -12.234 3.167 1.00 10.00 N ATOM 272 CZ ARG A 20 -7.159 -11.994 3.689 1.00 10.00 C ATOM 273 NH1 ARG A 20 -7.829 -10.879 3.371 1.00 10.00 N ATOM 274 NH2 ARG A 20 -7.696 -12.868 4.547 1.00 10.00 N ATOM 0 H ARG A 20 -6.370 -7.600 1.814 1.00 10.00 H new ATOM 0 HA ARG A 20 -4.709 -7.771 4.110 1.00 10.00 H new ATOM 0 HB2 ARG A 20 -4.961 -8.907 1.376 1.00 10.00 H new ATOM 0 HB3 ARG A 20 -3.334 -8.899 2.026 1.00 10.00 H new ATOM 0 HG2 ARG A 20 -3.862 -10.348 3.774 1.00 10.00 H new ATOM 0 HG3 ARG A 20 -5.523 -9.800 3.876 1.00 10.00 H new ATOM 0 HD2 ARG A 20 -5.796 -10.946 1.509 1.00 10.00 H new ATOM 0 HD3 ARG A 20 -4.311 -11.781 1.918 1.00 10.00 H new ATOM 0 HE ARG A 20 -5.518 -13.142 3.356 1.00 10.00 H new ATOM 0 HH11 ARG A 20 -7.418 -10.203 2.728 1.00 10.00 H new ATOM 0 HH12 ARG A 20 -8.751 -10.706 3.772 1.00 10.00 H new ATOM 0 HH21 ARG A 20 -7.184 -13.712 4.803 1.00 10.00 H new ATOM 0 HH22 ARG A 20 -8.618 -12.691 4.946 1.00 10.00 H new ATOM 288 N ILE A 21 -3.686 -5.664 1.825 1.00 10.00 N ATOM 289 CA ILE A 21 -2.773 -4.531 1.696 1.00 10.00 C ATOM 290 C ILE A 21 -2.935 -3.619 2.911 1.00 10.00 C ATOM 291 O ILE A 21 -1.945 -3.311 3.574 1.00 10.00 O ATOM 292 CB ILE A 21 -2.937 -3.743 0.379 1.00 10.00 C ATOM 293 CG1 ILE A 21 -3.127 -4.689 -0.805 1.00 10.00 C ATOM 294 CG2 ILE A 21 -1.666 -2.928 0.129 1.00 10.00 C ATOM 295 CD1 ILE A 21 -2.923 -4.078 -2.193 1.00 10.00 C ATOM 0 H ILE A 21 -4.363 -5.756 1.068 1.00 10.00 H new ATOM 0 HA ILE A 21 -1.760 -4.932 1.659 1.00 10.00 H new ATOM 0 HB ILE A 21 -3.812 -3.100 0.471 1.00 10.00 H new ATOM 0 HG12 ILE A 21 -2.435 -5.523 -0.692 1.00 10.00 H new ATOM 0 HG13 ILE A 21 -4.135 -5.102 -0.756 1.00 10.00 H new ATOM 0 HG21 ILE A 21 -1.770 -2.367 -0.800 1.00 10.00 H new ATOM 0 HG22 ILE A 21 -1.509 -2.235 0.956 1.00 10.00 H new ATOM 0 HG23 ILE A 21 -0.812 -3.601 0.052 1.00 10.00 H new ATOM 0 HD11 ILE A 21 -3.084 -4.842 -2.954 1.00 10.00 H new ATOM 0 HD12 ILE A 21 -3.633 -3.264 -2.340 1.00 10.00 H new ATOM 0 HD13 ILE A 21 -1.907 -3.692 -2.275 1.00 10.00 H new ATOM 307 N GLU A 22 -4.175 -3.224 3.231 1.00 10.00 N ATOM 308 CA GLU A 22 -4.455 -2.376 4.388 1.00 10.00 C ATOM 309 C GLU A 22 -3.830 -2.989 5.637 1.00 10.00 C ATOM 310 O GLU A 22 -3.127 -2.317 6.392 1.00 10.00 O ATOM 311 CB GLU A 22 -5.964 -2.211 4.619 1.00 10.00 C ATOM 312 CG GLU A 22 -6.728 -1.742 3.385 1.00 10.00 C ATOM 313 CD GLU A 22 -8.196 -1.526 3.715 1.00 10.00 C ATOM 314 OE1 GLU A 22 -8.861 -2.544 4.016 1.00 10.00 O ATOM 315 OE2 GLU A 22 -8.619 -0.353 3.669 1.00 10.00 O ATOM 0 H GLU A 22 -5.004 -3.483 2.696 1.00 10.00 H new ATOM 0 HA GLU A 22 -4.027 -1.394 4.188 1.00 10.00 H new ATOM 0 HB2 GLU A 22 -6.378 -3.163 4.951 1.00 10.00 H new ATOM 0 HB3 GLU A 22 -6.122 -1.496 5.426 1.00 10.00 H new ATOM 0 HG2 GLU A 22 -6.293 -0.815 3.012 1.00 10.00 H new ATOM 0 HG3 GLU A 22 -6.633 -2.481 2.589 1.00 10.00 H new ATOM 322 N LYS A 23 -4.102 -4.277 5.848 1.00 10.00 N ATOM 323 CA LYS A 23 -3.621 -5.031 6.994 1.00 10.00 C ATOM 324 C LYS A 23 -2.091 -4.949 7.075 1.00 10.00 C ATOM 325 O LYS A 23 -1.549 -4.641 8.136 1.00 10.00 O ATOM 326 CB LYS A 23 -4.127 -6.483 6.909 1.00 10.00 C ATOM 327 CG LYS A 23 -4.954 -6.967 8.114 1.00 10.00 C ATOM 328 CD LYS A 23 -4.089 -7.431 9.301 1.00 10.00 C ATOM 329 CE LYS A 23 -3.824 -6.342 10.351 1.00 10.00 C ATOM 330 NZ LYS A 23 -4.959 -6.168 11.285 1.00 10.00 N ATOM 0 H LYS A 23 -4.675 -4.832 5.212 1.00 10.00 H new ATOM 0 HA LYS A 23 -4.014 -4.599 7.914 1.00 10.00 H new ATOM 0 HB2 LYS A 23 -4.733 -6.586 6.009 1.00 10.00 H new ATOM 0 HB3 LYS A 23 -3.267 -7.143 6.792 1.00 10.00 H new ATOM 0 HG2 LYS A 23 -5.608 -6.160 8.444 1.00 10.00 H new ATOM 0 HG3 LYS A 23 -5.596 -7.789 7.798 1.00 10.00 H new ATOM 0 HD2 LYS A 23 -4.580 -8.275 9.785 1.00 10.00 H new ATOM 0 HD3 LYS A 23 -3.134 -7.793 8.920 1.00 10.00 H new ATOM 0 HE2 LYS A 23 -2.928 -6.597 10.917 1.00 10.00 H new ATOM 0 HE3 LYS A 23 -3.624 -5.396 9.847 1.00 10.00 H new ATOM 0 HZ1 LYS A 23 -4.731 -5.423 11.973 1.00 10.00 H new ATOM 0 HZ2 LYS A 23 -5.810 -5.898 10.751 1.00 10.00 H new ATOM 0 HZ3 LYS A 23 -5.135 -7.061 11.788 1.00 10.00 H new ATOM 344 N ARG A 24 -1.396 -5.222 5.964 1.00 10.00 N ATOM 345 CA ARG A 24 0.060 -5.147 5.919 1.00 10.00 C ATOM 346 C ARG A 24 0.530 -3.734 6.245 1.00 10.00 C ATOM 347 O ARG A 24 1.393 -3.555 7.096 1.00 10.00 O ATOM 348 CB ARG A 24 0.607 -5.580 4.548 1.00 10.00 C ATOM 349 CG ARG A 24 1.851 -6.470 4.673 1.00 10.00 C ATOM 350 CD ARG A 24 1.492 -7.908 5.067 1.00 10.00 C ATOM 351 NE ARG A 24 2.666 -8.788 4.953 1.00 10.00 N ATOM 352 CZ ARG A 24 2.634 -10.131 4.932 1.00 10.00 C ATOM 353 NH1 ARG A 24 1.467 -10.781 4.988 1.00 10.00 N ATOM 354 NH2 ARG A 24 3.778 -10.823 4.880 1.00 10.00 N ATOM 0 H ARG A 24 -1.827 -5.498 5.082 1.00 10.00 H new ATOM 0 HA ARG A 24 0.448 -5.836 6.669 1.00 10.00 H new ATOM 0 HB2 ARG A 24 -0.169 -6.118 4.003 1.00 10.00 H new ATOM 0 HB3 ARG A 24 0.853 -4.695 3.961 1.00 10.00 H new ATOM 0 HG2 ARG A 24 2.388 -6.477 3.725 1.00 10.00 H new ATOM 0 HG3 ARG A 24 2.525 -6.048 5.418 1.00 10.00 H new ATOM 0 HD2 ARG A 24 1.115 -7.927 6.090 1.00 10.00 H new ATOM 0 HD3 ARG A 24 0.691 -8.277 4.426 1.00 10.00 H new ATOM 0 HE ARG A 24 3.580 -8.341 4.884 1.00 10.00 H new ATOM 0 HH11 ARG A 24 0.594 -10.257 5.047 1.00 10.00 H new ATOM 0 HH12 ARG A 24 1.450 -11.801 4.972 1.00 10.00 H new ATOM 0 HH21 ARG A 24 4.671 -10.331 4.856 1.00 10.00 H new ATOM 0 HH22 ARG A 24 3.757 -11.843 4.864 1.00 10.00 H new ATOM 368 N LEU A 25 -0.035 -2.740 5.559 1.00 10.00 N ATOM 369 CA LEU A 25 0.360 -1.346 5.692 1.00 10.00 C ATOM 370 C LEU A 25 0.212 -0.896 7.144 1.00 10.00 C ATOM 371 O LEU A 25 1.147 -0.342 7.714 1.00 10.00 O ATOM 372 CB LEU A 25 -0.458 -0.479 4.726 1.00 10.00 C ATOM 373 CG LEU A 25 -0.030 -0.694 3.262 1.00 10.00 C ATOM 374 CD1 LEU A 25 -1.133 -0.237 2.308 1.00 10.00 C ATOM 375 CD2 LEU A 25 1.235 0.107 2.935 1.00 10.00 C ATOM 0 H LEU A 25 -0.789 -2.887 4.888 1.00 10.00 H new ATOM 0 HA LEU A 25 1.410 -1.231 5.424 1.00 10.00 H new ATOM 0 HB2 LEU A 25 -1.517 -0.715 4.834 1.00 10.00 H new ATOM 0 HB3 LEU A 25 -0.337 0.572 4.989 1.00 10.00 H new ATOM 0 HG LEU A 25 0.163 -1.759 3.137 1.00 10.00 H new ATOM 0 HD11 LEU A 25 -0.813 -0.397 1.278 1.00 10.00 H new ATOM 0 HD12 LEU A 25 -2.040 -0.811 2.499 1.00 10.00 H new ATOM 0 HD13 LEU A 25 -1.334 0.823 2.465 1.00 10.00 H new ATOM 0 HD21 LEU A 25 1.515 -0.063 1.895 1.00 10.00 H new ATOM 0 HD22 LEU A 25 1.044 1.169 3.090 1.00 10.00 H new ATOM 0 HD23 LEU A 25 2.048 -0.214 3.587 1.00 10.00 H new ATOM 387 N ASN A 26 -0.930 -1.198 7.766 1.00 10.00 N ATOM 388 CA ASN A 26 -1.158 -0.965 9.188 1.00 10.00 C ATOM 389 C ASN A 26 -0.050 -1.601 10.028 1.00 10.00 C ATOM 390 O ASN A 26 0.372 -1.038 11.033 1.00 10.00 O ATOM 391 CB ASN A 26 -2.516 -1.544 9.606 1.00 10.00 C ATOM 392 CG ASN A 26 -3.661 -0.558 9.399 1.00 10.00 C ATOM 393 OD1 ASN A 26 -4.145 0.045 10.349 1.00 10.00 O ATOM 394 ND2 ASN A 26 -4.127 -0.404 8.165 1.00 10.00 N ATOM 0 H ASN A 26 -1.729 -1.615 7.289 1.00 10.00 H new ATOM 0 HA ASN A 26 -1.153 0.111 9.361 1.00 10.00 H new ATOM 0 HB2 ASN A 26 -2.713 -2.450 9.033 1.00 10.00 H new ATOM 0 HB3 ASN A 26 -2.476 -1.834 10.656 1.00 10.00 H new ATOM 0 HD21 ASN A 26 -4.907 0.229 7.990 1.00 10.00 H new ATOM 0 HD22 ASN A 26 -3.705 -0.919 7.392 1.00 10.00 H new ATOM 401 N LYS A 27 0.403 -2.794 9.634 1.00 10.00 N ATOM 402 CA LYS A 27 1.484 -3.490 10.314 1.00 10.00 C ATOM 403 C LYS A 27 2.845 -2.794 10.160 1.00 10.00 C ATOM 404 O LYS A 27 3.746 -3.104 10.935 1.00 10.00 O ATOM 405 CB LYS A 27 1.550 -4.961 9.856 1.00 10.00 C ATOM 406 CG LYS A 27 1.500 -5.905 11.064 1.00 10.00 C ATOM 407 CD LYS A 27 1.608 -7.382 10.659 1.00 10.00 C ATOM 408 CE LYS A 27 3.056 -7.759 10.310 1.00 10.00 C ATOM 409 NZ LYS A 27 3.202 -9.200 10.016 1.00 10.00 N ATOM 0 H LYS A 27 0.026 -3.300 8.833 1.00 10.00 H new ATOM 0 HA LYS A 27 1.256 -3.462 11.379 1.00 10.00 H new ATOM 0 HB2 LYS A 27 0.719 -5.176 9.185 1.00 10.00 H new ATOM 0 HB3 LYS A 27 2.467 -5.131 9.292 1.00 10.00 H new ATOM 0 HG2 LYS A 27 2.312 -5.659 11.748 1.00 10.00 H new ATOM 0 HG3 LYS A 27 0.568 -5.747 11.606 1.00 10.00 H new ATOM 0 HD2 LYS A 27 1.252 -8.012 11.474 1.00 10.00 H new ATOM 0 HD3 LYS A 27 0.963 -7.575 9.802 1.00 10.00 H new ATOM 0 HE2 LYS A 27 3.383 -7.179 9.447 1.00 10.00 H new ATOM 0 HE3 LYS A 27 3.710 -7.491 11.140 1.00 10.00 H new ATOM 0 HZ1 LYS A 27 4.195 -9.409 9.786 1.00 10.00 H new ATOM 0 HZ2 LYS A 27 2.915 -9.755 10.848 1.00 10.00 H new ATOM 0 HZ3 LYS A 27 2.599 -9.452 9.207 1.00 10.00 H new ATOM 423 N ILE A 28 3.042 -1.914 9.170 1.00 10.00 N ATOM 424 CA ILE A 28 4.324 -1.235 9.010 1.00 10.00 C ATOM 425 C ILE A 28 4.456 -0.138 10.061 1.00 10.00 C ATOM 426 O ILE A 28 3.588 0.717 10.235 1.00 10.00 O ATOM 427 CB ILE A 28 4.518 -0.637 7.611 1.00 10.00 C ATOM 428 CG1 ILE A 28 4.421 -1.720 6.525 1.00 10.00 C ATOM 429 CG2 ILE A 28 5.868 0.097 7.488 1.00 10.00 C ATOM 430 CD1 ILE A 28 4.376 -1.110 5.133 1.00 10.00 C ATOM 0 H ILE A 28 2.337 -1.661 8.478 1.00 10.00 H new ATOM 0 HA ILE A 28 5.101 -1.988 9.142 1.00 10.00 H new ATOM 0 HB ILE A 28 3.716 0.086 7.464 1.00 10.00 H new ATOM 0 HG12 ILE A 28 5.276 -2.391 6.602 1.00 10.00 H new ATOM 0 HG13 ILE A 28 3.527 -2.322 6.689 1.00 10.00 H new ATOM 0 HG21 ILE A 28 5.969 0.507 6.483 1.00 10.00 H new ATOM 0 HG22 ILE A 28 5.909 0.907 8.216 1.00 10.00 H new ATOM 0 HG23 ILE A 28 6.681 -0.603 7.678 1.00 10.00 H new ATOM 0 HD11 ILE A 28 4.308 -1.904 4.390 1.00 10.00 H new ATOM 0 HD12 ILE A 28 3.506 -0.459 5.049 1.00 10.00 H new ATOM 0 HD13 ILE A 28 5.282 -0.529 4.961 1.00 10.00 H new ATOM 442 N GLU A 29 5.613 -0.141 10.703 1.00 10.00 N ATOM 443 CA GLU A 29 6.014 0.820 11.706 1.00 10.00 C ATOM 444 C GLU A 29 6.357 2.133 10.995 1.00 10.00 C ATOM 445 O GLU A 29 7.380 2.213 10.318 1.00 10.00 O ATOM 446 CB GLU A 29 7.207 0.232 12.473 1.00 10.00 C ATOM 447 CG GLU A 29 6.826 -1.096 13.153 1.00 10.00 C ATOM 448 CD GLU A 29 8.031 -1.784 13.784 1.00 10.00 C ATOM 449 OE1 GLU A 29 8.775 -1.081 14.500 1.00 10.00 O ATOM 450 OE2 GLU A 29 8.181 -2.999 13.537 1.00 10.00 O ATOM 0 H GLU A 29 6.328 -0.848 10.528 1.00 10.00 H new ATOM 0 HA GLU A 29 5.223 1.029 12.426 1.00 10.00 H new ATOM 0 HB2 GLU A 29 8.039 0.068 11.788 1.00 10.00 H new ATOM 0 HB3 GLU A 29 7.548 0.945 13.224 1.00 10.00 H new ATOM 0 HG2 GLU A 29 6.074 -0.908 13.920 1.00 10.00 H new ATOM 0 HG3 GLU A 29 6.373 -1.762 12.419 1.00 10.00 H new ATOM 457 N GLY A 30 5.490 3.143 11.115 1.00 10.00 N ATOM 458 CA GLY A 30 5.732 4.482 10.584 1.00 10.00 C ATOM 459 C GLY A 30 4.660 4.958 9.604 1.00 10.00 C ATOM 460 O GLY A 30 4.594 6.148 9.300 1.00 10.00 O ATOM 0 H GLY A 30 4.592 3.050 11.589 1.00 10.00 H new ATOM 0 HA2 GLY A 30 5.792 5.187 11.413 1.00 10.00 H new ATOM 0 HA3 GLY A 30 6.700 4.495 10.084 1.00 10.00 H new ATOM 464 N VAL A 31 3.817 4.049 9.106 1.00 10.00 N ATOM 465 CA VAL A 31 2.668 4.414 8.288 1.00 10.00 C ATOM 466 C VAL A 31 1.580 4.967 9.210 1.00 10.00 C ATOM 467 O VAL A 31 1.355 4.424 10.290 1.00 10.00 O ATOM 468 CB VAL A 31 2.199 3.198 7.468 1.00 10.00 C ATOM 469 CG1 VAL A 31 0.890 3.483 6.719 1.00 10.00 C ATOM 470 CG2 VAL A 31 3.273 2.818 6.440 1.00 10.00 C ATOM 0 H VAL A 31 3.915 3.045 9.260 1.00 10.00 H new ATOM 0 HA VAL A 31 2.927 5.189 7.567 1.00 10.00 H new ATOM 0 HB VAL A 31 2.029 2.381 8.170 1.00 10.00 H new ATOM 0 HG11 VAL A 31 0.595 2.599 6.153 1.00 10.00 H new ATOM 0 HG12 VAL A 31 0.108 3.733 7.436 1.00 10.00 H new ATOM 0 HG13 VAL A 31 1.037 4.319 6.035 1.00 10.00 H new ATOM 0 HG21 VAL A 31 2.936 1.957 5.863 1.00 10.00 H new ATOM 0 HG22 VAL A 31 3.448 3.659 5.769 1.00 10.00 H new ATOM 0 HG23 VAL A 31 4.199 2.568 6.957 1.00 10.00 H new ATOM 480 N ALA A 32 0.916 6.051 8.796 1.00 10.00 N ATOM 481 CA ALA A 32 -0.177 6.642 9.556 1.00 10.00 C ATOM 482 C ALA A 32 -1.481 5.930 9.206 1.00 10.00 C ATOM 483 O ALA A 32 -2.218 5.504 10.092 1.00 10.00 O ATOM 484 CB ALA A 32 -0.268 8.145 9.267 1.00 10.00 C ATOM 0 H ALA A 32 1.125 6.539 7.925 1.00 10.00 H new ATOM 0 HA ALA A 32 0.008 6.519 10.623 1.00 10.00 H new ATOM 0 HB1 ALA A 32 -1.088 8.577 9.840 1.00 10.00 H new ATOM 0 HB2 ALA A 32 0.667 8.628 9.552 1.00 10.00 H new ATOM 0 HB3 ALA A 32 -0.447 8.301 8.203 1.00 10.00 H new ATOM 490 N ASN A 33 -1.762 5.793 7.908 1.00 10.00 N ATOM 491 CA ASN A 33 -2.969 5.161 7.390 1.00 10.00 C ATOM 492 C ASN A 33 -2.770 4.945 5.896 1.00 10.00 C ATOM 493 O ASN A 33 -1.818 5.468 5.334 1.00 10.00 O ATOM 494 CB ASN A 33 -4.229 5.992 7.690 1.00 10.00 C ATOM 495 CG ASN A 33 -4.118 7.452 7.254 1.00 10.00 C ATOM 496 OD1 ASN A 33 -3.523 8.260 7.960 1.00 10.00 O ATOM 497 ND2 ASN A 33 -4.696 7.812 6.111 1.00 10.00 N ATOM 0 H ASN A 33 -1.139 6.128 7.173 1.00 10.00 H new ATOM 0 HA ASN A 33 -3.130 4.204 7.886 1.00 10.00 H new ATOM 0 HB2 ASN A 33 -5.083 5.536 7.189 1.00 10.00 H new ATOM 0 HB3 ASN A 33 -4.431 5.956 8.760 1.00 10.00 H new ATOM 0 HD21 ASN A 33 -4.651 8.783 5.801 1.00 10.00 H new ATOM 0 HD22 ASN A 33 -5.184 7.117 5.545 1.00 10.00 H new ATOM 504 N ALA A 34 -3.630 4.145 5.263 1.00 10.00 N ATOM 505 CA ALA A 34 -3.498 3.732 3.872 1.00 10.00 C ATOM 506 C ALA A 34 -4.650 2.830 3.391 1.00 10.00 C ATOM 507 O ALA A 34 -4.422 1.653 3.108 1.00 10.00 O ATOM 508 CB ALA A 34 -2.186 2.973 3.687 1.00 10.00 C ATOM 0 H ALA A 34 -4.457 3.759 5.718 1.00 10.00 H new ATOM 0 HA ALA A 34 -3.522 4.645 3.277 1.00 10.00 H new ATOM 0 HB1 ALA A 34 -2.088 2.664 2.646 1.00 10.00 H new ATOM 0 HB2 ALA A 34 -1.351 3.620 3.954 1.00 10.00 H new ATOM 0 HB3 ALA A 34 -2.182 2.092 4.329 1.00 10.00 H new ATOM 514 N PRO A 35 -5.881 3.339 3.277 1.00 10.00 N ATOM 515 CA PRO A 35 -6.981 2.573 2.711 1.00 10.00 C ATOM 516 C PRO A 35 -6.803 2.451 1.190 1.00 10.00 C ATOM 517 O PRO A 35 -6.646 3.462 0.508 1.00 10.00 O ATOM 518 CB PRO A 35 -8.234 3.364 3.090 1.00 10.00 C ATOM 519 CG PRO A 35 -7.739 4.813 3.155 1.00 10.00 C ATOM 520 CD PRO A 35 -6.299 4.679 3.653 1.00 10.00 C ATOM 0 HA PRO A 35 -7.037 1.551 3.086 1.00 10.00 H new ATOM 0 HB2 PRO A 35 -9.024 3.243 2.349 1.00 10.00 H new ATOM 0 HB3 PRO A 35 -8.641 3.036 4.046 1.00 10.00 H new ATOM 0 HG2 PRO A 35 -7.782 5.296 2.179 1.00 10.00 H new ATOM 0 HG3 PRO A 35 -8.344 5.413 3.834 1.00 10.00 H new ATOM 0 HD2 PRO A 35 -5.655 5.433 3.199 1.00 10.00 H new ATOM 0 HD3 PRO A 35 -6.242 4.819 4.732 1.00 10.00 H new ATOM 528 N VAL A 36 -6.814 1.231 0.640 1.00 10.00 N ATOM 529 CA VAL A 36 -6.685 1.014 -0.799 1.00 10.00 C ATOM 530 C VAL A 36 -8.053 1.094 -1.489 1.00 10.00 C ATOM 531 O VAL A 36 -9.034 0.550 -0.985 1.00 10.00 O ATOM 532 CB VAL A 36 -5.929 -0.297 -1.065 1.00 10.00 C ATOM 533 CG1 VAL A 36 -6.541 -1.514 -0.374 1.00 10.00 C ATOM 534 CG2 VAL A 36 -5.822 -0.590 -2.562 1.00 10.00 C ATOM 0 H VAL A 36 -6.912 0.372 1.181 1.00 10.00 H new ATOM 0 HA VAL A 36 -6.089 1.812 -1.242 1.00 10.00 H new ATOM 0 HB VAL A 36 -4.939 -0.134 -0.640 1.00 10.00 H new ATOM 0 HG11 VAL A 36 -5.952 -2.400 -0.609 1.00 10.00 H new ATOM 0 HG12 VAL A 36 -6.544 -1.357 0.705 1.00 10.00 H new ATOM 0 HG13 VAL A 36 -7.564 -1.655 -0.723 1.00 10.00 H new ATOM 0 HG21 VAL A 36 -5.281 -1.525 -2.712 1.00 10.00 H new ATOM 0 HG22 VAL A 36 -6.821 -0.677 -2.988 1.00 10.00 H new ATOM 0 HG23 VAL A 36 -5.287 0.222 -3.054 1.00 10.00 H new ATOM 544 N ASN A 37 -8.141 1.777 -2.641 1.00 10.00 N ATOM 545 CA ASN A 37 -9.414 2.023 -3.304 1.00 10.00 C ATOM 546 C ASN A 37 -9.745 0.925 -4.317 1.00 10.00 C ATOM 547 O ASN A 37 -9.186 0.876 -5.416 1.00 10.00 O ATOM 548 CB ASN A 37 -9.488 3.439 -3.893 1.00 10.00 C ATOM 549 CG ASN A 37 -8.312 3.907 -4.745 1.00 10.00 C ATOM 550 OD1 ASN A 37 -7.635 4.865 -4.395 1.00 10.00 O ATOM 551 ND2 ASN A 37 -8.078 3.282 -5.890 1.00 10.00 N ATOM 0 H ASN A 37 -7.335 2.168 -3.129 1.00 10.00 H new ATOM 0 HA ASN A 37 -10.196 1.977 -2.546 1.00 10.00 H new ATOM 0 HB2 ASN A 37 -10.391 3.505 -4.500 1.00 10.00 H new ATOM 0 HB3 ASN A 37 -9.607 4.141 -3.068 1.00 10.00 H new ATOM 0 HD21 ASN A 37 -7.322 3.597 -6.498 1.00 10.00 H new ATOM 0 HD22 ASN A 37 -8.654 2.486 -6.163 1.00 10.00 H new ATOM 558 N PHE A 38 -10.696 0.055 -3.962 1.00 10.00 N ATOM 559 CA PHE A 38 -11.126 -1.057 -4.801 1.00 10.00 C ATOM 560 C PHE A 38 -11.999 -0.584 -5.966 1.00 10.00 C ATOM 561 O PHE A 38 -13.191 -0.875 -6.035 1.00 10.00 O ATOM 562 CB PHE A 38 -11.832 -2.116 -3.945 1.00 10.00 C ATOM 563 CG PHE A 38 -11.685 -3.504 -4.526 1.00 10.00 C ATOM 564 CD1 PHE A 38 -10.423 -4.110 -4.456 1.00 10.00 C ATOM 565 CD2 PHE A 38 -12.706 -4.099 -5.289 1.00 10.00 C ATOM 566 CE1 PHE A 38 -10.179 -5.310 -5.130 1.00 10.00 C ATOM 567 CE2 PHE A 38 -12.470 -5.322 -5.945 1.00 10.00 C ATOM 568 CZ PHE A 38 -11.205 -5.930 -5.865 1.00 10.00 C ATOM 0 H PHE A 38 -11.192 0.108 -3.072 1.00 10.00 H new ATOM 0 HA PHE A 38 -10.243 -1.515 -5.248 1.00 10.00 H new ATOM 0 HB2 PHE A 38 -11.420 -2.100 -2.936 1.00 10.00 H new ATOM 0 HB3 PHE A 38 -12.890 -1.868 -3.861 1.00 10.00 H new ATOM 0 HD1 PHE A 38 -9.636 -3.648 -3.879 1.00 10.00 H new ATOM 0 HD2 PHE A 38 -13.670 -3.618 -5.371 1.00 10.00 H new ATOM 0 HE1 PHE A 38 -9.199 -5.762 -5.086 1.00 10.00 H new ATOM 0 HE2 PHE A 38 -13.261 -5.793 -6.510 1.00 10.00 H new ATOM 0 HZ PHE A 38 -11.022 -6.869 -6.366 1.00 10.00 H new ATOM 578 N ALA A 39 -11.386 0.165 -6.880 1.00 10.00 N ATOM 579 CA ALA A 39 -12.010 0.692 -8.083 1.00 10.00 C ATOM 580 C ALA A 39 -10.922 1.066 -9.087 1.00 10.00 C ATOM 581 O ALA A 39 -10.863 0.515 -10.179 1.00 10.00 O ATOM 582 CB ALA A 39 -12.895 1.896 -7.733 1.00 10.00 C ATOM 0 H ALA A 39 -10.404 0.429 -6.796 1.00 10.00 H new ATOM 0 HA ALA A 39 -12.651 -0.065 -8.535 1.00 10.00 H new ATOM 0 HB1 ALA A 39 -13.358 2.283 -8.641 1.00 10.00 H new ATOM 0 HB2 ALA A 39 -13.671 1.586 -7.034 1.00 10.00 H new ATOM 0 HB3 ALA A 39 -12.285 2.675 -7.276 1.00 10.00 H new ATOM 588 N LEU A 40 -10.049 2.004 -8.702 1.00 10.00 N ATOM 589 CA LEU A 40 -9.001 2.530 -9.584 1.00 10.00 C ATOM 590 C LEU A 40 -7.734 1.674 -9.518 1.00 10.00 C ATOM 591 O LEU A 40 -6.799 1.879 -10.286 1.00 10.00 O ATOM 592 CB LEU A 40 -8.682 3.997 -9.248 1.00 10.00 C ATOM 593 CG LEU A 40 -9.934 4.852 -9.072 1.00 10.00 C ATOM 594 CD1 LEU A 40 -10.057 5.441 -7.662 1.00 10.00 C ATOM 595 CD2 LEU A 40 -10.026 5.970 -10.116 1.00 10.00 C ATOM 0 H LEU A 40 -10.049 2.420 -7.771 1.00 10.00 H new ATOM 0 HA LEU A 40 -9.381 2.488 -10.605 1.00 10.00 H new ATOM 0 HB2 LEU A 40 -8.091 4.035 -8.333 1.00 10.00 H new ATOM 0 HB3 LEU A 40 -8.067 4.421 -10.042 1.00 10.00 H new ATOM 0 HG LEU A 40 -10.771 4.171 -9.224 1.00 10.00 H new ATOM 0 HD11 LEU A 40 -10.966 6.039 -7.596 1.00 10.00 H new ATOM 0 HD12 LEU A 40 -10.101 4.632 -6.932 1.00 10.00 H new ATOM 0 HD13 LEU A 40 -9.192 6.071 -7.454 1.00 10.00 H new ATOM 0 HD21 LEU A 40 -10.934 6.550 -9.949 1.00 10.00 H new ATOM 0 HD22 LEU A 40 -9.157 6.622 -10.028 1.00 10.00 H new ATOM 0 HD23 LEU A 40 -10.053 5.534 -11.115 1.00 10.00 H new ATOM 607 N GLU A 41 -7.713 0.754 -8.554 1.00 10.00 N ATOM 608 CA GLU A 41 -6.606 -0.152 -8.247 1.00 10.00 C ATOM 609 C GLU A 41 -5.360 0.671 -7.883 1.00 10.00 C ATOM 610 O GLU A 41 -4.252 0.442 -8.363 1.00 10.00 O ATOM 611 CB GLU A 41 -6.395 -1.205 -9.360 1.00 10.00 C ATOM 612 CG GLU A 41 -6.081 -2.590 -8.753 1.00 10.00 C ATOM 613 CD GLU A 41 -5.748 -3.694 -9.766 1.00 10.00 C ATOM 614 OE1 GLU A 41 -6.225 -3.570 -10.914 1.00 10.00 O ATOM 615 OE2 GLU A 41 -5.084 -4.684 -9.360 1.00 10.00 O ATOM 0 H GLU A 41 -8.510 0.613 -7.933 1.00 10.00 H new ATOM 0 HA GLU A 41 -6.847 -0.752 -7.370 1.00 10.00 H new ATOM 0 HB2 GLU A 41 -7.289 -1.269 -9.980 1.00 10.00 H new ATOM 0 HB3 GLU A 41 -5.577 -0.894 -10.010 1.00 10.00 H new ATOM 0 HG2 GLU A 41 -5.241 -2.485 -8.067 1.00 10.00 H new ATOM 0 HG3 GLU A 41 -6.938 -2.911 -8.161 1.00 10.00 H new ATOM 622 N THR A 42 -5.570 1.638 -6.985 1.00 10.00 N ATOM 623 CA THR A 42 -4.557 2.511 -6.416 1.00 10.00 C ATOM 624 C THR A 42 -4.712 2.492 -4.894 1.00 10.00 C ATOM 625 O THR A 42 -5.821 2.317 -4.385 1.00 10.00 O ATOM 626 CB THR A 42 -4.627 3.926 -7.032 1.00 10.00 C ATOM 627 OG1 THR A 42 -3.618 4.062 -8.015 1.00 10.00 O ATOM 628 CG2 THR A 42 -4.420 5.061 -6.025 1.00 10.00 C ATOM 0 H THR A 42 -6.502 1.838 -6.621 1.00 10.00 H new ATOM 0 HA THR A 42 -3.557 2.152 -6.658 1.00 10.00 H new ATOM 0 HB THR A 42 -5.634 4.015 -7.440 1.00 10.00 H new ATOM 0 HG1 THR A 42 -2.746 3.853 -7.620 1.00 10.00 H new ATOM 0 HG21 THR A 42 -4.484 6.020 -6.539 1.00 10.00 H new ATOM 0 HG22 THR A 42 -5.190 5.010 -5.255 1.00 10.00 H new ATOM 0 HG23 THR A 42 -3.438 4.963 -5.563 1.00 10.00 H new ATOM 636 N VAL A 43 -3.600 2.663 -4.174 1.00 10.00 N ATOM 637 CA VAL A 43 -3.604 2.912 -2.736 1.00 10.00 C ATOM 638 C VAL A 43 -2.961 4.265 -2.453 1.00 10.00 C ATOM 639 O VAL A 43 -1.920 4.586 -3.027 1.00 10.00 O ATOM 640 CB VAL A 43 -2.942 1.761 -1.951 1.00 10.00 C ATOM 641 CG1 VAL A 43 -1.498 1.495 -2.378 1.00 10.00 C ATOM 642 CG2 VAL A 43 -2.985 2.012 -0.438 1.00 10.00 C ATOM 0 H VAL A 43 -2.665 2.632 -4.580 1.00 10.00 H new ATOM 0 HA VAL A 43 -4.635 2.947 -2.385 1.00 10.00 H new ATOM 0 HB VAL A 43 -3.529 0.874 -2.190 1.00 10.00 H new ATOM 0 HG11 VAL A 43 -1.090 0.674 -1.788 1.00 10.00 H new ATOM 0 HG12 VAL A 43 -1.474 1.229 -3.435 1.00 10.00 H new ATOM 0 HG13 VAL A 43 -0.900 2.391 -2.216 1.00 10.00 H new ATOM 0 HG21 VAL A 43 -2.510 1.181 0.082 1.00 10.00 H new ATOM 0 HG22 VAL A 43 -2.454 2.936 -0.207 1.00 10.00 H new ATOM 0 HG23 VAL A 43 -4.022 2.098 -0.113 1.00 10.00 H new ATOM 652 N THR A 44 -3.599 5.036 -1.573 1.00 10.00 N ATOM 653 CA THR A 44 -3.180 6.334 -1.090 1.00 10.00 C ATOM 654 C THR A 44 -2.591 6.145 0.311 1.00 10.00 C ATOM 655 O THR A 44 -3.321 6.135 1.300 1.00 10.00 O ATOM 656 CB THR A 44 -4.431 7.227 -1.075 1.00 10.00 C ATOM 657 OG1 THR A 44 -5.555 6.448 -0.695 1.00 10.00 O ATOM 658 CG2 THR A 44 -4.711 7.797 -2.467 1.00 10.00 C ATOM 0 H THR A 44 -4.482 4.742 -1.155 1.00 10.00 H new ATOM 0 HA THR A 44 -2.419 6.800 -1.716 1.00 10.00 H new ATOM 0 HB THR A 44 -4.258 8.043 -0.373 1.00 10.00 H new ATOM 0 HG1 THR A 44 -5.351 5.961 0.131 1.00 10.00 H new ATOM 0 HG21 THR A 44 -5.601 8.425 -2.431 1.00 10.00 H new ATOM 0 HG22 THR A 44 -3.859 8.393 -2.794 1.00 10.00 H new ATOM 0 HG23 THR A 44 -4.873 6.979 -3.169 1.00 10.00 H new ATOM 666 N VAL A 45 -1.273 5.956 0.412 1.00 10.00 N ATOM 667 CA VAL A 45 -0.620 5.743 1.696 1.00 10.00 C ATOM 668 C VAL A 45 -0.312 7.088 2.340 1.00 10.00 C ATOM 669 O VAL A 45 0.374 7.910 1.740 1.00 10.00 O ATOM 670 CB VAL A 45 0.671 4.930 1.534 1.00 10.00 C ATOM 671 CG1 VAL A 45 1.415 4.827 2.874 1.00 10.00 C ATOM 672 CG2 VAL A 45 0.379 3.519 1.009 1.00 10.00 C ATOM 0 H VAL A 45 -0.639 5.947 -0.387 1.00 10.00 H new ATOM 0 HA VAL A 45 -1.296 5.176 2.337 1.00 10.00 H new ATOM 0 HB VAL A 45 1.296 5.452 0.809 1.00 10.00 H new ATOM 0 HG11 VAL A 45 2.328 4.247 2.740 1.00 10.00 H new ATOM 0 HG12 VAL A 45 1.669 5.827 3.227 1.00 10.00 H new ATOM 0 HG13 VAL A 45 0.777 4.334 3.608 1.00 10.00 H new ATOM 0 HG21 VAL A 45 1.314 2.969 0.905 1.00 10.00 H new ATOM 0 HG22 VAL A 45 -0.273 2.998 1.710 1.00 10.00 H new ATOM 0 HG23 VAL A 45 -0.112 3.586 0.038 1.00 10.00 H new ATOM 682 N GLU A 46 -0.754 7.271 3.581 1.00 10.00 N ATOM 683 CA GLU A 46 -0.353 8.376 4.429 1.00 10.00 C ATOM 684 C GLU A 46 0.717 7.937 5.428 1.00 10.00 C ATOM 685 O GLU A 46 0.525 6.976 6.177 1.00 10.00 O ATOM 686 CB GLU A 46 -1.553 8.937 5.176 1.00 10.00 C ATOM 687 CG GLU A 46 -2.493 9.707 4.248 1.00 10.00 C ATOM 688 CD GLU A 46 -3.268 10.747 5.038 1.00 10.00 C ATOM 689 OE1 GLU A 46 -2.681 11.827 5.291 1.00 10.00 O ATOM 690 OE2 GLU A 46 -4.422 10.425 5.391 1.00 10.00 O ATOM 0 H GLU A 46 -1.416 6.638 4.030 1.00 10.00 H new ATOM 0 HA GLU A 46 0.065 9.154 3.789 1.00 10.00 H new ATOM 0 HB2 GLU A 46 -2.099 8.122 5.651 1.00 10.00 H new ATOM 0 HB3 GLU A 46 -1.209 9.596 5.973 1.00 10.00 H new ATOM 0 HG2 GLU A 46 -1.920 10.192 3.458 1.00 10.00 H new ATOM 0 HG3 GLU A 46 -3.184 9.017 3.764 1.00 10.00 H new ATOM 697 N TYR A 47 1.831 8.668 5.468 1.00 10.00 N ATOM 698 CA TYR A 47 2.925 8.418 6.391 1.00 10.00 C ATOM 699 C TYR A 47 3.729 9.702 6.586 1.00 10.00 C ATOM 700 O TYR A 47 3.304 10.768 6.141 1.00 10.00 O ATOM 701 CB TYR A 47 3.775 7.226 5.913 1.00 10.00 C ATOM 702 CG TYR A 47 4.664 7.453 4.705 1.00 10.00 C ATOM 703 CD1 TYR A 47 4.096 7.648 3.433 1.00 10.00 C ATOM 704 CD2 TYR A 47 6.061 7.319 4.828 1.00 10.00 C ATOM 705 CE1 TYR A 47 4.920 7.706 2.298 1.00 10.00 C ATOM 706 CE2 TYR A 47 6.885 7.404 3.693 1.00 10.00 C ATOM 707 CZ TYR A 47 6.316 7.638 2.434 1.00 10.00 C ATOM 708 OH TYR A 47 7.116 7.871 1.356 1.00 10.00 O ATOM 0 H TYR A 47 1.996 9.461 4.848 1.00 10.00 H new ATOM 0 HA TYR A 47 2.536 8.133 7.369 1.00 10.00 H new ATOM 0 HB2 TYR A 47 4.406 6.906 6.742 1.00 10.00 H new ATOM 0 HB3 TYR A 47 3.102 6.399 5.687 1.00 10.00 H new ATOM 0 HD1 TYR A 47 3.026 7.753 3.330 1.00 10.00 H new ATOM 0 HD2 TYR A 47 6.501 7.150 5.800 1.00 10.00 H new ATOM 0 HE1 TYR A 47 4.479 7.803 1.317 1.00 10.00 H new ATOM 0 HE2 TYR A 47 7.954 7.289 3.791 1.00 10.00 H new ATOM 0 HH TYR A 47 6.758 8.623 0.839 1.00 10.00 H new ATOM 718 N ASN A 48 4.874 9.599 7.267 1.00 10.00 N ATOM 719 CA ASN A 48 5.831 10.677 7.444 1.00 10.00 C ATOM 720 C ASN A 48 7.152 10.215 6.824 1.00 10.00 C ATOM 721 O ASN A 48 7.554 9.082 7.105 1.00 10.00 O ATOM 722 CB ASN A 48 6.040 10.917 8.943 1.00 10.00 C ATOM 723 CG ASN A 48 4.869 11.621 9.625 1.00 10.00 C ATOM 724 OD1 ASN A 48 4.009 12.214 8.982 1.00 10.00 O ATOM 725 ND2 ASN A 48 4.828 11.571 10.952 1.00 10.00 N ATOM 0 H ASN A 48 5.163 8.733 7.722 1.00 10.00 H new ATOM 0 HA ASN A 48 5.478 11.596 6.977 1.00 10.00 H new ATOM 0 HB2 ASN A 48 6.211 9.959 9.434 1.00 10.00 H new ATOM 0 HB3 ASN A 48 6.942 11.513 9.084 1.00 10.00 H new ATOM 0 HD21 ASN A 48 4.071 12.032 11.457 1.00 10.00 H new ATOM 0 HD22 ASN A 48 5.554 11.072 11.466 1.00 10.00 H new ATOM 732 N PRO A 49 7.861 11.059 6.051 1.00 10.00 N ATOM 733 CA PRO A 49 9.100 10.704 5.359 1.00 10.00 C ATOM 734 C PRO A 49 10.290 10.649 6.329 1.00 10.00 C ATOM 735 O PRO A 49 11.330 11.278 6.116 1.00 10.00 O ATOM 736 CB PRO A 49 9.280 11.786 4.286 1.00 10.00 C ATOM 737 CG PRO A 49 8.628 13.013 4.922 1.00 10.00 C ATOM 738 CD PRO A 49 7.457 12.410 5.697 1.00 10.00 C ATOM 0 HA PRO A 49 9.051 9.709 4.917 1.00 10.00 H new ATOM 0 HB2 PRO A 49 10.332 11.959 4.060 1.00 10.00 H new ATOM 0 HB3 PRO A 49 8.794 11.511 3.350 1.00 10.00 H new ATOM 0 HG2 PRO A 49 9.318 13.543 5.579 1.00 10.00 H new ATOM 0 HG3 PRO A 49 8.291 13.727 4.171 1.00 10.00 H new ATOM 0 HD2 PRO A 49 7.236 12.997 6.589 1.00 10.00 H new ATOM 0 HD3 PRO A 49 6.552 12.400 5.090 1.00 10.00 H new ATOM 746 N LYS A 50 10.146 9.894 7.416 1.00 10.00 N ATOM 747 CA LYS A 50 11.140 9.752 8.460 1.00 10.00 C ATOM 748 C LYS A 50 11.012 8.430 9.223 1.00 10.00 C ATOM 749 O LYS A 50 11.990 8.033 9.851 1.00 10.00 O ATOM 750 CB LYS A 50 11.077 10.969 9.394 1.00 10.00 C ATOM 751 CG LYS A 50 12.457 11.466 9.862 1.00 10.00 C ATOM 752 CD LYS A 50 13.086 12.551 8.959 1.00 10.00 C ATOM 753 CE LYS A 50 14.253 12.114 8.057 1.00 10.00 C ATOM 754 NZ LYS A 50 13.855 11.186 6.981 1.00 10.00 N ATOM 0 H LYS A 50 9.303 9.348 7.594 1.00 10.00 H new ATOM 0 HA LYS A 50 12.124 9.719 7.992 1.00 10.00 H new ATOM 0 HB2 LYS A 50 10.563 11.782 8.881 1.00 10.00 H new ATOM 0 HB3 LYS A 50 10.478 10.714 10.268 1.00 10.00 H new ATOM 0 HG2 LYS A 50 12.363 11.862 10.873 1.00 10.00 H new ATOM 0 HG3 LYS A 50 13.137 10.616 9.915 1.00 10.00 H new ATOM 0 HD2 LYS A 50 12.301 12.961 8.324 1.00 10.00 H new ATOM 0 HD3 LYS A 50 13.436 13.363 9.597 1.00 10.00 H new ATOM 0 HE2 LYS A 50 14.708 12.999 7.612 1.00 10.00 H new ATOM 0 HE3 LYS A 50 15.017 11.638 8.671 1.00 10.00 H new ATOM 0 HZ1 LYS A 50 14.398 11.399 6.120 1.00 10.00 H new ATOM 0 HZ2 LYS A 50 14.046 10.208 7.278 1.00 10.00 H new ATOM 0 HZ3 LYS A 50 12.840 11.296 6.785 1.00 10.00 H new ATOM 768 N GLU A 51 9.853 7.758 9.159 1.00 10.00 N ATOM 769 CA GLU A 51 9.592 6.555 9.933 1.00 10.00 C ATOM 770 C GLU A 51 9.508 5.360 8.980 1.00 10.00 C ATOM 771 O GLU A 51 10.323 4.445 9.049 1.00 10.00 O ATOM 772 CB GLU A 51 8.299 6.754 10.739 1.00 10.00 C ATOM 773 CG GLU A 51 8.341 7.989 11.655 1.00 10.00 C ATOM 774 CD GLU A 51 9.419 7.901 12.728 1.00 10.00 C ATOM 775 OE1 GLU A 51 9.563 6.799 13.299 1.00 10.00 O ATOM 776 OE2 GLU A 51 10.057 8.947 12.969 1.00 10.00 O ATOM 0 H GLU A 51 9.074 8.042 8.565 1.00 10.00 H new ATOM 0 HA GLU A 51 10.397 6.357 10.641 1.00 10.00 H new ATOM 0 HB2 GLU A 51 7.460 6.849 10.050 1.00 10.00 H new ATOM 0 HB3 GLU A 51 8.115 5.866 11.344 1.00 10.00 H new ATOM 0 HG2 GLU A 51 8.512 8.878 11.048 1.00 10.00 H new ATOM 0 HG3 GLU A 51 7.370 8.112 12.134 1.00 10.00 H new ATOM 783 N ALA A 52 8.529 5.394 8.072 1.00 10.00 N ATOM 784 CA ALA A 52 8.335 4.405 7.028 1.00 10.00 C ATOM 785 C ALA A 52 8.902 4.947 5.715 1.00 10.00 C ATOM 786 O ALA A 52 9.302 6.109 5.639 1.00 10.00 O ATOM 787 CB ALA A 52 6.837 4.125 6.913 1.00 10.00 C ATOM 0 H ALA A 52 7.831 6.138 8.049 1.00 10.00 H new ATOM 0 HA ALA A 52 8.854 3.475 7.262 1.00 10.00 H new ATOM 0 HB1 ALA A 52 6.664 3.383 6.133 1.00 10.00 H new ATOM 0 HB2 ALA A 52 6.464 3.745 7.864 1.00 10.00 H new ATOM 0 HB3 ALA A 52 6.313 5.047 6.659 1.00 10.00 H new ATOM 793 N SER A 53 8.901 4.106 4.678 1.00 10.00 N ATOM 794 CA SER A 53 9.455 4.429 3.372 1.00 10.00 C ATOM 795 C SER A 53 8.632 3.742 2.281 1.00 10.00 C ATOM 796 O SER A 53 8.188 2.605 2.454 1.00 10.00 O ATOM 797 CB SER A 53 10.929 4.005 3.274 1.00 10.00 C ATOM 798 OG SER A 53 11.515 3.765 4.537 1.00 10.00 O ATOM 0 H SER A 53 8.507 3.167 4.729 1.00 10.00 H new ATOM 0 HA SER A 53 9.409 5.509 3.234 1.00 10.00 H new ATOM 0 HB2 SER A 53 11.003 3.103 2.667 1.00 10.00 H new ATOM 0 HB3 SER A 53 11.493 4.783 2.759 1.00 10.00 H new ATOM 0 HG SER A 53 11.545 2.800 4.706 1.00 10.00 H new ATOM 804 N VAL A 54 8.481 4.411 1.137 1.00 10.00 N ATOM 805 CA VAL A 54 7.765 3.888 -0.019 1.00 10.00 C ATOM 806 C VAL A 54 8.353 2.551 -0.483 1.00 10.00 C ATOM 807 O VAL A 54 7.622 1.614 -0.791 1.00 10.00 O ATOM 808 CB VAL A 54 7.693 4.965 -1.117 1.00 10.00 C ATOM 809 CG1 VAL A 54 9.059 5.471 -1.601 1.00 10.00 C ATOM 810 CG2 VAL A 54 6.865 4.499 -2.319 1.00 10.00 C ATOM 0 H VAL A 54 8.860 5.346 0.989 1.00 10.00 H new ATOM 0 HA VAL A 54 6.736 3.657 0.257 1.00 10.00 H new ATOM 0 HB VAL A 54 7.198 5.807 -0.634 1.00 10.00 H new ATOM 0 HG11 VAL A 54 8.914 6.226 -2.373 1.00 10.00 H new ATOM 0 HG12 VAL A 54 9.603 5.908 -0.763 1.00 10.00 H new ATOM 0 HG13 VAL A 54 9.631 4.638 -2.010 1.00 10.00 H new ATOM 0 HG21 VAL A 54 6.839 5.288 -3.071 1.00 10.00 H new ATOM 0 HG22 VAL A 54 7.317 3.604 -2.747 1.00 10.00 H new ATOM 0 HG23 VAL A 54 5.849 4.273 -1.995 1.00 10.00 H new ATOM 820 N SER A 55 9.682 2.439 -0.498 1.00 10.00 N ATOM 821 CA SER A 55 10.352 1.197 -0.871 1.00 10.00 C ATOM 822 C SER A 55 10.057 0.058 0.117 1.00 10.00 C ATOM 823 O SER A 55 9.890 -1.089 -0.301 1.00 10.00 O ATOM 824 CB SER A 55 11.857 1.436 -1.020 1.00 10.00 C ATOM 825 OG SER A 55 12.089 2.372 -2.058 1.00 10.00 O ATOM 0 H SER A 55 10.317 3.199 -0.254 1.00 10.00 H new ATOM 0 HA SER A 55 9.953 0.878 -1.834 1.00 10.00 H new ATOM 0 HB2 SER A 55 12.271 1.807 -0.083 1.00 10.00 H new ATOM 0 HB3 SER A 55 12.364 0.497 -1.243 1.00 10.00 H new ATOM 0 HG SER A 55 13.052 2.525 -2.151 1.00 10.00 H new ATOM 831 N ASP A 56 9.987 0.365 1.417 1.00 10.00 N ATOM 832 CA ASP A 56 9.778 -0.637 2.455 1.00 10.00 C ATOM 833 C ASP A 56 8.393 -1.238 2.266 1.00 10.00 C ATOM 834 O ASP A 56 8.235 -2.438 2.037 1.00 10.00 O ATOM 835 CB ASP A 56 9.906 -0.008 3.850 1.00 10.00 C ATOM 836 CG ASP A 56 11.357 0.123 4.272 1.00 10.00 C ATOM 837 OD1 ASP A 56 11.884 -0.874 4.802 1.00 10.00 O ATOM 838 OD2 ASP A 56 11.908 1.222 4.048 1.00 10.00 O ATOM 0 H ASP A 56 10.074 1.317 1.774 1.00 10.00 H new ATOM 0 HA ASP A 56 10.536 -1.416 2.375 1.00 10.00 H new ATOM 0 HB2 ASP A 56 9.436 0.975 3.851 1.00 10.00 H new ATOM 0 HB3 ASP A 56 9.369 -0.619 4.576 1.00 10.00 H new ATOM 843 N LEU A 57 7.377 -0.375 2.325 1.00 10.00 N ATOM 844 CA LEU A 57 6.012 -0.795 2.078 1.00 10.00 C ATOM 845 C LEU A 57 5.875 -1.502 0.734 1.00 10.00 C ATOM 846 O LEU A 57 5.140 -2.486 0.660 1.00 10.00 O ATOM 847 CB LEU A 57 5.027 0.354 2.313 1.00 10.00 C ATOM 848 CG LEU A 57 5.142 1.527 1.342 1.00 10.00 C ATOM 849 CD1 LEU A 57 4.316 1.324 0.069 1.00 10.00 C ATOM 850 CD2 LEU A 57 4.659 2.789 2.055 1.00 10.00 C ATOM 0 H LEU A 57 7.482 0.616 2.542 1.00 10.00 H new ATOM 0 HA LEU A 57 5.737 -1.553 2.811 1.00 10.00 H new ATOM 0 HB2 LEU A 57 4.013 -0.043 2.258 1.00 10.00 H new ATOM 0 HB3 LEU A 57 5.168 0.729 3.327 1.00 10.00 H new ATOM 0 HG LEU A 57 6.185 1.611 1.038 1.00 10.00 H new ATOM 0 HD11 LEU A 57 4.436 2.188 -0.584 1.00 10.00 H new ATOM 0 HD12 LEU A 57 4.659 0.428 -0.448 1.00 10.00 H new ATOM 0 HD13 LEU A 57 3.264 1.211 0.332 1.00 10.00 H new ATOM 0 HD21 LEU A 57 4.733 3.640 1.378 1.00 10.00 H new ATOM 0 HD22 LEU A 57 3.621 2.659 2.362 1.00 10.00 H new ATOM 0 HD23 LEU A 57 5.278 2.970 2.934 1.00 10.00 H new ATOM 862 N LYS A 58 6.611 -1.067 -0.304 1.00 10.00 N ATOM 863 CA LYS A 58 6.672 -1.819 -1.551 1.00 10.00 C ATOM 864 C LYS A 58 6.943 -3.293 -1.244 1.00 10.00 C ATOM 865 O LYS A 58 6.143 -4.153 -1.604 1.00 10.00 O ATOM 866 CB LYS A 58 7.722 -1.251 -2.527 1.00 10.00 C ATOM 867 CG LYS A 58 7.227 -1.254 -3.979 1.00 10.00 C ATOM 868 CD LYS A 58 6.940 -2.659 -4.536 1.00 10.00 C ATOM 869 CE LYS A 58 7.950 -3.107 -5.598 1.00 10.00 C ATOM 870 NZ LYS A 58 9.309 -3.263 -5.041 1.00 10.00 N ATOM 0 H LYS A 58 7.162 -0.209 -0.297 1.00 10.00 H new ATOM 0 HA LYS A 58 5.708 -1.725 -2.051 1.00 10.00 H new ATOM 0 HB2 LYS A 58 7.974 -0.232 -2.233 1.00 10.00 H new ATOM 0 HB3 LYS A 58 8.637 -1.839 -2.456 1.00 10.00 H new ATOM 0 HG2 LYS A 58 6.318 -0.655 -4.044 1.00 10.00 H new ATOM 0 HG3 LYS A 58 7.974 -0.770 -4.608 1.00 10.00 H new ATOM 0 HD2 LYS A 58 6.944 -3.376 -3.715 1.00 10.00 H new ATOM 0 HD3 LYS A 58 5.939 -2.674 -4.967 1.00 10.00 H new ATOM 0 HE2 LYS A 58 7.625 -4.053 -6.030 1.00 10.00 H new ATOM 0 HE3 LYS A 58 7.972 -2.377 -6.408 1.00 10.00 H new ATOM 0 HZ1 LYS A 58 9.960 -3.567 -5.793 1.00 10.00 H new ATOM 0 HZ2 LYS A 58 9.631 -2.354 -4.651 1.00 10.00 H new ATOM 0 HZ3 LYS A 58 9.295 -3.978 -4.286 1.00 10.00 H new ATOM 884 N GLU A 59 8.057 -3.595 -0.576 1.00 10.00 N ATOM 885 CA GLU A 59 8.411 -4.977 -0.291 1.00 10.00 C ATOM 886 C GLU A 59 7.302 -5.678 0.504 1.00 10.00 C ATOM 887 O GLU A 59 7.060 -6.872 0.334 1.00 10.00 O ATOM 888 CB GLU A 59 9.741 -5.050 0.467 1.00 10.00 C ATOM 889 CG GLU A 59 10.429 -6.384 0.152 1.00 10.00 C ATOM 890 CD GLU A 59 11.444 -6.763 1.216 1.00 10.00 C ATOM 891 OE1 GLU A 59 12.601 -6.317 1.098 1.00 10.00 O ATOM 892 OE2 GLU A 59 11.036 -7.558 2.094 1.00 10.00 O ATOM 0 H GLU A 59 8.722 -2.905 -0.227 1.00 10.00 H new ATOM 0 HA GLU A 59 8.526 -5.496 -1.243 1.00 10.00 H new ATOM 0 HB2 GLU A 59 10.384 -4.219 0.178 1.00 10.00 H new ATOM 0 HB3 GLU A 59 9.567 -4.961 1.539 1.00 10.00 H new ATOM 0 HG2 GLU A 59 9.678 -7.170 0.071 1.00 10.00 H new ATOM 0 HG3 GLU A 59 10.926 -6.317 -0.816 1.00 10.00 H new ATOM 899 N ALA A 60 6.628 -4.935 1.383 1.00 10.00 N ATOM 900 CA ALA A 60 5.628 -5.479 2.285 1.00 10.00 C ATOM 901 C ALA A 60 4.414 -5.954 1.493 1.00 10.00 C ATOM 902 O ALA A 60 3.913 -7.051 1.733 1.00 10.00 O ATOM 903 CB ALA A 60 5.236 -4.441 3.339 1.00 10.00 C ATOM 0 H ALA A 60 6.767 -3.930 1.485 1.00 10.00 H new ATOM 0 HA ALA A 60 6.049 -6.338 2.808 1.00 10.00 H new ATOM 0 HB1 ALA A 60 4.486 -4.865 4.006 1.00 10.00 H new ATOM 0 HB2 ALA A 60 6.116 -4.158 3.916 1.00 10.00 H new ATOM 0 HB3 ALA A 60 4.826 -3.559 2.846 1.00 10.00 H new ATOM 909 N VAL A 61 3.935 -5.131 0.555 1.00 10.00 N ATOM 910 CA VAL A 61 2.833 -5.513 -0.300 1.00 10.00 C ATOM 911 C VAL A 61 3.269 -6.597 -1.282 1.00 10.00 C ATOM 912 O VAL A 61 2.576 -7.596 -1.446 1.00 10.00 O ATOM 913 CB VAL A 61 2.249 -4.283 -0.995 1.00 10.00 C ATOM 914 CG1 VAL A 61 1.731 -3.275 0.040 1.00 10.00 C ATOM 915 CG2 VAL A 61 3.169 -3.555 -1.973 1.00 10.00 C ATOM 0 H VAL A 61 4.302 -4.196 0.377 1.00 10.00 H new ATOM 0 HA VAL A 61 2.036 -5.942 0.307 1.00 10.00 H new ATOM 0 HB VAL A 61 1.443 -4.693 -1.604 1.00 10.00 H new ATOM 0 HG11 VAL A 61 1.319 -2.406 -0.473 1.00 10.00 H new ATOM 0 HG12 VAL A 61 0.954 -3.742 0.645 1.00 10.00 H new ATOM 0 HG13 VAL A 61 2.552 -2.960 0.684 1.00 10.00 H new ATOM 0 HG21 VAL A 61 2.643 -2.702 -2.401 1.00 10.00 H new ATOM 0 HG22 VAL A 61 4.057 -3.207 -1.446 1.00 10.00 H new ATOM 0 HG23 VAL A 61 3.464 -4.237 -2.771 1.00 10.00 H new ATOM 925 N ASP A 62 4.438 -6.415 -1.894 1.00 10.00 N ATOM 926 CA ASP A 62 5.070 -7.388 -2.782 1.00 10.00 C ATOM 927 C ASP A 62 5.052 -8.776 -2.122 1.00 10.00 C ATOM 928 O ASP A 62 4.621 -9.755 -2.728 1.00 10.00 O ATOM 929 CB ASP A 62 6.484 -6.896 -3.131 1.00 10.00 C ATOM 930 CG ASP A 62 7.068 -7.528 -4.386 1.00 10.00 C ATOM 931 OD1 ASP A 62 7.397 -8.728 -4.317 1.00 10.00 O ATOM 932 OD2 ASP A 62 7.229 -6.769 -5.373 1.00 10.00 O ATOM 0 H ASP A 62 4.987 -5.562 -1.782 1.00 10.00 H new ATOM 0 HA ASP A 62 4.520 -7.484 -3.718 1.00 10.00 H new ATOM 0 HB2 ASP A 62 6.459 -5.814 -3.259 1.00 10.00 H new ATOM 0 HB3 ASP A 62 7.147 -7.102 -2.291 1.00 10.00 H new ATOM 937 N LYS A 63 5.399 -8.830 -0.827 1.00 10.00 N ATOM 938 CA LYS A 63 5.346 -10.036 0.004 1.00 10.00 C ATOM 939 C LYS A 63 4.025 -10.813 -0.116 1.00 10.00 C ATOM 940 O LYS A 63 4.020 -12.032 0.046 1.00 10.00 O ATOM 941 CB LYS A 63 5.589 -9.682 1.485 1.00 10.00 C ATOM 942 CG LYS A 63 6.424 -10.739 2.226 1.00 10.00 C ATOM 943 CD LYS A 63 7.883 -10.298 2.418 1.00 10.00 C ATOM 944 CE LYS A 63 8.623 -10.130 1.084 1.00 10.00 C ATOM 945 NZ LYS A 63 10.045 -9.781 1.285 1.00 10.00 N ATOM 0 H LYS A 63 5.733 -8.012 -0.318 1.00 10.00 H new ATOM 0 HA LYS A 63 6.137 -10.686 -0.371 1.00 10.00 H new ATOM 0 HB2 LYS A 63 6.096 -8.719 1.544 1.00 10.00 H new ATOM 0 HB3 LYS A 63 4.629 -9.568 1.988 1.00 10.00 H new ATOM 0 HG2 LYS A 63 5.975 -10.937 3.199 1.00 10.00 H new ATOM 0 HG3 LYS A 63 6.400 -11.675 1.668 1.00 10.00 H new ATOM 0 HD2 LYS A 63 7.906 -9.355 2.964 1.00 10.00 H new ATOM 0 HD3 LYS A 63 8.405 -11.034 3.030 1.00 10.00 H new ATOM 0 HE2 LYS A 63 8.553 -11.054 0.511 1.00 10.00 H new ATOM 0 HE3 LYS A 63 8.138 -9.352 0.495 1.00 10.00 H new ATOM 0 HZ1 LYS A 63 10.498 -9.626 0.362 1.00 10.00 H new ATOM 0 HZ2 LYS A 63 10.112 -8.913 1.854 1.00 10.00 H new ATOM 0 HZ3 LYS A 63 10.526 -10.558 1.781 1.00 10.00 H new ATOM 959 N LEU A 64 2.901 -10.118 -0.319 1.00 10.00 N ATOM 960 CA LEU A 64 1.578 -10.729 -0.424 1.00 10.00 C ATOM 961 C LEU A 64 1.366 -11.391 -1.789 1.00 10.00 C ATOM 962 O LEU A 64 0.554 -12.308 -1.883 1.00 10.00 O ATOM 963 CB LEU A 64 0.487 -9.683 -0.152 1.00 10.00 C ATOM 964 CG LEU A 64 0.501 -9.199 1.307 1.00 10.00 C ATOM 965 CD1 LEU A 64 -0.062 -7.781 1.447 1.00 10.00 C ATOM 966 CD2 LEU A 64 -0.314 -10.159 2.186 1.00 10.00 C ATOM 0 H LEU A 64 2.888 -9.103 -0.416 1.00 10.00 H new ATOM 0 HA LEU A 64 1.511 -11.513 0.330 1.00 10.00 H new ATOM 0 HB2 LEU A 64 0.628 -8.831 -0.817 1.00 10.00 H new ATOM 0 HB3 LEU A 64 -0.489 -10.110 -0.383 1.00 10.00 H new ATOM 0 HG LEU A 64 1.541 -9.182 1.634 1.00 10.00 H new ATOM 0 HD11 LEU A 64 -0.033 -7.480 2.494 1.00 10.00 H new ATOM 0 HD12 LEU A 64 0.538 -7.091 0.854 1.00 10.00 H new ATOM 0 HD13 LEU A 64 -1.093 -7.762 1.092 1.00 10.00 H new ATOM 0 HD21 LEU A 64 -0.299 -9.809 3.218 1.00 10.00 H new ATOM 0 HD22 LEU A 64 -1.343 -10.193 1.829 1.00 10.00 H new ATOM 0 HD23 LEU A 64 0.121 -11.157 2.135 1.00 10.00 H new ATOM 978 N GLY A 65 2.070 -10.946 -2.837 1.00 10.00 N ATOM 979 CA GLY A 65 2.059 -11.588 -4.147 1.00 10.00 C ATOM 980 C GLY A 65 1.826 -10.580 -5.270 1.00 10.00 C ATOM 981 O GLY A 65 2.579 -10.541 -6.241 1.00 10.00 O ATOM 0 H GLY A 65 2.668 -10.121 -2.794 1.00 10.00 H new ATOM 0 HA2 GLY A 65 3.008 -12.100 -4.309 1.00 10.00 H new ATOM 0 HA3 GLY A 65 1.278 -12.348 -4.173 1.00 10.00 H new ATOM 985 N TYR A 66 0.761 -9.783 -5.155 1.00 10.00 N ATOM 986 CA TYR A 66 0.443 -8.741 -6.129 1.00 10.00 C ATOM 987 C TYR A 66 1.524 -7.659 -6.142 1.00 10.00 C ATOM 988 O TYR A 66 2.301 -7.539 -5.195 1.00 10.00 O ATOM 989 CB TYR A 66 -0.948 -8.148 -5.868 1.00 10.00 C ATOM 990 CG TYR A 66 -1.364 -8.078 -4.416 1.00 10.00 C ATOM 991 CD1 TYR A 66 -0.685 -7.226 -3.526 1.00 10.00 C ATOM 992 CD2 TYR A 66 -2.356 -8.949 -3.932 1.00 10.00 C ATOM 993 CE1 TYR A 66 -1.047 -7.199 -2.172 1.00 10.00 C ATOM 994 CE2 TYR A 66 -2.700 -8.932 -2.573 1.00 10.00 C ATOM 995 CZ TYR A 66 -2.085 -8.024 -1.704 1.00 10.00 C ATOM 996 OH TYR A 66 -2.508 -7.937 -0.413 1.00 10.00 O ATOM 0 H TYR A 66 0.096 -9.843 -4.384 1.00 10.00 H new ATOM 0 HA TYR A 66 0.422 -9.196 -7.119 1.00 10.00 H new ATOM 0 HB2 TYR A 66 -0.979 -7.142 -6.286 1.00 10.00 H new ATOM 0 HB3 TYR A 66 -1.684 -8.741 -6.411 1.00 10.00 H new ATOM 0 HD1 TYR A 66 0.114 -6.594 -3.885 1.00 10.00 H new ATOM 0 HD2 TYR A 66 -2.853 -9.631 -4.607 1.00 10.00 H new ATOM 0 HE1 TYR A 66 -0.528 -6.544 -1.488 1.00 10.00 H new ATOM 0 HE2 TYR A 66 -3.441 -9.621 -2.196 1.00 10.00 H new ATOM 0 HH TYR A 66 -3.427 -7.598 -0.392 1.00 10.00 H new ATOM 1006 N LYS A 67 1.572 -6.870 -7.220 1.00 10.00 N ATOM 1007 CA LYS A 67 2.625 -5.883 -7.424 1.00 10.00 C ATOM 1008 C LYS A 67 2.103 -4.485 -7.143 1.00 10.00 C ATOM 1009 O LYS A 67 0.902 -4.241 -7.224 1.00 10.00 O ATOM 1010 CB LYS A 67 3.184 -5.979 -8.850 1.00 10.00 C ATOM 1011 CG LYS A 67 4.590 -6.580 -8.863 1.00 10.00 C ATOM 1012 CD LYS A 67 5.651 -5.657 -8.238 1.00 10.00 C ATOM 1013 CE LYS A 67 7.062 -6.011 -8.726 1.00 10.00 C ATOM 1014 NZ LYS A 67 7.283 -5.591 -10.127 1.00 10.00 N ATOM 0 H LYS A 67 0.882 -6.901 -7.971 1.00 10.00 H new ATOM 0 HA LYS A 67 3.436 -6.092 -6.726 1.00 10.00 H new ATOM 0 HB2 LYS A 67 2.520 -6.591 -9.461 1.00 10.00 H new ATOM 0 HB3 LYS A 67 3.208 -4.987 -9.300 1.00 10.00 H new ATOM 0 HG2 LYS A 67 4.578 -7.527 -8.323 1.00 10.00 H new ATOM 0 HG3 LYS A 67 4.873 -6.803 -9.892 1.00 10.00 H new ATOM 0 HD2 LYS A 67 5.427 -4.620 -8.490 1.00 10.00 H new ATOM 0 HD3 LYS A 67 5.610 -5.737 -7.152 1.00 10.00 H new ATOM 0 HE2 LYS A 67 7.800 -5.531 -8.083 1.00 10.00 H new ATOM 0 HE3 LYS A 67 7.216 -7.087 -8.641 1.00 10.00 H new ATOM 0 HZ1 LYS A 67 8.298 -5.643 -10.349 1.00 10.00 H new ATOM 0 HZ2 LYS A 67 6.756 -6.220 -10.765 1.00 10.00 H new ATOM 0 HZ3 LYS A 67 6.951 -4.613 -10.253 1.00 10.00 H new ATOM 1028 N LEU A 68 3.032 -3.571 -6.848 1.00 10.00 N ATOM 1029 CA LEU A 68 2.773 -2.179 -6.550 1.00 10.00 C ATOM 1030 C LEU A 68 3.894 -1.357 -7.181 1.00 10.00 C ATOM 1031 O LEU A 68 4.997 -1.871 -7.388 1.00 10.00 O ATOM 1032 CB LEU A 68 2.675 -1.983 -5.028 1.00 10.00 C ATOM 1033 CG LEU A 68 2.318 -0.555 -4.574 1.00 10.00 C ATOM 1034 CD1 LEU A 68 1.341 -0.549 -3.391 1.00 10.00 C ATOM 1035 CD2 LEU A 68 3.581 0.208 -4.146 1.00 10.00 C ATOM 0 H LEU A 68 4.025 -3.802 -6.812 1.00 10.00 H new ATOM 0 HA LEU A 68 1.821 -1.847 -6.965 1.00 10.00 H new ATOM 0 HB2 LEU A 68 1.925 -2.670 -4.637 1.00 10.00 H new ATOM 0 HB3 LEU A 68 3.628 -2.262 -4.579 1.00 10.00 H new ATOM 0 HG LEU A 68 1.846 -0.072 -5.429 1.00 10.00 H new ATOM 0 HD11 LEU A 68 1.120 0.480 -3.107 1.00 10.00 H new ATOM 0 HD12 LEU A 68 0.418 -1.053 -3.679 1.00 10.00 H new ATOM 0 HD13 LEU A 68 1.790 -1.070 -2.545 1.00 10.00 H new ATOM 0 HD21 LEU A 68 3.308 1.214 -3.829 1.00 10.00 H new ATOM 0 HD22 LEU A 68 4.060 -0.316 -3.319 1.00 10.00 H new ATOM 0 HD23 LEU A 68 4.272 0.268 -4.986 1.00 10.00 H new ATOM 1047 N LYS A 69 3.596 -0.099 -7.491 1.00 10.00 N ATOM 1048 CA LYS A 69 4.482 0.876 -8.106 1.00 10.00 C ATOM 1049 C LYS A 69 3.994 2.279 -7.729 1.00 10.00 C ATOM 1050 O LYS A 69 2.879 2.417 -7.232 1.00 10.00 O ATOM 1051 CB LYS A 69 4.464 0.704 -9.633 1.00 10.00 C ATOM 1052 CG LYS A 69 3.037 0.841 -10.191 1.00 10.00 C ATOM 1053 CD LYS A 69 2.940 1.459 -11.599 1.00 10.00 C ATOM 1054 CE LYS A 69 2.664 0.425 -12.707 1.00 10.00 C ATOM 1055 NZ LYS A 69 1.498 0.797 -13.538 1.00 10.00 N ATOM 0 H LYS A 69 2.670 0.288 -7.307 1.00 10.00 H new ATOM 0 HA LYS A 69 5.503 0.732 -7.753 1.00 10.00 H new ATOM 0 HB2 LYS A 69 5.111 1.451 -10.093 1.00 10.00 H new ATOM 0 HB3 LYS A 69 4.868 -0.273 -9.896 1.00 10.00 H new ATOM 0 HG2 LYS A 69 2.576 -0.147 -10.213 1.00 10.00 H new ATOM 0 HG3 LYS A 69 2.452 1.451 -9.503 1.00 10.00 H new ATOM 0 HD2 LYS A 69 2.147 2.207 -11.605 1.00 10.00 H new ATOM 0 HD3 LYS A 69 3.871 1.980 -11.823 1.00 10.00 H new ATOM 0 HE2 LYS A 69 3.545 0.330 -13.341 1.00 10.00 H new ATOM 0 HE3 LYS A 69 2.490 -0.552 -12.255 1.00 10.00 H new ATOM 0 HZ1 LYS A 69 1.098 -0.057 -13.977 1.00 10.00 H new ATOM 0 HZ2 LYS A 69 0.777 1.250 -12.941 1.00 10.00 H new ATOM 0 HZ3 LYS A 69 1.799 1.460 -14.281 1.00 10.00 H new ATOM 1069 N LEU A 70 4.781 3.312 -8.030 1.00 10.00 N ATOM 1070 CA LEU A 70 4.388 4.703 -7.825 1.00 10.00 C ATOM 1071 C LEU A 70 3.187 5.091 -8.689 1.00 10.00 C ATOM 1072 O LEU A 70 3.001 4.552 -9.780 1.00 10.00 O ATOM 1073 CB LEU A 70 5.604 5.626 -8.013 1.00 10.00 C ATOM 1074 CG LEU A 70 5.345 7.142 -8.144 1.00 10.00 C ATOM 1075 CD1 LEU A 70 6.586 7.909 -7.670 1.00 10.00 C ATOM 1076 CD2 LEU A 70 5.069 7.569 -9.595 1.00 10.00 C ATOM 0 H LEU A 70 5.715 3.205 -8.425 1.00 10.00 H new ATOM 0 HA LEU A 70 4.047 4.826 -6.797 1.00 10.00 H new ATOM 0 HB2 LEU A 70 6.274 5.473 -7.167 1.00 10.00 H new ATOM 0 HB3 LEU A 70 6.137 5.299 -8.906 1.00 10.00 H new ATOM 0 HG LEU A 70 4.467 7.367 -7.539 1.00 10.00 H new ATOM 0 HD11 LEU A 70 6.408 8.981 -7.761 1.00 10.00 H new ATOM 0 HD12 LEU A 70 6.791 7.662 -6.628 1.00 10.00 H new ATOM 0 HD13 LEU A 70 7.442 7.630 -8.284 1.00 10.00 H new ATOM 0 HD21 LEU A 70 4.893 8.644 -9.631 1.00 10.00 H new ATOM 0 HD22 LEU A 70 5.929 7.321 -10.217 1.00 10.00 H new ATOM 0 HD23 LEU A 70 4.189 7.045 -9.967 1.00 10.00 H new ATOM 1088 N LYS A 71 2.399 6.047 -8.183 1.00 10.00 N ATOM 1089 CA LYS A 71 1.360 6.758 -8.921 1.00 10.00 C ATOM 1090 C LYS A 71 1.534 8.274 -8.807 1.00 10.00 C ATOM 1091 O LYS A 71 1.566 8.956 -9.830 1.00 10.00 O ATOM 1092 CB LYS A 71 -0.049 6.271 -8.544 1.00 10.00 C ATOM 1093 CG LYS A 71 -1.187 6.808 -9.435 1.00 10.00 C ATOM 1094 CD LYS A 71 -1.245 6.259 -10.868 1.00 10.00 C ATOM 1095 CE LYS A 71 -1.604 4.771 -10.936 1.00 10.00 C ATOM 1096 NZ LYS A 71 -2.999 4.440 -10.569 1.00 10.00 N ATOM 0 H LYS A 71 2.474 6.354 -7.213 1.00 10.00 H new ATOM 0 HA LYS A 71 1.476 6.519 -9.978 1.00 10.00 H new ATOM 0 HB2 LYS A 71 -0.062 5.182 -8.582 1.00 10.00 H new ATOM 0 HB3 LYS A 71 -0.251 6.557 -7.512 1.00 10.00 H new ATOM 0 HG2 LYS A 71 -2.136 6.590 -8.946 1.00 10.00 H new ATOM 0 HG3 LYS A 71 -1.098 7.893 -9.488 1.00 10.00 H new ATOM 0 HD2 LYS A 71 -1.979 6.829 -11.438 1.00 10.00 H new ATOM 0 HD3 LYS A 71 -0.279 6.414 -11.348 1.00 10.00 H new ATOM 0 HE2 LYS A 71 -1.418 4.415 -11.949 1.00 10.00 H new ATOM 0 HE3 LYS A 71 -0.932 4.221 -10.277 1.00 10.00 H new ATOM 0 HZ1 LYS A 71 -3.199 3.451 -10.821 1.00 10.00 H new ATOM 0 HZ2 LYS A 71 -3.129 4.569 -9.545 1.00 10.00 H new ATOM 0 HZ3 LYS A 71 -3.651 5.067 -11.082 1.00 10.00 H new