USER MOD reduce.3.24.130724 H: found=0, std=0, add=371, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 369 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 12 CYS SG : rot -87:sc= -0.104 USER MOD Set 1.2: A 30 CYS SG : rot 72:sc= -2.35 USER MOD Single : A 1 ASP N :NH3+ -142:sc= 0.224 (180deg=0) USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 TYR OH : rot 180:sc= -0.969 USER MOD Single : A 11 THR OG1 : rot 89:sc= 1.19 USER MOD Single : A 13 HIS : no HD1:sc= -1.99 K(o=-2,f=-4!) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 ASN : amide:sc= -2.79 K(o=-2.8,f=-6.1!) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 ASN : amide:sc= -0.261 K(o=-0.26,f=-2!) USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.185) USER MOD Single : A 50 ASN : amide:sc= -0.589 X(o=-0.59,f=-0.34) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 1 1.322 0.037 0.017 1.00 10.00 N ATOM 2 CA ASP A 1 2.124 0.046 -1.214 1.00 10.00 C ATOM 3 C ASP A 1 2.181 -1.373 -1.724 1.00 10.00 C ATOM 4 O ASP A 1 1.475 -2.202 -1.167 1.00 10.00 O ATOM 5 CB ASP A 1 3.541 0.585 -0.957 1.00 10.00 C ATOM 6 CG ASP A 1 3.903 1.553 -2.073 1.00 10.00 C ATOM 7 OD1 ASP A 1 3.035 2.410 -2.323 1.00 10.00 O ATOM 8 OD2 ASP A 1 4.914 1.307 -2.759 1.00 10.00 O ATOM 0 H1 ASP A 1 0.734 0.894 0.055 1.00 10.00 H new ATOM 0 H2 ASP A 1 0.710 -0.804 0.026 1.00 10.00 H new ATOM 0 H3 ASP A 1 1.954 0.014 0.843 1.00 10.00 H new ATOM 0 HA ASP A 1 1.667 0.705 -1.952 1.00 10.00 H new ATOM 0 HB2 ASP A 1 3.585 1.088 0.009 1.00 10.00 H new ATOM 0 HB3 ASP A 1 4.257 -0.236 -0.921 1.00 10.00 H new ATOM 15 N GLU A 2 3.031 -1.632 -2.712 1.00 10.00 N ATOM 16 CA GLU A 2 3.292 -2.948 -3.298 1.00 10.00 C ATOM 17 C GLU A 2 4.156 -2.801 -4.546 1.00 10.00 C ATOM 18 O GLU A 2 4.947 -3.677 -4.864 1.00 10.00 O ATOM 19 CB GLU A 2 1.982 -3.665 -3.670 1.00 10.00 C ATOM 20 CG GLU A 2 1.789 -4.908 -2.797 1.00 10.00 C ATOM 21 CD GLU A 2 0.411 -5.518 -3.058 1.00 10.00 C ATOM 22 OE1 GLU A 2 -0.554 -5.098 -2.381 1.00 10.00 O ATOM 23 OE2 GLU A 2 0.338 -6.361 -3.980 1.00 10.00 O ATOM 0 H GLU A 2 3.585 -0.896 -3.149 1.00 10.00 H new ATOM 0 HA GLU A 2 3.815 -3.546 -2.552 1.00 10.00 H new ATOM 0 HB2 GLU A 2 1.139 -2.987 -3.540 1.00 10.00 H new ATOM 0 HB3 GLU A 2 2.002 -3.951 -4.722 1.00 10.00 H new ATOM 0 HG2 GLU A 2 2.567 -5.640 -3.014 1.00 10.00 H new ATOM 0 HG3 GLU A 2 1.885 -4.642 -1.744 1.00 10.00 H new ATOM 30 N ALA A 3 4.057 -1.662 -5.233 1.00 10.00 N ATOM 31 CA ALA A 3 4.830 -1.381 -6.433 1.00 10.00 C ATOM 32 C ALA A 3 6.326 -1.336 -6.149 1.00 10.00 C ATOM 33 O ALA A 3 7.078 -2.018 -6.828 1.00 10.00 O ATOM 34 CB ALA A 3 4.390 -0.057 -7.047 1.00 10.00 C ATOM 0 H ALA A 3 3.430 -0.904 -4.965 1.00 10.00 H new ATOM 0 HA ALA A 3 4.643 -2.194 -7.135 1.00 10.00 H new ATOM 0 HB1 ALA A 3 4.977 0.141 -7.944 1.00 10.00 H new ATOM 0 HB2 ALA A 3 3.333 -0.111 -7.309 1.00 10.00 H new ATOM 0 HB3 ALA A 3 4.545 0.747 -6.328 1.00 10.00 H new ATOM 40 N GLN A 4 6.752 -0.620 -5.103 1.00 10.00 N ATOM 41 CA GLN A 4 8.152 -0.598 -4.666 1.00 10.00 C ATOM 42 C GLN A 4 8.798 -1.994 -4.578 1.00 10.00 C ATOM 43 O GLN A 4 9.986 -2.149 -4.847 1.00 10.00 O ATOM 44 CB GLN A 4 8.226 0.095 -3.296 1.00 10.00 C ATOM 45 CG GLN A 4 8.377 1.610 -3.440 1.00 10.00 C ATOM 46 CD GLN A 4 8.181 2.363 -2.127 1.00 10.00 C ATOM 47 OE1 GLN A 4 7.495 1.977 -1.195 1.00 10.00 O ATOM 48 NE2 GLN A 4 8.860 3.473 -1.969 1.00 10.00 N ATOM 0 H GLN A 4 6.135 -0.039 -4.535 1.00 10.00 H new ATOM 0 HA GLN A 4 8.717 -0.052 -5.421 1.00 10.00 H new ATOM 0 HB2 GLN A 4 7.325 -0.129 -2.725 1.00 10.00 H new ATOM 0 HB3 GLN A 4 9.069 -0.303 -2.731 1.00 10.00 H new ATOM 0 HG2 GLN A 4 9.368 1.834 -3.835 1.00 10.00 H new ATOM 0 HG3 GLN A 4 7.654 1.973 -4.170 1.00 10.00 H new ATOM 0 HE21 GLN A 4 9.444 3.826 -2.727 1.00 10.00 H new ATOM 0 HE22 GLN A 4 8.804 3.984 -1.088 1.00 10.00 H new ATOM 57 N PHE A 5 8.002 -3.007 -4.226 1.00 10.00 N ATOM 58 CA PHE A 5 8.386 -4.414 -4.186 1.00 10.00 C ATOM 59 C PHE A 5 8.177 -5.049 -5.566 1.00 10.00 C ATOM 60 O PHE A 5 9.051 -5.780 -6.001 1.00 10.00 O ATOM 61 CB PHE A 5 7.444 -5.088 -3.214 1.00 10.00 C ATOM 62 CG PHE A 5 7.889 -6.471 -2.900 1.00 10.00 C ATOM 63 CD1 PHE A 5 7.615 -7.539 -3.776 1.00 10.00 C ATOM 64 CD2 PHE A 5 8.594 -6.679 -1.714 1.00 10.00 C ATOM 65 CE1 PHE A 5 8.049 -8.829 -3.447 1.00 10.00 C ATOM 66 CE2 PHE A 5 8.995 -7.974 -1.381 1.00 10.00 C ATOM 67 CZ PHE A 5 8.757 -9.046 -2.255 1.00 10.00 C ATOM 0 H PHE A 5 7.031 -2.859 -3.950 1.00 10.00 H new ATOM 0 HA PHE A 5 9.431 -4.521 -3.895 1.00 10.00 H new ATOM 0 HB2 PHE A 5 7.388 -4.505 -2.295 1.00 10.00 H new ATOM 0 HB3 PHE A 5 6.440 -5.114 -3.637 1.00 10.00 H new ATOM 0 HD1 PHE A 5 7.074 -7.364 -4.694 1.00 10.00 H new ATOM 0 HD2 PHE A 5 8.826 -5.849 -1.063 1.00 10.00 H new ATOM 0 HE1 PHE A 5 7.839 -9.656 -4.110 1.00 10.00 H new ATOM 0 HE2 PHE A 5 9.494 -8.153 -0.440 1.00 10.00 H new ATOM 0 HZ PHE A 5 9.117 -10.034 -2.011 1.00 10.00 H new ATOM 77 N LYS A 6 7.055 -4.820 -6.268 1.00 10.00 N ATOM 78 CA LYS A 6 6.797 -5.338 -7.623 1.00 10.00 C ATOM 79 C LYS A 6 7.905 -4.952 -8.591 1.00 10.00 C ATOM 80 O LYS A 6 8.224 -5.740 -9.464 1.00 10.00 O ATOM 81 CB LYS A 6 5.426 -4.876 -8.138 1.00 10.00 C ATOM 82 CG LYS A 6 5.063 -5.557 -9.468 1.00 10.00 C ATOM 83 CD LYS A 6 3.567 -5.421 -9.767 1.00 10.00 C ATOM 84 CE LYS A 6 3.327 -5.408 -11.279 1.00 10.00 C ATOM 85 NZ LYS A 6 1.897 -5.157 -11.575 1.00 10.00 N ATOM 0 H LYS A 6 6.286 -4.258 -5.903 1.00 10.00 H new ATOM 0 HA LYS A 6 6.784 -6.426 -7.560 1.00 10.00 H new ATOM 0 HB2 LYS A 6 4.662 -5.100 -7.393 1.00 10.00 H new ATOM 0 HB3 LYS A 6 5.433 -3.794 -8.272 1.00 10.00 H new ATOM 0 HG2 LYS A 6 5.641 -5.111 -10.278 1.00 10.00 H new ATOM 0 HG3 LYS A 6 5.334 -6.612 -9.426 1.00 10.00 H new ATOM 0 HD2 LYS A 6 3.022 -6.248 -9.312 1.00 10.00 H new ATOM 0 HD3 LYS A 6 3.182 -4.503 -9.323 1.00 10.00 H new ATOM 0 HE2 LYS A 6 3.942 -4.637 -11.744 1.00 10.00 H new ATOM 0 HE3 LYS A 6 3.632 -6.362 -11.710 1.00 10.00 H new ATOM 0 HZ1 LYS A 6 1.751 -5.151 -12.605 1.00 10.00 H new ATOM 0 HZ2 LYS A 6 1.317 -5.907 -11.147 1.00 10.00 H new ATOM 0 HZ3 LYS A 6 1.617 -4.236 -11.181 1.00 10.00 H new ATOM 99 N GLU A 7 8.562 -3.829 -8.347 1.00 10.00 N ATOM 100 CA GLU A 7 9.709 -3.409 -9.110 1.00 10.00 C ATOM 101 C GLU A 7 10.938 -4.195 -8.711 1.00 10.00 C ATOM 102 O GLU A 7 11.683 -4.617 -9.572 1.00 10.00 O ATOM 103 CB GLU A 7 9.967 -1.904 -8.952 1.00 10.00 C ATOM 104 CG GLU A 7 9.891 -1.196 -10.306 1.00 10.00 C ATOM 105 CD GLU A 7 8.453 -0.738 -10.578 1.00 10.00 C ATOM 106 OE1 GLU A 7 8.102 0.359 -10.090 1.00 10.00 O ATOM 107 OE2 GLU A 7 7.692 -1.502 -11.213 1.00 10.00 O ATOM 0 H GLU A 7 8.304 -3.181 -7.603 1.00 10.00 H new ATOM 0 HA GLU A 7 9.493 -3.607 -10.160 1.00 10.00 H new ATOM 0 HB2 GLU A 7 9.234 -1.474 -8.270 1.00 10.00 H new ATOM 0 HB3 GLU A 7 10.949 -1.743 -8.507 1.00 10.00 H new ATOM 0 HG2 GLU A 7 10.563 -0.338 -10.315 1.00 10.00 H new ATOM 0 HG3 GLU A 7 10.223 -1.869 -11.097 1.00 10.00 H new ATOM 114 N CYS A 8 11.141 -4.472 -7.429 1.00 10.00 N ATOM 115 CA CYS A 8 12.250 -5.271 -6.960 1.00 10.00 C ATOM 116 C CYS A 8 12.077 -6.698 -7.414 1.00 10.00 C ATOM 117 O CYS A 8 13.013 -7.264 -7.898 1.00 10.00 O ATOM 118 CB CYS A 8 12.331 -5.225 -5.441 1.00 10.00 C ATOM 119 SG CYS A 8 14.009 -5.268 -4.768 1.00 10.00 S ATOM 0 H CYS A 8 10.529 -4.141 -6.683 1.00 10.00 H new ATOM 0 HA CYS A 8 13.173 -4.866 -7.375 1.00 10.00 H new ATOM 0 HB2 CYS A 8 11.838 -4.317 -5.092 1.00 10.00 H new ATOM 0 HB3 CYS A 8 11.771 -6.068 -5.036 1.00 10.00 H new ATOM 124 N TYR A 9 10.904 -7.294 -7.337 1.00 10.00 N ATOM 125 CA TYR A 9 10.623 -8.642 -7.800 1.00 10.00 C ATOM 126 C TYR A 9 10.845 -8.796 -9.297 1.00 10.00 C ATOM 127 O TYR A 9 11.581 -9.683 -9.722 1.00 10.00 O ATOM 128 CB TYR A 9 9.165 -8.935 -7.466 1.00 10.00 C ATOM 129 CG TYR A 9 8.825 -10.397 -7.502 1.00 10.00 C ATOM 130 CD1 TYR A 9 8.487 -11.028 -8.714 1.00 10.00 C ATOM 131 CD2 TYR A 9 8.819 -11.113 -6.300 1.00 10.00 C ATOM 132 CE1 TYR A 9 8.126 -12.386 -8.714 1.00 10.00 C ATOM 133 CE2 TYR A 9 8.427 -12.446 -6.302 1.00 10.00 C ATOM 134 CZ TYR A 9 8.102 -13.090 -7.487 1.00 10.00 C ATOM 135 OH TYR A 9 7.821 -14.399 -7.381 1.00 10.00 O ATOM 0 H TYR A 9 10.087 -6.836 -6.934 1.00 10.00 H new ATOM 0 HA TYR A 9 11.302 -9.340 -7.309 1.00 10.00 H new ATOM 0 HB2 TYR A 9 8.942 -8.542 -6.474 1.00 10.00 H new ATOM 0 HB3 TYR A 9 8.525 -8.404 -8.171 1.00 10.00 H new ATOM 0 HD1 TYR A 9 8.505 -10.471 -9.639 1.00 10.00 H new ATOM 0 HD2 TYR A 9 9.116 -10.634 -5.379 1.00 10.00 H new ATOM 0 HE1 TYR A 9 7.871 -12.885 -9.637 1.00 10.00 H new ATOM 0 HE2 TYR A 9 8.375 -12.988 -5.369 1.00 10.00 H new ATOM 0 HH TYR A 9 7.864 -14.668 -6.440 1.00 10.00 H new ATOM 145 N ASP A 10 10.230 -7.921 -10.096 1.00 10.00 N ATOM 146 CA ASP A 10 10.354 -7.922 -11.556 1.00 10.00 C ATOM 147 C ASP A 10 11.810 -7.696 -11.969 1.00 10.00 C ATOM 148 O ASP A 10 12.441 -8.499 -12.663 1.00 10.00 O ATOM 149 CB ASP A 10 9.471 -6.815 -12.156 1.00 10.00 C ATOM 150 CG ASP A 10 9.017 -7.157 -13.568 1.00 10.00 C ATOM 151 OD1 ASP A 10 8.180 -8.081 -13.670 1.00 10.00 O ATOM 152 OD2 ASP A 10 9.514 -6.523 -14.519 1.00 10.00 O ATOM 0 H ASP A 10 9.623 -7.181 -9.742 1.00 10.00 H new ATOM 0 HA ASP A 10 10.027 -8.892 -11.932 1.00 10.00 H new ATOM 0 HB2 ASP A 10 8.599 -6.662 -11.521 1.00 10.00 H new ATOM 0 HB3 ASP A 10 10.024 -5.876 -12.170 1.00 10.00 H new ATOM 157 N THR A 11 12.391 -6.620 -11.443 1.00 10.00 N ATOM 158 CA THR A 11 13.770 -6.218 -11.715 1.00 10.00 C ATOM 159 C THR A 11 14.752 -7.255 -11.189 1.00 10.00 C ATOM 160 O THR A 11 15.662 -7.660 -11.904 1.00 10.00 O ATOM 161 CB THR A 11 14.082 -4.854 -11.099 1.00 10.00 C ATOM 162 OG1 THR A 11 13.182 -3.909 -11.611 1.00 10.00 O ATOM 163 CG2 THR A 11 15.449 -4.307 -11.450 1.00 10.00 C ATOM 0 H THR A 11 11.907 -5.990 -10.803 1.00 10.00 H new ATOM 0 HA THR A 11 13.879 -6.144 -12.797 1.00 10.00 H new ATOM 0 HB THR A 11 14.021 -5.008 -10.022 1.00 10.00 H new ATOM 0 HG1 THR A 11 12.383 -3.878 -11.045 1.00 10.00 H new ATOM 0 HG21 THR A 11 15.587 -3.337 -10.972 1.00 10.00 H new ATOM 0 HG22 THR A 11 16.217 -4.996 -11.100 1.00 10.00 H new ATOM 0 HG23 THR A 11 15.529 -4.193 -12.531 1.00 10.00 H new ATOM 171 N CYS A 12 14.549 -7.764 -9.978 1.00 10.00 N ATOM 172 CA CYS A 12 15.334 -8.850 -9.409 1.00 10.00 C ATOM 173 C CYS A 12 15.272 -10.027 -10.356 1.00 10.00 C ATOM 174 O CYS A 12 16.320 -10.514 -10.733 1.00 10.00 O ATOM 175 CB CYS A 12 14.880 -9.253 -8.003 1.00 10.00 C ATOM 176 SG CYS A 12 15.893 -10.510 -7.209 1.00 10.00 S ATOM 0 H CYS A 12 13.818 -7.425 -9.353 1.00 10.00 H new ATOM 0 HA CYS A 12 16.361 -8.504 -9.293 1.00 10.00 H new ATOM 0 HB2 CYS A 12 14.869 -8.364 -7.372 1.00 10.00 H new ATOM 0 HB3 CYS A 12 13.854 -9.616 -8.059 1.00 10.00 H new ATOM 0 HG CYS A 12 15.470 -11.690 -7.554 1.00 10.00 H new ATOM 181 N HIS A 13 14.093 -10.408 -10.869 1.00 10.00 N ATOM 182 CA HIS A 13 13.938 -11.484 -11.844 1.00 10.00 C ATOM 183 C HIS A 13 14.806 -11.281 -13.070 1.00 10.00 C ATOM 184 O HIS A 13 15.329 -12.258 -13.602 1.00 10.00 O ATOM 185 CB HIS A 13 12.481 -11.631 -12.269 1.00 10.00 C ATOM 186 CG HIS A 13 12.147 -13.045 -12.633 1.00 10.00 C ATOM 187 ND1 HIS A 13 12.385 -13.621 -13.858 1.00 10.00 N ATOM 188 CD2 HIS A 13 11.568 -13.973 -11.812 1.00 10.00 C ATOM 189 CE1 HIS A 13 11.957 -14.890 -13.788 1.00 10.00 C ATOM 190 NE2 HIS A 13 11.445 -15.128 -12.560 1.00 10.00 N ATOM 0 H HIS A 13 13.210 -9.967 -10.611 1.00 10.00 H new ATOM 0 HA HIS A 13 14.265 -12.398 -11.348 1.00 10.00 H new ATOM 0 HB2 HIS A 13 11.831 -11.301 -11.458 1.00 10.00 H new ATOM 0 HB3 HIS A 13 12.284 -10.980 -13.121 1.00 10.00 H new ATOM 0 HD2 HIS A 13 11.267 -13.831 -10.784 1.00 10.00 H new ATOM 0 HE1 HIS A 13 12.013 -15.611 -14.590 1.00 10.00 H new ATOM 0 HE2 HIS A 13 11.038 -16.007 -12.241 1.00 10.00 H new ATOM 199 N LYS A 14 14.928 -10.044 -13.552 1.00 10.00 N ATOM 200 CA LYS A 14 15.835 -9.688 -14.643 1.00 10.00 C ATOM 201 C LYS A 14 17.281 -10.073 -14.330 1.00 10.00 C ATOM 202 O LYS A 14 17.842 -10.885 -15.056 1.00 10.00 O ATOM 203 CB LYS A 14 15.694 -8.204 -14.981 1.00 10.00 C ATOM 204 CG LYS A 14 16.477 -7.836 -16.244 1.00 10.00 C ATOM 205 CD LYS A 14 17.753 -7.048 -15.904 1.00 10.00 C ATOM 206 CE LYS A 14 18.100 -6.091 -17.042 1.00 10.00 C ATOM 207 NZ LYS A 14 19.504 -6.267 -17.475 1.00 10.00 N ATOM 0 H LYS A 14 14.394 -9.253 -13.192 1.00 10.00 H new ATOM 0 HA LYS A 14 15.553 -10.263 -15.525 1.00 10.00 H new ATOM 0 HB2 LYS A 14 14.641 -7.961 -15.122 1.00 10.00 H new ATOM 0 HB3 LYS A 14 16.051 -7.604 -14.144 1.00 10.00 H new ATOM 0 HG2 LYS A 14 16.742 -8.743 -16.787 1.00 10.00 H new ATOM 0 HG3 LYS A 14 15.846 -7.242 -16.905 1.00 10.00 H new ATOM 0 HD2 LYS A 14 17.608 -6.489 -14.980 1.00 10.00 H new ATOM 0 HD3 LYS A 14 18.580 -7.737 -15.733 1.00 10.00 H new ATOM 0 HE2 LYS A 14 17.431 -6.265 -17.885 1.00 10.00 H new ATOM 0 HE3 LYS A 14 17.942 -5.062 -16.718 1.00 10.00 H new ATOM 0 HZ1 LYS A 14 19.714 -5.605 -18.249 1.00 10.00 H new ATOM 0 HZ2 LYS A 14 20.140 -6.077 -16.675 1.00 10.00 H new ATOM 0 HZ3 LYS A 14 19.646 -7.243 -17.806 1.00 10.00 H new ATOM 221 N GLU A 15 17.864 -9.515 -13.271 1.00 10.00 N ATOM 222 CA GLU A 15 19.201 -9.911 -12.786 1.00 10.00 C ATOM 223 C GLU A 15 19.217 -11.355 -12.233 1.00 10.00 C ATOM 224 O GLU A 15 20.252 -11.961 -11.993 1.00 10.00 O ATOM 225 CB GLU A 15 19.678 -8.894 -11.736 1.00 10.00 C ATOM 226 CG GLU A 15 21.076 -9.241 -11.209 1.00 10.00 C ATOM 227 CD GLU A 15 21.627 -8.149 -10.299 1.00 10.00 C ATOM 228 OE1 GLU A 15 21.244 -8.155 -9.108 1.00 10.00 O ATOM 229 OE2 GLU A 15 22.400 -7.305 -10.807 1.00 10.00 O ATOM 0 H GLU A 15 17.430 -8.775 -12.719 1.00 10.00 H new ATOM 0 HA GLU A 15 19.893 -9.906 -13.628 1.00 10.00 H new ATOM 0 HB2 GLU A 15 19.691 -7.896 -12.175 1.00 10.00 H new ATOM 0 HB3 GLU A 15 18.972 -8.868 -10.906 1.00 10.00 H new ATOM 0 HG2 GLU A 15 21.034 -10.183 -10.662 1.00 10.00 H new ATOM 0 HG3 GLU A 15 21.754 -9.390 -12.049 1.00 10.00 H new ATOM 236 N CYS A 16 18.056 -11.976 -12.064 1.00 10.00 N ATOM 237 CA CYS A 16 17.939 -13.303 -11.525 1.00 10.00 C ATOM 238 C CYS A 16 18.158 -14.294 -12.639 1.00 10.00 C ATOM 239 O CYS A 16 19.092 -15.061 -12.549 1.00 10.00 O ATOM 240 CB CYS A 16 16.594 -13.547 -10.871 1.00 10.00 C ATOM 241 SG CYS A 16 16.495 -15.109 -9.998 1.00 10.00 S ATOM 0 H CYS A 16 17.160 -11.554 -12.306 1.00 10.00 H new ATOM 0 HA CYS A 16 18.693 -13.422 -10.747 1.00 10.00 H new ATOM 0 HB2 CYS A 16 16.386 -12.736 -10.173 1.00 10.00 H new ATOM 0 HB3 CYS A 16 15.817 -13.517 -11.635 1.00 10.00 H new ATOM 246 N SER A 17 17.303 -14.299 -13.663 1.00 10.00 N ATOM 247 CA SER A 17 17.448 -15.135 -14.851 1.00 10.00 C ATOM 248 C SER A 17 18.836 -14.993 -15.476 1.00 10.00 C ATOM 249 O SER A 17 19.286 -15.928 -16.120 1.00 10.00 O ATOM 250 CB SER A 17 16.402 -14.763 -15.904 1.00 10.00 C ATOM 251 OG SER A 17 15.666 -15.887 -16.356 1.00 10.00 O ATOM 0 H SER A 17 16.472 -13.708 -13.688 1.00 10.00 H new ATOM 0 HA SER A 17 17.306 -16.167 -14.529 1.00 10.00 H new ATOM 0 HB2 SER A 17 15.715 -14.027 -15.486 1.00 10.00 H new ATOM 0 HB3 SER A 17 16.897 -14.291 -16.753 1.00 10.00 H new ATOM 0 HG SER A 17 15.010 -15.601 -17.025 1.00 10.00 H new ATOM 257 N ASP A 18 19.513 -13.850 -15.290 1.00 10.00 N ATOM 258 CA ASP A 18 20.923 -13.642 -15.658 1.00 10.00 C ATOM 259 C ASP A 18 21.838 -14.741 -15.112 1.00 10.00 C ATOM 260 O ASP A 18 22.721 -15.218 -15.820 1.00 10.00 O ATOM 261 CB ASP A 18 21.416 -12.285 -15.145 1.00 10.00 C ATOM 262 CG ASP A 18 22.946 -12.199 -15.047 1.00 10.00 C ATOM 263 OD1 ASP A 18 23.571 -12.007 -16.114 1.00 10.00 O ATOM 264 OD2 ASP A 18 23.462 -12.314 -13.913 1.00 10.00 O ATOM 0 H ASP A 18 19.086 -13.025 -14.870 1.00 10.00 H new ATOM 0 HA ASP A 18 20.967 -13.673 -16.747 1.00 10.00 H new ATOM 0 HB2 ASP A 18 21.055 -11.499 -15.809 1.00 10.00 H new ATOM 0 HB3 ASP A 18 20.984 -12.096 -14.163 1.00 10.00 H new ATOM 269 N LYS A 19 21.577 -15.238 -13.896 1.00 10.00 N ATOM 270 CA LYS A 19 22.288 -16.357 -13.313 1.00 10.00 C ATOM 271 C LYS A 19 22.190 -17.623 -14.155 1.00 10.00 C ATOM 272 O LYS A 19 22.882 -18.593 -13.856 1.00 10.00 O ATOM 273 CB LYS A 19 21.813 -16.573 -11.866 1.00 10.00 C ATOM 274 CG LYS A 19 22.856 -16.101 -10.851 1.00 10.00 C ATOM 275 CD LYS A 19 23.448 -17.276 -10.069 1.00 10.00 C ATOM 276 CE LYS A 19 22.909 -17.274 -8.639 1.00 10.00 C ATOM 277 NZ LYS A 19 23.353 -18.495 -7.923 1.00 10.00 N ATOM 0 H LYS A 19 20.851 -14.859 -13.288 1.00 10.00 H new ATOM 0 HA LYS A 19 23.350 -16.113 -13.295 1.00 10.00 H new ATOM 0 HB2 LYS A 19 20.879 -16.034 -11.705 1.00 10.00 H new ATOM 0 HB3 LYS A 19 21.602 -17.630 -11.706 1.00 10.00 H new ATOM 0 HG2 LYS A 19 23.654 -15.568 -11.368 1.00 10.00 H new ATOM 0 HG3 LYS A 19 22.398 -15.395 -10.158 1.00 10.00 H new ATOM 0 HD2 LYS A 19 23.195 -18.215 -10.561 1.00 10.00 H new ATOM 0 HD3 LYS A 19 24.536 -17.205 -10.057 1.00 10.00 H new ATOM 0 HE2 LYS A 19 23.259 -16.387 -8.112 1.00 10.00 H new ATOM 0 HE3 LYS A 19 21.820 -17.227 -8.653 1.00 10.00 H new ATOM 0 HZ1 LYS A 19 22.981 -18.483 -6.952 1.00 10.00 H new ATOM 0 HZ2 LYS A 19 22.998 -19.337 -8.419 1.00 10.00 H new ATOM 0 HZ3 LYS A 19 24.392 -18.522 -7.895 1.00 10.00 H new ATOM 291 N GLY A 20 21.290 -17.644 -15.132 1.00 10.00 N ATOM 292 CA GLY A 20 21.014 -18.736 -16.047 1.00 10.00 C ATOM 293 C GLY A 20 20.089 -19.774 -15.425 1.00 10.00 C ATOM 294 O GLY A 20 19.924 -20.870 -15.954 1.00 10.00 O ATOM 0 H GLY A 20 20.693 -16.838 -15.315 1.00 10.00 H new ATOM 0 HA2 GLY A 20 20.560 -18.342 -16.956 1.00 10.00 H new ATOM 0 HA3 GLY A 20 21.950 -19.212 -16.339 1.00 10.00 H new ATOM 298 N ASN A 21 19.549 -19.474 -14.243 1.00 10.00 N ATOM 299 CA ASN A 21 18.570 -20.292 -13.560 1.00 10.00 C ATOM 300 C ASN A 21 17.210 -20.274 -14.279 1.00 10.00 C ATOM 301 O ASN A 21 16.981 -19.577 -15.264 1.00 10.00 O ATOM 302 CB ASN A 21 18.453 -19.834 -12.092 1.00 10.00 C ATOM 303 CG ASN A 21 18.293 -18.346 -11.926 1.00 10.00 C ATOM 304 OD1 ASN A 21 18.065 -17.612 -12.853 1.00 10.00 O ATOM 305 ND2 ASN A 21 18.403 -17.855 -10.715 1.00 10.00 N ATOM 0 H ASN A 21 19.794 -18.629 -13.727 1.00 10.00 H new ATOM 0 HA ASN A 21 18.906 -21.329 -13.575 1.00 10.00 H new ATOM 0 HB2 ASN A 21 17.600 -20.334 -11.633 1.00 10.00 H new ATOM 0 HB3 ASN A 21 19.342 -20.156 -11.550 1.00 10.00 H new ATOM 0 HD21 ASN A 21 18.295 -16.853 -10.559 1.00 10.00 H new ATOM 0 HD22 ASN A 21 18.596 -18.475 -9.929 1.00 10.00 H new ATOM 312 N GLY A 22 16.273 -21.045 -13.730 1.00 10.00 N ATOM 313 CA GLY A 22 14.910 -21.079 -14.231 1.00 10.00 C ATOM 314 C GLY A 22 14.078 -19.934 -13.684 1.00 10.00 C ATOM 315 O GLY A 22 14.307 -19.461 -12.574 1.00 10.00 O ATOM 0 H GLY A 22 16.440 -21.657 -12.932 1.00 10.00 H new ATOM 0 HA2 GLY A 22 14.922 -21.031 -15.320 1.00 10.00 H new ATOM 0 HA3 GLY A 22 14.447 -22.027 -13.959 1.00 10.00 H new ATOM 319 N PHE A 23 13.014 -19.595 -14.413 1.00 10.00 N ATOM 320 CA PHE A 23 12.088 -18.531 -14.048 1.00 10.00 C ATOM 321 C PHE A 23 11.441 -18.793 -12.698 1.00 10.00 C ATOM 322 O PHE A 23 11.491 -17.933 -11.833 1.00 10.00 O ATOM 323 CB PHE A 23 10.995 -18.430 -15.117 1.00 10.00 C ATOM 324 CG PHE A 23 10.105 -17.207 -15.008 1.00 10.00 C ATOM 325 CD1 PHE A 23 9.295 -16.973 -13.873 1.00 10.00 C ATOM 326 CD2 PHE A 23 10.101 -16.272 -16.059 1.00 10.00 C ATOM 327 CE1 PHE A 23 8.522 -15.807 -13.781 1.00 10.00 C ATOM 328 CE2 PHE A 23 9.323 -15.105 -15.965 1.00 10.00 C ATOM 329 CZ PHE A 23 8.539 -14.871 -14.823 1.00 10.00 C ATOM 0 H PHE A 23 12.771 -20.062 -15.287 1.00 10.00 H new ATOM 0 HA PHE A 23 12.649 -17.599 -13.981 1.00 10.00 H new ATOM 0 HB2 PHE A 23 11.467 -18.431 -16.099 1.00 10.00 H new ATOM 0 HB3 PHE A 23 10.370 -19.322 -15.062 1.00 10.00 H new ATOM 0 HD1 PHE A 23 9.272 -17.697 -13.072 1.00 10.00 H new ATOM 0 HD2 PHE A 23 10.698 -16.451 -16.941 1.00 10.00 H new ATOM 0 HE1 PHE A 23 7.913 -15.630 -12.907 1.00 10.00 H new ATOM 0 HE2 PHE A 23 9.328 -14.387 -16.772 1.00 10.00 H new ATOM 0 HZ PHE A 23 7.949 -13.969 -14.748 1.00 10.00 H new ATOM 339 N THR A 24 10.781 -19.941 -12.553 1.00 10.00 N ATOM 340 CA THR A 24 10.085 -20.361 -11.331 1.00 10.00 C ATOM 341 C THR A 24 10.991 -20.246 -10.114 1.00 10.00 C ATOM 342 O THR A 24 10.697 -19.525 -9.173 1.00 10.00 O ATOM 343 CB THR A 24 9.572 -21.801 -11.490 1.00 10.00 C ATOM 344 OG1 THR A 24 8.229 -21.775 -11.887 1.00 10.00 O ATOM 345 CG2 THR A 24 9.624 -22.644 -10.214 1.00 10.00 C ATOM 0 H THR A 24 10.712 -20.628 -13.304 1.00 10.00 H new ATOM 0 HA THR A 24 9.235 -19.697 -11.174 1.00 10.00 H new ATOM 0 HB THR A 24 10.236 -22.256 -12.225 1.00 10.00 H new ATOM 0 HG1 THR A 24 7.901 -22.693 -11.991 1.00 10.00 H new ATOM 0 HG21 THR A 24 9.243 -23.644 -10.423 1.00 10.00 H new ATOM 0 HG22 THR A 24 10.655 -22.714 -9.866 1.00 10.00 H new ATOM 0 HG23 THR A 24 9.012 -22.176 -9.443 1.00 10.00 H new ATOM 353 N PHE A 25 12.129 -20.932 -10.135 1.00 10.00 N ATOM 354 CA PHE A 25 13.103 -20.864 -9.061 1.00 10.00 C ATOM 355 C PHE A 25 13.535 -19.424 -8.817 1.00 10.00 C ATOM 356 O PHE A 25 13.721 -19.027 -7.674 1.00 10.00 O ATOM 357 CB PHE A 25 14.307 -21.704 -9.474 1.00 10.00 C ATOM 358 CG PHE A 25 15.524 -21.478 -8.606 1.00 10.00 C ATOM 359 CD1 PHE A 25 15.636 -22.136 -7.371 1.00 10.00 C ATOM 360 CD2 PHE A 25 16.520 -20.569 -9.009 1.00 10.00 C ATOM 361 CE1 PHE A 25 16.762 -21.918 -6.560 1.00 10.00 C ATOM 362 CE2 PHE A 25 17.654 -20.360 -8.206 1.00 10.00 C ATOM 363 CZ PHE A 25 17.775 -21.039 -6.981 1.00 10.00 C ATOM 0 H PHE A 25 12.399 -21.550 -10.900 1.00 10.00 H new ATOM 0 HA PHE A 25 12.666 -21.242 -8.137 1.00 10.00 H new ATOM 0 HB2 PHE A 25 14.034 -22.759 -9.437 1.00 10.00 H new ATOM 0 HB3 PHE A 25 14.561 -21.477 -10.509 1.00 10.00 H new ATOM 0 HD1 PHE A 25 14.857 -22.809 -7.045 1.00 10.00 H new ATOM 0 HD2 PHE A 25 16.412 -20.030 -9.939 1.00 10.00 H new ATOM 0 HE1 PHE A 25 16.850 -22.427 -5.611 1.00 10.00 H new ATOM 0 HE2 PHE A 25 18.429 -19.681 -8.528 1.00 10.00 H new ATOM 0 HZ PHE A 25 18.647 -20.885 -6.363 1.00 10.00 H new ATOM 373 N CYS A 26 13.684 -18.645 -9.889 1.00 10.00 N ATOM 374 CA CYS A 26 13.981 -17.249 -9.793 1.00 10.00 C ATOM 375 C CYS A 26 12.891 -16.498 -9.075 1.00 10.00 C ATOM 376 O CYS A 26 13.217 -15.576 -8.374 1.00 10.00 O ATOM 377 CB CYS A 26 14.160 -16.614 -11.163 1.00 10.00 C ATOM 378 SG CYS A 26 15.855 -16.267 -11.504 1.00 10.00 S ATOM 0 H CYS A 26 13.598 -18.985 -10.847 1.00 10.00 H new ATOM 0 HA CYS A 26 14.912 -17.181 -9.231 1.00 10.00 H new ATOM 0 HB2 CYS A 26 13.764 -17.282 -11.928 1.00 10.00 H new ATOM 0 HB3 CYS A 26 13.582 -15.691 -11.215 1.00 10.00 H new ATOM 383 N GLU A 27 11.626 -16.834 -9.267 1.00 10.00 N ATOM 384 CA GLU A 27 10.481 -16.266 -8.580 1.00 10.00 C ATOM 385 C GLU A 27 10.541 -16.547 -7.100 1.00 10.00 C ATOM 386 O GLU A 27 10.814 -15.619 -6.360 1.00 10.00 O ATOM 387 CB GLU A 27 9.170 -16.813 -9.157 1.00 10.00 C ATOM 388 CG GLU A 27 8.400 -15.732 -9.894 1.00 10.00 C ATOM 389 CD GLU A 27 6.873 -15.836 -9.725 1.00 10.00 C ATOM 390 OE1 GLU A 27 6.376 -16.459 -8.760 1.00 10.00 O ATOM 391 OE2 GLU A 27 6.212 -15.315 -10.647 1.00 10.00 O ATOM 0 H GLU A 27 11.358 -17.549 -9.943 1.00 10.00 H new ATOM 0 HA GLU A 27 10.511 -15.187 -8.732 1.00 10.00 H new ATOM 0 HB2 GLU A 27 9.385 -17.637 -9.837 1.00 10.00 H new ATOM 0 HB3 GLU A 27 8.556 -17.216 -8.352 1.00 10.00 H new ATOM 0 HG2 GLU A 27 8.730 -14.756 -9.538 1.00 10.00 H new ATOM 0 HG3 GLU A 27 8.644 -15.784 -10.955 1.00 10.00 H new ATOM 398 N MET A 28 10.444 -17.815 -6.686 1.00 10.00 N ATOM 399 CA MET A 28 10.488 -18.214 -5.277 1.00 10.00 C ATOM 400 C MET A 28 11.700 -17.640 -4.541 1.00 10.00 C ATOM 401 O MET A 28 11.693 -17.516 -3.316 1.00 10.00 O ATOM 402 CB MET A 28 10.555 -19.749 -5.184 1.00 10.00 C ATOM 403 CG MET A 28 9.414 -20.329 -4.350 1.00 10.00 C ATOM 404 SD MET A 28 9.931 -21.615 -3.179 1.00 10.00 S ATOM 405 CE MET A 28 9.823 -20.661 -1.643 1.00 10.00 C ATOM 0 H MET A 28 10.332 -18.600 -7.327 1.00 10.00 H new ATOM 0 HA MET A 28 9.586 -17.823 -4.807 1.00 10.00 H new ATOM 0 HB2 MET A 28 10.521 -20.174 -6.187 1.00 10.00 H new ATOM 0 HB3 MET A 28 11.509 -20.043 -4.746 1.00 10.00 H new ATOM 0 HG2 MET A 28 8.935 -19.521 -3.797 1.00 10.00 H new ATOM 0 HG3 MET A 28 8.663 -20.745 -5.021 1.00 10.00 H new ATOM 0 HE1 MET A 28 10.107 -21.293 -0.802 1.00 10.00 H new ATOM 0 HE2 MET A 28 10.496 -19.805 -1.698 1.00 10.00 H new ATOM 0 HE3 MET A 28 8.800 -20.310 -1.504 1.00 10.00 H new ATOM 415 N LYS A 29 12.761 -17.341 -5.298 1.00 10.00 N ATOM 416 CA LYS A 29 13.957 -16.698 -4.817 1.00 10.00 C ATOM 417 C LYS A 29 13.830 -15.197 -4.796 1.00 10.00 C ATOM 418 O LYS A 29 13.919 -14.683 -3.710 1.00 10.00 O ATOM 419 CB LYS A 29 15.154 -17.140 -5.631 1.00 10.00 C ATOM 420 CG LYS A 29 16.424 -17.033 -4.787 1.00 10.00 C ATOM 421 CD LYS A 29 17.307 -15.875 -5.248 1.00 10.00 C ATOM 422 CE LYS A 29 18.772 -16.191 -4.958 1.00 10.00 C ATOM 423 NZ LYS A 29 19.604 -15.759 -6.106 1.00 10.00 N ATOM 0 H LYS A 29 12.797 -17.553 -6.295 1.00 10.00 H new ATOM 0 HA LYS A 29 14.106 -17.009 -3.783 1.00 10.00 H new ATOM 0 HB2 LYS A 29 15.016 -18.167 -5.968 1.00 10.00 H new ATOM 0 HB3 LYS A 29 15.247 -16.521 -6.524 1.00 10.00 H new ATOM 0 HG2 LYS A 29 16.155 -16.893 -3.740 1.00 10.00 H new ATOM 0 HG3 LYS A 29 16.984 -17.966 -4.850 1.00 10.00 H new ATOM 0 HD2 LYS A 29 17.168 -15.702 -6.315 1.00 10.00 H new ATOM 0 HD3 LYS A 29 17.016 -14.958 -4.736 1.00 10.00 H new ATOM 0 HE2 LYS A 29 19.093 -15.681 -4.050 1.00 10.00 H new ATOM 0 HE3 LYS A 29 18.898 -17.260 -4.785 1.00 10.00 H new ATOM 0 HZ1 LYS A 29 20.603 -15.973 -5.911 1.00 10.00 H new ATOM 0 HZ2 LYS A 29 19.302 -16.265 -6.963 1.00 10.00 H new ATOM 0 HZ3 LYS A 29 19.491 -14.735 -6.251 1.00 10.00 H new ATOM 437 N CYS A 30 13.666 -14.519 -5.927 1.00 10.00 N ATOM 438 CA CYS A 30 13.389 -13.091 -6.053 1.00 10.00 C ATOM 439 C CYS A 30 12.313 -12.609 -5.073 1.00 10.00 C ATOM 440 O CYS A 30 12.334 -11.451 -4.673 1.00 10.00 O ATOM 441 CB CYS A 30 12.915 -12.775 -7.472 1.00 10.00 C ATOM 442 SG CYS A 30 14.186 -12.772 -8.729 1.00 10.00 S ATOM 0 H CYS A 30 13.726 -14.979 -6.835 1.00 10.00 H new ATOM 0 HA CYS A 30 14.320 -12.573 -5.824 1.00 10.00 H new ATOM 0 HB2 CYS A 30 12.154 -13.503 -7.752 1.00 10.00 H new ATOM 0 HB3 CYS A 30 12.433 -11.797 -7.466 1.00 10.00 H new ATOM 0 HG CYS A 30 14.562 -13.993 -8.969 1.00 10.00 H new ATOM 447 N ASP A 31 11.394 -13.502 -4.708 1.00 10.00 N ATOM 448 CA ASP A 31 10.372 -13.284 -3.701 1.00 10.00 C ATOM 449 C ASP A 31 10.999 -13.007 -2.348 1.00 10.00 C ATOM 450 O ASP A 31 10.875 -11.925 -1.785 1.00 10.00 O ATOM 451 CB ASP A 31 9.448 -14.518 -3.600 1.00 10.00 C ATOM 452 CG ASP A 31 8.026 -14.168 -3.169 1.00 10.00 C ATOM 453 OD1 ASP A 31 7.777 -13.012 -2.767 1.00 10.00 O ATOM 454 OD2 ASP A 31 7.176 -15.071 -3.323 1.00 10.00 O ATOM 0 H ASP A 31 11.344 -14.431 -5.126 1.00 10.00 H new ATOM 0 HA ASP A 31 9.784 -12.416 -3.999 1.00 10.00 H new ATOM 0 HB2 ASP A 31 9.415 -15.020 -4.567 1.00 10.00 H new ATOM 0 HB3 ASP A 31 9.873 -15.226 -2.888 1.00 10.00 H new ATOM 459 N THR A 32 11.720 -14.003 -1.837 1.00 10.00 N ATOM 460 CA THR A 32 12.445 -13.874 -0.586 1.00 10.00 C ATOM 461 C THR A 32 13.679 -12.984 -0.739 1.00 10.00 C ATOM 462 O THR A 32 14.208 -12.556 0.268 1.00 10.00 O ATOM 463 CB THR A 32 12.787 -15.273 -0.055 1.00 10.00 C ATOM 464 OG1 THR A 32 11.706 -15.741 0.730 1.00 10.00 O ATOM 465 CG2 THR A 32 14.017 -15.370 0.848 1.00 10.00 C ATOM 0 H THR A 32 11.815 -14.917 -2.281 1.00 10.00 H new ATOM 0 HA THR A 32 11.813 -13.375 0.148 1.00 10.00 H new ATOM 0 HB THR A 32 12.992 -15.855 -0.954 1.00 10.00 H new ATOM 0 HG1 THR A 32 11.914 -16.635 1.073 1.00 10.00 H new ATOM 0 HG21 THR A 32 14.158 -16.405 1.161 1.00 10.00 H new ATOM 0 HG22 THR A 32 14.897 -15.033 0.301 1.00 10.00 H new ATOM 0 HG23 THR A 32 13.873 -14.742 1.727 1.00 10.00 H new ATOM 473 N ASP A 33 14.178 -12.729 -1.947 1.00 10.00 N ATOM 474 CA ASP A 33 15.342 -11.895 -2.226 1.00 10.00 C ATOM 475 C ASP A 33 15.113 -10.496 -1.674 1.00 10.00 C ATOM 476 O ASP A 33 15.740 -10.104 -0.687 1.00 10.00 O ATOM 477 CB ASP A 33 15.608 -11.828 -3.733 1.00 10.00 C ATOM 478 CG ASP A 33 16.722 -10.860 -4.122 1.00 10.00 C ATOM 479 OD1 ASP A 33 16.508 -9.638 -4.023 1.00 10.00 O ATOM 480 OD2 ASP A 33 17.771 -11.366 -4.579 1.00 10.00 O ATOM 0 H ASP A 33 13.763 -13.116 -2.794 1.00 10.00 H new ATOM 0 HA ASP A 33 16.214 -12.336 -1.742 1.00 10.00 H new ATOM 0 HB2 ASP A 33 15.865 -12.825 -4.091 1.00 10.00 H new ATOM 0 HB3 ASP A 33 14.690 -11.533 -4.241 1.00 10.00 H new ATOM 485 N CYS A 34 14.186 -9.767 -2.304 1.00 10.00 N ATOM 486 CA CYS A 34 13.867 -8.407 -1.928 1.00 10.00 C ATOM 487 C CYS A 34 12.920 -8.416 -0.734 1.00 10.00 C ATOM 488 O CYS A 34 11.843 -7.839 -0.763 1.00 10.00 O ATOM 489 CB CYS A 34 13.257 -7.635 -3.097 1.00 10.00 C ATOM 490 SG CYS A 34 14.344 -7.243 -4.489 1.00 10.00 S ATOM 0 H CYS A 34 13.639 -10.116 -3.091 1.00 10.00 H new ATOM 0 HA CYS A 34 14.790 -7.899 -1.649 1.00 10.00 H new ATOM 0 HB2 CYS A 34 12.414 -8.211 -3.479 1.00 10.00 H new ATOM 0 HB3 CYS A 34 12.854 -6.699 -2.710 1.00 10.00 H new ATOM 495 N SER A 35 13.347 -9.031 0.348 1.00 10.00 N ATOM 496 CA SER A 35 12.603 -9.206 1.570 1.00 10.00 C ATOM 497 C SER A 35 13.466 -9.923 2.613 1.00 10.00 C ATOM 498 O SER A 35 14.298 -10.776 2.346 1.00 10.00 O ATOM 499 CB SER A 35 11.317 -10.002 1.322 1.00 10.00 C ATOM 500 OG SER A 35 10.222 -9.172 1.676 1.00 10.00 O ATOM 0 H SER A 35 14.278 -9.445 0.398 1.00 10.00 H new ATOM 0 HA SER A 35 12.329 -8.220 1.944 1.00 10.00 H new ATOM 0 HB2 SER A 35 11.248 -10.301 0.276 1.00 10.00 H new ATOM 0 HB3 SER A 35 11.312 -10.916 1.916 1.00 10.00 H new ATOM 0 HG SER A 35 9.383 -9.656 1.526 1.00 10.00 H new ATOM 506 N VAL A 36 13.265 -9.601 3.876 1.00 10.00 N ATOM 507 CA VAL A 36 13.947 -10.255 4.984 1.00 10.00 C ATOM 508 C VAL A 36 13.279 -11.596 5.275 1.00 10.00 C ATOM 509 O VAL A 36 12.301 -11.983 4.636 1.00 10.00 O ATOM 510 CB VAL A 36 14.004 -9.344 6.222 1.00 10.00 C ATOM 511 CG1 VAL A 36 15.227 -9.669 7.103 1.00 10.00 C ATOM 512 CG2 VAL A 36 14.003 -7.859 5.818 1.00 10.00 C ATOM 0 H VAL A 36 12.617 -8.870 4.169 1.00 10.00 H new ATOM 0 HA VAL A 36 14.983 -10.449 4.704 1.00 10.00 H new ATOM 0 HB VAL A 36 13.107 -9.536 6.811 1.00 10.00 H new ATOM 0 HG11 VAL A 36 15.238 -9.007 7.969 1.00 10.00 H new ATOM 0 HG12 VAL A 36 15.169 -10.705 7.438 1.00 10.00 H new ATOM 0 HG13 VAL A 36 16.140 -9.525 6.525 1.00 10.00 H new ATOM 0 HG21 VAL A 36 14.044 -7.238 6.713 1.00 10.00 H new ATOM 0 HG22 VAL A 36 14.871 -7.651 5.193 1.00 10.00 H new ATOM 0 HG23 VAL A 36 13.093 -7.634 5.262 1.00 10.00 H new ATOM 522 N LYS A 37 13.769 -12.299 6.290 1.00 10.00 N ATOM 523 CA LYS A 37 13.234 -13.580 6.739 1.00 10.00 C ATOM 524 C LYS A 37 13.936 -14.017 8.020 1.00 10.00 C ATOM 525 O LYS A 37 14.411 -13.167 8.760 1.00 10.00 O ATOM 526 CB LYS A 37 13.349 -14.609 5.592 1.00 10.00 C ATOM 527 CG LYS A 37 12.016 -15.344 5.422 1.00 10.00 C ATOM 528 CD LYS A 37 12.283 -16.787 4.999 1.00 10.00 C ATOM 529 CE LYS A 37 11.062 -17.358 4.277 1.00 10.00 C ATOM 530 NZ LYS A 37 10.312 -18.300 5.144 1.00 10.00 N ATOM 0 H LYS A 37 14.570 -11.986 6.838 1.00 10.00 H new ATOM 0 HA LYS A 37 12.176 -13.492 6.985 1.00 10.00 H new ATOM 0 HB2 LYS A 37 13.618 -14.105 4.664 1.00 10.00 H new ATOM 0 HB3 LYS A 37 14.144 -15.323 5.809 1.00 10.00 H new ATOM 0 HG2 LYS A 37 11.456 -15.325 6.357 1.00 10.00 H new ATOM 0 HG3 LYS A 37 11.404 -14.841 4.673 1.00 10.00 H new ATOM 0 HD2 LYS A 37 13.154 -16.827 4.344 1.00 10.00 H new ATOM 0 HD3 LYS A 37 12.514 -17.394 5.874 1.00 10.00 H new ATOM 0 HE2 LYS A 37 10.406 -16.544 3.969 1.00 10.00 H new ATOM 0 HE3 LYS A 37 11.381 -17.871 3.370 1.00 10.00 H new ATOM 0 HZ1 LYS A 37 9.490 -18.670 4.625 1.00 10.00 H new ATOM 0 HZ2 LYS A 37 10.932 -19.089 5.418 1.00 10.00 H new ATOM 0 HZ3 LYS A 37 9.987 -17.803 5.998 1.00 10.00 H new ATOM 544 N ASP A 38 13.988 -15.323 8.254 1.00 10.00 N ATOM 545 CA ASP A 38 14.635 -15.931 9.403 1.00 10.00 C ATOM 546 C ASP A 38 15.430 -17.145 8.951 1.00 10.00 C ATOM 547 O ASP A 38 14.869 -18.078 8.369 1.00 10.00 O ATOM 548 CB ASP A 38 13.574 -16.376 10.417 1.00 10.00 C ATOM 549 CG ASP A 38 14.020 -16.138 11.860 1.00 10.00 C ATOM 550 OD1 ASP A 38 14.536 -15.036 12.134 1.00 10.00 O ATOM 551 OD2 ASP A 38 13.888 -17.082 12.671 1.00 10.00 O ATOM 0 H ASP A 38 13.566 -16.008 7.627 1.00 10.00 H new ATOM 0 HA ASP A 38 15.302 -15.204 9.867 1.00 10.00 H new ATOM 0 HB2 ASP A 38 12.646 -15.835 10.231 1.00 10.00 H new ATOM 0 HB3 ASP A 38 13.359 -17.435 10.275 1.00 10.00 H new ATOM 556 N VAL A 39 16.733 -17.126 9.195 1.00 10.00 N ATOM 557 CA VAL A 39 17.652 -18.204 8.844 1.00 10.00 C ATOM 558 C VAL A 39 18.742 -18.172 9.898 1.00 10.00 C ATOM 559 O VAL A 39 19.735 -17.464 9.753 1.00 10.00 O ATOM 560 CB VAL A 39 18.177 -18.044 7.397 1.00 10.00 C ATOM 561 CG1 VAL A 39 19.466 -18.836 7.127 1.00 10.00 C ATOM 562 CG2 VAL A 39 17.116 -18.488 6.378 1.00 10.00 C ATOM 0 H VAL A 39 17.194 -16.341 9.655 1.00 10.00 H new ATOM 0 HA VAL A 39 17.168 -19.180 8.843 1.00 10.00 H new ATOM 0 HB VAL A 39 18.400 -16.983 7.285 1.00 10.00 H new ATOM 0 HG11 VAL A 39 19.780 -18.680 6.095 1.00 10.00 H new ATOM 0 HG12 VAL A 39 20.251 -18.493 7.801 1.00 10.00 H new ATOM 0 HG13 VAL A 39 19.283 -19.897 7.294 1.00 10.00 H new ATOM 0 HG21 VAL A 39 17.508 -18.366 5.368 1.00 10.00 H new ATOM 0 HG22 VAL A 39 16.866 -19.535 6.546 1.00 10.00 H new ATOM 0 HG23 VAL A 39 16.221 -17.878 6.496 1.00 10.00 H new ATOM 572 N LYS A 40 18.502 -18.880 11.011 1.00 10.00 N ATOM 573 CA LYS A 40 19.505 -19.047 12.062 1.00 10.00 C ATOM 574 C LYS A 40 20.843 -19.453 11.457 1.00 10.00 C ATOM 575 O LYS A 40 20.874 -20.131 10.429 1.00 10.00 O ATOM 576 CB LYS A 40 19.035 -20.059 13.113 1.00 10.00 C ATOM 577 CG LYS A 40 17.856 -19.484 13.912 1.00 10.00 C ATOM 578 CD LYS A 40 17.916 -19.940 15.373 1.00 10.00 C ATOM 579 CE LYS A 40 16.810 -19.249 16.180 1.00 10.00 C ATOM 580 NZ LYS A 40 15.839 -20.233 16.713 1.00 10.00 N ATOM 0 H LYS A 40 17.616 -19.347 11.203 1.00 10.00 H new ATOM 0 HA LYS A 40 19.639 -18.091 12.568 1.00 10.00 H new ATOM 0 HB2 LYS A 40 18.736 -20.987 12.626 1.00 10.00 H new ATOM 0 HB3 LYS A 40 19.856 -20.303 13.787 1.00 10.00 H new ATOM 0 HG2 LYS A 40 17.875 -18.395 13.865 1.00 10.00 H new ATOM 0 HG3 LYS A 40 16.916 -19.806 13.464 1.00 10.00 H new ATOM 0 HD2 LYS A 40 17.799 -21.022 15.431 1.00 10.00 H new ATOM 0 HD3 LYS A 40 18.891 -19.702 15.798 1.00 10.00 H new ATOM 0 HE2 LYS A 40 17.253 -18.689 17.004 1.00 10.00 H new ATOM 0 HE3 LYS A 40 16.291 -18.529 15.548 1.00 10.00 H new ATOM 0 HZ1 LYS A 40 15.103 -19.736 17.254 1.00 10.00 H new ATOM 0 HZ2 LYS A 40 15.400 -20.749 15.924 1.00 10.00 H new ATOM 0 HZ3 LYS A 40 16.332 -20.905 17.335 1.00 10.00 H new ATOM 594 N GLU A 41 21.922 -19.036 12.114 1.00 10.00 N ATOM 595 CA GLU A 41 23.266 -19.317 11.627 1.00 10.00 C ATOM 596 C GLU A 41 23.476 -20.821 11.431 1.00 10.00 C ATOM 597 O GLU A 41 22.729 -21.666 11.941 1.00 10.00 O ATOM 598 CB GLU A 41 24.317 -18.746 12.591 1.00 10.00 C ATOM 599 CG GLU A 41 25.615 -18.357 11.858 1.00 10.00 C ATOM 600 CD GLU A 41 26.310 -17.172 12.538 1.00 10.00 C ATOM 601 OE1 GLU A 41 25.628 -16.132 12.682 1.00 10.00 O ATOM 602 OE2 GLU A 41 27.498 -17.303 12.900 1.00 10.00 O ATOM 0 H GLU A 41 21.890 -18.503 12.983 1.00 10.00 H new ATOM 0 HA GLU A 41 23.384 -18.832 10.658 1.00 10.00 H new ATOM 0 HB2 GLU A 41 23.909 -17.871 13.097 1.00 10.00 H new ATOM 0 HB3 GLU A 41 24.542 -19.483 13.362 1.00 10.00 H new ATOM 0 HG2 GLU A 41 26.291 -19.212 11.834 1.00 10.00 H new ATOM 0 HG3 GLU A 41 25.387 -18.102 10.823 1.00 10.00 H new ATOM 609 N LYS A 42 24.555 -21.177 10.749 1.00 10.00 N ATOM 610 CA LYS A 42 24.907 -22.567 10.530 1.00 10.00 C ATOM 611 C LYS A 42 26.082 -22.869 11.440 1.00 10.00 C ATOM 612 O LYS A 42 27.225 -22.690 11.044 1.00 10.00 O ATOM 613 CB LYS A 42 25.158 -22.781 9.034 1.00 10.00 C ATOM 614 CG LYS A 42 25.606 -24.217 8.735 1.00 10.00 C ATOM 615 CD LYS A 42 24.406 -25.160 8.653 1.00 10.00 C ATOM 616 CE LYS A 42 24.896 -26.607 8.749 1.00 10.00 C ATOM 617 NZ LYS A 42 23.979 -27.417 9.585 1.00 10.00 N ATOM 0 H LYS A 42 25.207 -20.511 10.334 1.00 10.00 H new ATOM 0 HA LYS A 42 24.116 -23.271 10.786 1.00 10.00 H new ATOM 0 HB2 LYS A 42 24.248 -22.560 8.477 1.00 10.00 H new ATOM 0 HB3 LYS A 42 25.920 -22.082 8.689 1.00 10.00 H new ATOM 0 HG2 LYS A 42 26.157 -24.241 7.795 1.00 10.00 H new ATOM 0 HG3 LYS A 42 26.289 -24.558 9.513 1.00 10.00 H new ATOM 0 HD2 LYS A 42 23.705 -24.947 9.460 1.00 10.00 H new ATOM 0 HD3 LYS A 42 23.871 -25.006 7.716 1.00 10.00 H new ATOM 0 HE2 LYS A 42 24.964 -27.040 7.751 1.00 10.00 H new ATOM 0 HE3 LYS A 42 25.899 -26.629 9.175 1.00 10.00 H new ATOM 0 HZ1 LYS A 42 24.329 -28.395 9.637 1.00 10.00 H new ATOM 0 HZ2 LYS A 42 23.935 -27.014 10.543 1.00 10.00 H new ATOM 0 HZ3 LYS A 42 23.029 -27.412 9.163 1.00 10.00 H new ATOM 631 N LEU A 43 25.769 -23.255 12.682 1.00 10.00 N ATOM 632 CA LEU A 43 26.783 -23.695 13.633 1.00 10.00 C ATOM 633 C LEU A 43 27.706 -24.730 12.984 1.00 10.00 C ATOM 634 O LEU A 43 27.293 -25.510 12.122 1.00 10.00 O ATOM 635 CB LEU A 43 26.125 -24.237 14.916 1.00 10.00 C ATOM 636 CG LEU A 43 25.695 -25.721 14.832 1.00 10.00 C ATOM 637 CD1 LEU A 43 26.722 -26.638 15.509 1.00 10.00 C ATOM 638 CD2 LEU A 43 24.326 -25.918 15.477 1.00 10.00 C ATOM 0 H LEU A 43 24.817 -23.270 13.048 1.00 10.00 H new ATOM 0 HA LEU A 43 27.395 -22.840 13.919 1.00 10.00 H new ATOM 0 HB2 LEU A 43 26.822 -24.119 15.746 1.00 10.00 H new ATOM 0 HB3 LEU A 43 25.250 -23.630 15.146 1.00 10.00 H new ATOM 0 HG LEU A 43 25.637 -25.988 13.777 1.00 10.00 H new ATOM 0 HD11 LEU A 43 26.391 -27.674 15.433 1.00 10.00 H new ATOM 0 HD12 LEU A 43 27.688 -26.529 15.016 1.00 10.00 H new ATOM 0 HD13 LEU A 43 26.818 -26.364 16.560 1.00 10.00 H new ATOM 0 HD21 LEU A 43 24.039 -26.967 15.409 1.00 10.00 H new ATOM 0 HD22 LEU A 43 24.371 -25.622 16.525 1.00 10.00 H new ATOM 0 HD23 LEU A 43 23.588 -25.306 14.958 1.00 10.00 H new ATOM 650 N GLU A 44 28.917 -24.821 13.497 1.00 10.00 N ATOM 651 CA GLU A 44 29.919 -25.728 12.973 1.00 10.00 C ATOM 652 C GLU A 44 30.957 -26.001 14.042 1.00 10.00 C ATOM 653 O GLU A 44 30.843 -25.507 15.166 1.00 10.00 O ATOM 654 CB GLU A 44 30.548 -25.130 11.698 1.00 10.00 C ATOM 655 CG GLU A 44 30.254 -26.017 10.480 1.00 10.00 C ATOM 656 CD GLU A 44 29.933 -25.187 9.233 1.00 10.00 C ATOM 657 OE1 GLU A 44 30.872 -24.574 8.682 1.00 10.00 O ATOM 658 OE2 GLU A 44 28.752 -25.225 8.812 1.00 10.00 O ATOM 0 H GLU A 44 29.235 -24.266 14.292 1.00 10.00 H new ATOM 0 HA GLU A 44 29.461 -26.678 12.699 1.00 10.00 H new ATOM 0 HB2 GLU A 44 30.154 -24.128 11.528 1.00 10.00 H new ATOM 0 HB3 GLU A 44 31.625 -25.031 11.830 1.00 10.00 H new ATOM 0 HG2 GLU A 44 31.115 -26.655 10.280 1.00 10.00 H new ATOM 0 HG3 GLU A 44 29.414 -26.675 10.704 1.00 10.00 H new ATOM 665 N ASN A 45 31.926 -26.843 13.696 1.00 10.00 N ATOM 666 CA ASN A 45 33.031 -27.236 14.546 1.00 10.00 C ATOM 667 C ASN A 45 33.840 -28.341 13.881 1.00 10.00 C ATOM 668 O ASN A 45 33.377 -29.033 12.978 1.00 10.00 O ATOM 669 CB ASN A 45 32.516 -27.738 15.910 1.00 10.00 C ATOM 670 CG ASN A 45 32.907 -26.842 17.067 1.00 10.00 C ATOM 671 OD1 ASN A 45 33.667 -25.893 16.979 1.00 10.00 O ATOM 672 ND2 ASN A 45 32.444 -27.196 18.238 1.00 10.00 N ATOM 0 H ASN A 45 31.959 -27.285 12.777 1.00 10.00 H new ATOM 0 HA ASN A 45 33.664 -26.363 14.702 1.00 10.00 H new ATOM 0 HB2 ASN A 45 31.430 -27.818 15.873 1.00 10.00 H new ATOM 0 HB3 ASN A 45 32.903 -28.741 16.090 1.00 10.00 H new ATOM 0 HD21 ASN A 45 32.719 -26.679 19.073 1.00 10.00 H new ATOM 0 HD22 ASN A 45 31.808 -27.989 18.316 1.00 10.00 H new ATOM 679 N TYR A 46 35.051 -28.533 14.378 1.00 10.00 N ATOM 680 CA TYR A 46 36.013 -29.460 13.813 1.00 10.00 C ATOM 681 C TYR A 46 36.934 -29.970 14.911 1.00 10.00 C ATOM 682 O TYR A 46 36.896 -29.507 16.052 1.00 10.00 O ATOM 683 CB TYR A 46 36.798 -28.762 12.682 1.00 10.00 C ATOM 684 CG TYR A 46 37.261 -27.343 12.989 1.00 10.00 C ATOM 685 CD1 TYR A 46 36.327 -26.288 13.058 1.00 10.00 C ATOM 686 CD2 TYR A 46 38.626 -27.063 13.189 1.00 10.00 C ATOM 687 CE1 TYR A 46 36.723 -24.993 13.418 1.00 10.00 C ATOM 688 CE2 TYR A 46 39.038 -25.746 13.487 1.00 10.00 C ATOM 689 CZ TYR A 46 38.084 -24.717 13.627 1.00 10.00 C ATOM 690 OH TYR A 46 38.464 -23.461 13.969 1.00 10.00 O ATOM 0 H TYR A 46 35.398 -28.039 15.200 1.00 10.00 H new ATOM 0 HA TYR A 46 35.500 -30.320 13.382 1.00 10.00 H new ATOM 0 HB2 TYR A 46 37.672 -29.367 12.442 1.00 10.00 H new ATOM 0 HB3 TYR A 46 36.172 -28.737 11.790 1.00 10.00 H new ATOM 0 HD1 TYR A 46 35.289 -26.482 12.830 1.00 10.00 H new ATOM 0 HD2 TYR A 46 39.357 -27.855 13.115 1.00 10.00 H new ATOM 0 HE1 TYR A 46 35.986 -24.212 13.534 1.00 10.00 H new ATOM 0 HE2 TYR A 46 40.088 -25.526 13.608 1.00 10.00 H new ATOM 0 HH TYR A 46 39.437 -23.432 14.079 1.00 10.00 H new ATOM 700 N LYS A 47 37.795 -30.922 14.554 1.00 10.00 N ATOM 701 CA LYS A 47 38.787 -31.474 15.465 1.00 10.00 C ATOM 702 C LYS A 47 40.188 -31.294 14.880 1.00 10.00 C ATOM 703 O LYS A 47 40.745 -32.234 14.310 1.00 10.00 O ATOM 704 CB LYS A 47 38.405 -32.911 15.820 1.00 10.00 C ATOM 705 CG LYS A 47 39.034 -33.299 17.166 1.00 10.00 C ATOM 706 CD LYS A 47 39.991 -34.477 16.993 1.00 10.00 C ATOM 707 CE LYS A 47 40.735 -34.750 18.303 1.00 10.00 C ATOM 708 NZ LYS A 47 40.083 -35.836 19.076 1.00 10.00 N ATOM 0 H LYS A 47 37.821 -31.331 13.620 1.00 10.00 H new ATOM 0 HA LYS A 47 38.805 -30.934 16.412 1.00 10.00 H new ATOM 0 HB2 LYS A 47 37.320 -33.006 15.874 1.00 10.00 H new ATOM 0 HB3 LYS A 47 38.746 -33.591 15.039 1.00 10.00 H new ATOM 0 HG2 LYS A 47 39.570 -32.446 17.582 1.00 10.00 H new ATOM 0 HG3 LYS A 47 38.251 -33.561 17.877 1.00 10.00 H new ATOM 0 HD2 LYS A 47 39.436 -35.365 16.690 1.00 10.00 H new ATOM 0 HD3 LYS A 47 40.705 -34.261 16.199 1.00 10.00 H new ATOM 0 HE2 LYS A 47 41.768 -35.024 18.087 1.00 10.00 H new ATOM 0 HE3 LYS A 47 40.765 -33.841 18.903 1.00 10.00 H new ATOM 0 HZ1 LYS A 47 40.609 -35.998 19.958 1.00 10.00 H new ATOM 0 HZ2 LYS A 47 39.105 -35.563 19.301 1.00 10.00 H new ATOM 0 HZ3 LYS A 47 40.077 -36.709 18.511 1.00 10.00 H new ATOM 722 N PRO A 48 40.736 -30.070 14.958 1.00 10.00 N ATOM 723 CA PRO A 48 42.074 -29.803 14.470 1.00 10.00 C ATOM 724 C PRO A 48 43.057 -30.572 15.343 1.00 10.00 C ATOM 725 O PRO A 48 42.860 -30.682 16.558 1.00 10.00 O ATOM 726 CB PRO A 48 42.251 -28.285 14.521 1.00 10.00 C ATOM 727 CG PRO A 48 41.189 -27.783 15.503 1.00 10.00 C ATOM 728 CD PRO A 48 40.217 -28.937 15.709 1.00 10.00 C ATOM 0 HA PRO A 48 42.250 -30.133 13.446 1.00 10.00 H new ATOM 0 HB2 PRO A 48 43.253 -28.018 14.856 1.00 10.00 H new ATOM 0 HB3 PRO A 48 42.115 -27.841 13.535 1.00 10.00 H new ATOM 0 HG2 PRO A 48 41.643 -27.484 16.448 1.00 10.00 H new ATOM 0 HG3 PRO A 48 40.675 -26.908 15.106 1.00 10.00 H new ATOM 0 HD2 PRO A 48 40.130 -29.183 16.767 1.00 10.00 H new ATOM 0 HD3 PRO A 48 39.220 -28.668 15.361 1.00 10.00 H new ATOM 736 N LYS A 49 44.049 -31.195 14.688 1.00 10.00 N ATOM 737 CA LYS A 49 45.143 -31.879 15.377 1.00 10.00 C ATOM 738 C LYS A 49 45.757 -30.954 16.445 1.00 10.00 C ATOM 739 O LYS A 49 45.502 -29.751 16.436 1.00 10.00 O ATOM 740 CB LYS A 49 46.181 -32.371 14.352 1.00 10.00 C ATOM 741 CG LYS A 49 46.806 -33.708 14.788 1.00 10.00 C ATOM 742 CD LYS A 49 48.314 -33.609 15.014 1.00 10.00 C ATOM 743 CE LYS A 49 49.090 -33.689 13.703 1.00 10.00 C ATOM 744 NZ LYS A 49 49.464 -32.336 13.226 1.00 10.00 N ATOM 0 H LYS A 49 44.111 -31.236 13.671 1.00 10.00 H new ATOM 0 HA LYS A 49 44.762 -32.757 15.898 1.00 10.00 H new ATOM 0 HB2 LYS A 49 45.706 -32.489 13.378 1.00 10.00 H new ATOM 0 HB3 LYS A 49 46.964 -31.622 14.236 1.00 10.00 H new ATOM 0 HG2 LYS A 49 46.327 -34.046 15.707 1.00 10.00 H new ATOM 0 HG3 LYS A 49 46.606 -34.463 14.028 1.00 10.00 H new ATOM 0 HD2 LYS A 49 48.545 -32.670 15.516 1.00 10.00 H new ATOM 0 HD3 LYS A 49 48.636 -34.413 15.676 1.00 10.00 H new ATOM 0 HE2 LYS A 49 49.988 -34.291 13.844 1.00 10.00 H new ATOM 0 HE3 LYS A 49 48.485 -34.191 12.948 1.00 10.00 H new ATOM 0 HZ1 LYS A 49 50.169 -32.418 12.466 1.00 10.00 H new ATOM 0 HZ2 LYS A 49 48.619 -31.850 12.864 1.00 10.00 H new ATOM 0 HZ3 LYS A 49 49.867 -31.789 14.014 1.00 10.00 H new ATOM 758 N ASN A 50 46.532 -31.549 17.355 1.00 10.00 N ATOM 759 CA ASN A 50 47.258 -30.779 18.373 1.00 10.00 C ATOM 760 C ASN A 50 48.084 -29.611 17.791 1.00 10.00 C ATOM 761 O ASN A 50 48.525 -28.810 18.641 1.00 10.00 O ATOM 762 CB ASN A 50 48.167 -31.719 19.182 1.00 10.00 C ATOM 763 CG ASN A 50 49.222 -32.376 18.309 1.00 10.00 C ATOM 764 OD1 ASN A 50 50.189 -31.835 17.810 1.00 10.00 O ATOM 765 ND2 ASN A 50 49.035 -33.640 18.040 1.00 10.00 N ATOM 766 OXT ASN A 50 48.310 -29.612 16.553 1.00 10.00 O ATOM 0 H ASN A 50 46.674 -32.558 17.409 1.00 10.00 H new ATOM 0 HA ASN A 50 46.506 -30.327 19.020 1.00 10.00 H new ATOM 0 HB2 ASN A 50 48.654 -31.157 19.979 1.00 10.00 H new ATOM 0 HB3 ASN A 50 47.560 -32.488 19.660 1.00 10.00 H new ATOM 0 HD21 ASN A 50 49.688 -34.134 17.432 1.00 10.00 H new ATOM 0 HD22 ASN A 50 48.236 -34.133 18.438 1.00 10.00 H new TER 773 ASN A 50