USER MOD reduce.3.24.130724 H: found=0, std=0, add=547, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 547 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 55 THR OG1 : rot -83:sc= 1.2 USER MOD Set 1.2: A 57 SER OG : rot -31:sc= 0.817 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 2.06 (180deg=2.06) USER MOD Single : A 2 GLN : amide:sc= 1.01 K(o=1,f=-0.65) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 155:sc= 1.28 (180deg=1.06) USER MOD Single : A 12 THR OG1 : rot 148:sc= -0.807 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 ASN : amide:sc= -0.239 K(o=-0.24,f=-1.5) USER MOD Single : A 27 LYS NZ :NH3+ -159:sc= 1.36 (180deg=1.19) USER MOD Single : A 29 LYS NZ :NH3+ 160:sc= 2.07 (180deg=1.49) USER MOD Single : A 31 GLN : amide:sc= -0.408 X(o=-0.41,f=-0.85) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 41 GLN : amide:sc= 1.09 K(o=1.1,f=-3!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 59 TYR OH : rot 130:sc= 0.351 USER MOD Single : A 60 ASN : amide:sc= -0.214 X(o=-0.21,f=-0.52) USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 78:sc= 1.27 USER MOD Single : A 66 THR OG1 : rot 33:sc= 0.204 USER MOD Single : A 68 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 32.714 52.279 19.859 1.00 0.00 N ATOM 2 CA MET A 1 33.107 52.574 21.245 1.00 0.00 C ATOM 3 C MET A 1 34.633 52.596 21.346 1.00 0.00 C ATOM 4 O MET A 1 35.302 52.094 20.445 1.00 0.00 O ATOM 5 CB MET A 1 32.437 51.644 22.253 1.00 0.00 C ATOM 6 CG MET A 1 32.822 50.167 22.209 1.00 0.00 C ATOM 7 SD MET A 1 34.273 49.736 23.202 1.00 0.00 S ATOM 8 CE MET A 1 34.144 47.930 23.183 1.00 0.00 C ATOM 0 H1 MET A 1 31.677 52.264 19.788 1.00 0.00 H new ATOM 0 H2 MET A 1 33.093 53.013 19.227 1.00 0.00 H new ATOM 0 H3 MET A 1 33.094 51.352 19.580 1.00 0.00 H new ATOM 0 HA MET A 1 32.744 53.566 21.514 1.00 0.00 H new ATOM 0 HB2 MET A 1 32.654 52.019 23.253 1.00 0.00 H new ATOM 0 HB3 MET A 1 31.358 51.715 22.112 1.00 0.00 H new ATOM 0 HG2 MET A 1 31.974 49.574 22.552 1.00 0.00 H new ATOM 0 HG3 MET A 1 33.010 49.885 21.173 1.00 0.00 H new ATOM 0 HE1 MET A 1 34.967 47.500 23.753 1.00 0.00 H new ATOM 0 HE2 MET A 1 33.197 47.628 23.630 1.00 0.00 H new ATOM 0 HE3 MET A 1 34.190 47.573 22.154 1.00 0.00 H new ATOM 20 N GLN A 2 35.195 53.193 22.393 1.00 0.00 N ATOM 21 CA GLN A 2 36.629 53.346 22.530 1.00 0.00 C ATOM 22 C GLN A 2 37.218 52.526 23.679 1.00 0.00 C ATOM 23 O GLN A 2 36.597 52.398 24.732 1.00 0.00 O ATOM 24 CB GLN A 2 36.999 54.827 22.569 1.00 0.00 C ATOM 25 CG GLN A 2 36.638 55.552 23.862 1.00 0.00 C ATOM 26 CD GLN A 2 36.878 57.062 23.789 1.00 0.00 C ATOM 27 OE1 GLN A 2 37.184 57.644 22.751 1.00 0.00 O ATOM 28 NE2 GLN A 2 36.755 57.771 24.907 1.00 0.00 N ATOM 0 H GLN A 2 34.662 53.584 23.170 1.00 0.00 H new ATOM 0 HA GLN A 2 37.100 52.920 21.644 1.00 0.00 H new ATOM 0 HB2 GLN A 2 38.073 54.921 22.406 1.00 0.00 H new ATOM 0 HB3 GLN A 2 36.505 55.331 21.738 1.00 0.00 H new ATOM 0 HG2 GLN A 2 35.589 55.367 24.095 1.00 0.00 H new ATOM 0 HG3 GLN A 2 37.224 55.136 24.681 1.00 0.00 H new ATOM 0 HE21 GLN A 2 36.502 57.307 25.780 1.00 0.00 H new ATOM 0 HE22 GLN A 2 36.914 58.778 24.892 1.00 0.00 H new ATOM 37 N ILE A 3 38.428 52.008 23.490 1.00 0.00 N ATOM 38 CA ILE A 3 39.241 51.379 24.510 1.00 0.00 C ATOM 39 C ILE A 3 40.656 51.963 24.504 1.00 0.00 C ATOM 40 O ILE A 3 41.064 52.605 23.539 1.00 0.00 O ATOM 41 CB ILE A 3 39.255 49.858 24.384 1.00 0.00 C ATOM 42 CG1 ILE A 3 39.882 49.383 23.076 1.00 0.00 C ATOM 43 CG2 ILE A 3 37.860 49.283 24.607 1.00 0.00 C ATOM 44 CD1 ILE A 3 40.035 47.869 22.970 1.00 0.00 C ATOM 0 H ILE A 3 38.884 52.019 22.578 1.00 0.00 H new ATOM 0 HA ILE A 3 38.787 51.600 25.476 1.00 0.00 H new ATOM 0 HB ILE A 3 39.899 49.471 25.173 1.00 0.00 H new ATOM 0 HG12 ILE A 3 39.271 49.734 22.245 1.00 0.00 H new ATOM 0 HG13 ILE A 3 40.863 49.845 22.968 1.00 0.00 H new ATOM 0 HG21 ILE A 3 37.894 48.198 24.512 1.00 0.00 H new ATOM 0 HG22 ILE A 3 37.512 49.549 25.605 1.00 0.00 H new ATOM 0 HG23 ILE A 3 37.175 49.691 23.863 1.00 0.00 H new ATOM 0 HD11 ILE A 3 40.488 47.615 22.012 1.00 0.00 H new ATOM 0 HD12 ILE A 3 40.672 47.510 23.779 1.00 0.00 H new ATOM 0 HD13 ILE A 3 39.055 47.398 23.044 1.00 0.00 H new ATOM 56 N PHE A 4 41.420 51.716 25.564 1.00 0.00 N ATOM 57 CA PHE A 4 42.778 52.202 25.699 1.00 0.00 C ATOM 58 C PHE A 4 43.778 51.057 25.875 1.00 0.00 C ATOM 59 O PHE A 4 43.579 50.188 26.722 1.00 0.00 O ATOM 60 CB PHE A 4 42.871 53.161 26.883 1.00 0.00 C ATOM 61 CG PHE A 4 41.952 54.358 26.832 1.00 0.00 C ATOM 62 CD1 PHE A 4 42.217 55.404 25.940 1.00 0.00 C ATOM 63 CD2 PHE A 4 40.849 54.441 27.690 1.00 0.00 C ATOM 64 CE1 PHE A 4 41.394 56.536 25.912 1.00 0.00 C ATOM 65 CE2 PHE A 4 40.023 55.571 27.658 1.00 0.00 C ATOM 66 CZ PHE A 4 40.292 56.620 26.772 1.00 0.00 C ATOM 0 H PHE A 4 41.103 51.164 26.361 1.00 0.00 H new ATOM 0 HA PHE A 4 43.035 52.727 24.779 1.00 0.00 H new ATOM 0 HB2 PHE A 4 42.660 52.603 27.796 1.00 0.00 H new ATOM 0 HB3 PHE A 4 43.898 53.518 26.958 1.00 0.00 H new ATOM 0 HD1 PHE A 4 43.061 55.337 25.270 1.00 0.00 H new ATOM 0 HD2 PHE A 4 40.635 53.634 28.376 1.00 0.00 H new ATOM 0 HE1 PHE A 4 41.609 57.344 25.228 1.00 0.00 H new ATOM 0 HE2 PHE A 4 39.173 55.633 28.321 1.00 0.00 H new ATOM 0 HZ PHE A 4 39.653 57.490 26.751 1.00 0.00 H new ATOM 76 N VAL A 5 44.900 51.099 25.163 1.00 0.00 N ATOM 77 CA VAL A 5 46.115 50.430 25.581 1.00 0.00 C ATOM 78 C VAL A 5 46.960 51.452 26.347 1.00 0.00 C ATOM 79 O VAL A 5 47.232 52.531 25.825 1.00 0.00 O ATOM 80 CB VAL A 5 46.869 49.811 24.407 1.00 0.00 C ATOM 81 CG1 VAL A 5 48.208 49.217 24.832 1.00 0.00 C ATOM 82 CG2 VAL A 5 46.056 48.678 23.786 1.00 0.00 C ATOM 0 H VAL A 5 44.987 51.600 24.279 1.00 0.00 H new ATOM 0 HA VAL A 5 45.874 49.588 26.230 1.00 0.00 H new ATOM 0 HB VAL A 5 47.034 50.619 23.694 1.00 0.00 H new ATOM 0 HG11 VAL A 5 48.708 48.788 23.963 1.00 0.00 H new ATOM 0 HG12 VAL A 5 48.833 50.000 25.261 1.00 0.00 H new ATOM 0 HG13 VAL A 5 48.041 48.438 25.576 1.00 0.00 H new ATOM 0 HG21 VAL A 5 46.609 48.249 22.951 1.00 0.00 H new ATOM 0 HG22 VAL A 5 45.874 47.907 24.535 1.00 0.00 H new ATOM 0 HG23 VAL A 5 45.103 49.068 23.428 1.00 0.00 H new ATOM 92 N LYS A 6 47.344 51.121 27.576 1.00 0.00 N ATOM 93 CA LYS A 6 48.046 52.011 28.478 1.00 0.00 C ATOM 94 C LYS A 6 49.322 51.350 29.007 1.00 0.00 C ATOM 95 O LYS A 6 49.283 50.195 29.423 1.00 0.00 O ATOM 96 CB LYS A 6 47.144 52.475 29.618 1.00 0.00 C ATOM 97 CG LYS A 6 45.856 53.128 29.126 1.00 0.00 C ATOM 98 CD LYS A 6 45.030 53.774 30.235 1.00 0.00 C ATOM 99 CE LYS A 6 45.644 55.077 30.738 1.00 0.00 C ATOM 100 NZ LYS A 6 44.878 55.641 31.860 1.00 0.00 N ATOM 0 H LYS A 6 47.168 50.200 27.977 1.00 0.00 H new ATOM 0 HA LYS A 6 48.336 52.899 27.916 1.00 0.00 H new ATOM 0 HB2 LYS A 6 46.895 51.621 30.248 1.00 0.00 H new ATOM 0 HB3 LYS A 6 47.690 53.183 30.241 1.00 0.00 H new ATOM 0 HG2 LYS A 6 46.105 53.886 28.383 1.00 0.00 H new ATOM 0 HG3 LYS A 6 45.247 52.376 28.624 1.00 0.00 H new ATOM 0 HD2 LYS A 6 44.023 53.969 29.867 1.00 0.00 H new ATOM 0 HD3 LYS A 6 44.935 53.076 31.067 1.00 0.00 H new ATOM 0 HE2 LYS A 6 46.672 54.897 31.053 1.00 0.00 H new ATOM 0 HE3 LYS A 6 45.682 55.800 29.923 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 45.325 56.526 32.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 43.904 55.836 31.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 44.863 54.961 32.647 1.00 0.00 H new ATOM 168 N LYS A 11 51.988 56.186 29.069 1.00 0.00 N ATOM 169 CA LYS A 11 51.585 56.511 27.715 1.00 0.00 C ATOM 170 C LYS A 11 50.291 55.784 27.346 1.00 0.00 C ATOM 171 O LYS A 11 50.120 54.626 27.720 1.00 0.00 O ATOM 172 CB LYS A 11 52.736 56.170 26.773 1.00 0.00 C ATOM 173 CG LYS A 11 52.388 56.296 25.293 1.00 0.00 C ATOM 174 CD LYS A 11 53.645 56.131 24.444 1.00 0.00 C ATOM 175 CE LYS A 11 53.300 56.041 22.960 1.00 0.00 C ATOM 176 NZ LYS A 11 54.520 55.948 22.143 1.00 0.00 N ATOM 0 HA LYS A 11 51.370 57.576 27.628 1.00 0.00 H new ATOM 0 HB2 LYS A 11 53.579 56.825 26.994 1.00 0.00 H new ATOM 0 HB3 LYS A 11 53.065 55.150 26.972 1.00 0.00 H new ATOM 0 HG2 LYS A 11 51.652 55.540 25.019 1.00 0.00 H new ATOM 0 HG3 LYS A 11 51.934 57.268 25.099 1.00 0.00 H new ATOM 0 HD2 LYS A 11 54.315 56.974 24.614 1.00 0.00 H new ATOM 0 HD3 LYS A 11 54.179 55.232 24.751 1.00 0.00 H new ATOM 0 HE2 LYS A 11 52.670 55.170 22.781 1.00 0.00 H new ATOM 0 HE3 LYS A 11 52.724 56.917 22.662 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 54.299 55.478 21.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 54.886 56.903 21.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 55.239 55.397 22.654 1.00 0.00 H new ATOM 190 N THR A 12 49.418 56.422 26.571 1.00 0.00 N ATOM 191 CA THR A 12 48.137 55.886 26.155 1.00 0.00 C ATOM 192 C THR A 12 47.956 55.884 24.636 1.00 0.00 C ATOM 193 O THR A 12 48.319 56.837 23.951 1.00 0.00 O ATOM 194 CB THR A 12 46.998 56.637 26.838 1.00 0.00 C ATOM 195 OG1 THR A 12 47.059 56.399 28.226 1.00 0.00 O ATOM 196 CG2 THR A 12 45.600 56.213 26.396 1.00 0.00 C ATOM 0 H THR A 12 49.595 57.358 26.206 1.00 0.00 H new ATOM 0 HA THR A 12 48.114 54.842 26.468 1.00 0.00 H new ATOM 0 HB THR A 12 47.138 57.682 26.563 1.00 0.00 H new ATOM 0 HG1 THR A 12 46.735 57.188 28.708 1.00 0.00 H new ATOM 0 HG21 THR A 12 44.855 56.800 26.933 1.00 0.00 H new ATOM 0 HG22 THR A 12 45.490 56.381 25.325 1.00 0.00 H new ATOM 0 HG23 THR A 12 45.455 55.155 26.614 1.00 0.00 H new ATOM 204 N ILE A 13 47.350 54.819 24.119 1.00 0.00 N ATOM 205 CA ILE A 13 46.913 54.642 22.749 1.00 0.00 C ATOM 206 C ILE A 13 45.397 54.430 22.749 1.00 0.00 C ATOM 207 O ILE A 13 44.916 53.430 23.278 1.00 0.00 O ATOM 208 CB ILE A 13 47.661 53.493 22.080 1.00 0.00 C ATOM 209 CG1 ILE A 13 49.178 53.659 22.084 1.00 0.00 C ATOM 210 CG2 ILE A 13 47.212 53.355 20.628 1.00 0.00 C ATOM 211 CD1 ILE A 13 49.896 53.079 23.299 1.00 0.00 C ATOM 0 H ILE A 13 47.139 54.002 24.692 1.00 0.00 H new ATOM 0 HA ILE A 13 47.142 55.532 22.163 1.00 0.00 H new ATOM 0 HB ILE A 13 47.420 52.606 22.666 1.00 0.00 H new ATOM 0 HG12 ILE A 13 49.580 53.189 21.187 1.00 0.00 H new ATOM 0 HG13 ILE A 13 49.411 54.722 22.019 1.00 0.00 H new ATOM 0 HG21 ILE A 13 47.751 52.533 20.157 1.00 0.00 H new ATOM 0 HG22 ILE A 13 46.141 53.153 20.596 1.00 0.00 H new ATOM 0 HG23 ILE A 13 47.423 54.281 20.092 1.00 0.00 H new ATOM 0 HD11 ILE A 13 50.968 53.250 23.204 1.00 0.00 H new ATOM 0 HD12 ILE A 13 49.530 53.565 24.204 1.00 0.00 H new ATOM 0 HD13 ILE A 13 49.703 52.008 23.359 1.00 0.00 H new ATOM 223 N THR A 14 44.654 55.361 22.158 1.00 0.00 N ATOM 224 CA THR A 14 43.212 55.312 22.031 1.00 0.00 C ATOM 225 C THR A 14 42.808 54.535 20.776 1.00 0.00 C ATOM 226 O THR A 14 43.274 54.864 19.687 1.00 0.00 O ATOM 227 CB THR A 14 42.595 56.705 21.951 1.00 0.00 C ATOM 228 OG1 THR A 14 43.103 57.560 22.951 1.00 0.00 O ATOM 229 CG2 THR A 14 41.077 56.672 22.104 1.00 0.00 C ATOM 0 H THR A 14 45.060 56.199 21.741 1.00 0.00 H new ATOM 0 HA THR A 14 42.839 54.812 22.925 1.00 0.00 H new ATOM 0 HB THR A 14 42.859 57.082 20.963 1.00 0.00 H new ATOM 0 HG1 THR A 14 42.687 58.443 22.868 1.00 0.00 H new ATOM 0 HG21 THR A 14 40.683 57.686 22.040 1.00 0.00 H new ATOM 0 HG22 THR A 14 40.644 56.064 21.309 1.00 0.00 H new ATOM 0 HG23 THR A 14 40.818 56.242 23.072 1.00 0.00 H new ATOM 237 N LEU A 15 41.949 53.529 20.912 1.00 0.00 N ATOM 238 CA LEU A 15 41.530 52.661 19.830 1.00 0.00 C ATOM 239 C LEU A 15 40.005 52.648 19.712 1.00 0.00 C ATOM 240 O LEU A 15 39.308 52.445 20.703 1.00 0.00 O ATOM 241 CB LEU A 15 42.081 51.257 20.068 1.00 0.00 C ATOM 242 CG LEU A 15 43.599 51.164 20.197 1.00 0.00 C ATOM 243 CD1 LEU A 15 43.994 49.742 20.587 1.00 0.00 C ATOM 244 CD2 LEU A 15 44.328 51.510 18.902 1.00 0.00 C ATOM 0 H LEU A 15 41.516 53.293 21.805 1.00 0.00 H new ATOM 0 HA LEU A 15 41.926 53.037 18.887 1.00 0.00 H new ATOM 0 HB2 LEU A 15 41.631 50.857 20.977 1.00 0.00 H new ATOM 0 HB3 LEU A 15 41.763 50.616 19.246 1.00 0.00 H new ATOM 0 HG LEU A 15 43.889 51.888 20.959 1.00 0.00 H new ATOM 0 HD11 LEU A 15 45.078 49.678 20.679 1.00 0.00 H new ATOM 0 HD12 LEU A 15 43.533 49.485 21.541 1.00 0.00 H new ATOM 0 HD13 LEU A 15 43.653 49.046 19.820 1.00 0.00 H new ATOM 0 HD21 LEU A 15 45.404 51.426 19.056 1.00 0.00 H new ATOM 0 HD22 LEU A 15 44.019 50.821 18.116 1.00 0.00 H new ATOM 0 HD23 LEU A 15 44.082 52.530 18.608 1.00 0.00 H new ATOM 256 N GLU A 16 39.496 52.834 18.498 1.00 0.00 N ATOM 257 CA GLU A 16 38.079 52.812 18.198 1.00 0.00 C ATOM 258 C GLU A 16 37.687 51.436 17.658 1.00 0.00 C ATOM 259 O GLU A 16 38.320 50.902 16.749 1.00 0.00 O ATOM 260 CB GLU A 16 37.753 53.983 17.274 1.00 0.00 C ATOM 261 CG GLU A 16 36.289 54.123 16.870 1.00 0.00 C ATOM 262 CD GLU A 16 35.306 54.391 18.012 1.00 0.00 C ATOM 263 OE1 GLU A 16 35.567 55.251 18.880 1.00 0.00 O ATOM 264 OE2 GLU A 16 34.193 53.824 17.971 1.00 0.00 O ATOM 0 H GLU A 16 40.078 53.008 17.678 1.00 0.00 H new ATOM 0 HA GLU A 16 37.473 52.952 19.093 1.00 0.00 H new ATOM 0 HB2 GLU A 16 38.065 54.905 17.764 1.00 0.00 H new ATOM 0 HB3 GLU A 16 38.352 53.885 16.369 1.00 0.00 H new ATOM 0 HG2 GLU A 16 36.207 54.935 16.147 1.00 0.00 H new ATOM 0 HG3 GLU A 16 35.984 53.210 16.360 1.00 0.00 H new ATOM 271 N VAL A 17 36.692 50.821 18.290 1.00 0.00 N ATOM 272 CA VAL A 17 36.348 49.417 18.189 1.00 0.00 C ATOM 273 C VAL A 17 34.841 49.198 18.337 1.00 0.00 C ATOM 274 O VAL A 17 34.091 50.083 18.743 1.00 0.00 O ATOM 275 CB VAL A 17 37.094 48.601 19.240 1.00 0.00 C ATOM 276 CG1 VAL A 17 38.601 48.545 19.006 1.00 0.00 C ATOM 277 CG2 VAL A 17 36.839 49.094 20.661 1.00 0.00 C ATOM 0 H VAL A 17 36.071 51.325 18.923 1.00 0.00 H new ATOM 0 HA VAL A 17 36.648 49.080 17.197 1.00 0.00 H new ATOM 0 HB VAL A 17 36.688 47.595 19.131 1.00 0.00 H new ATOM 0 HG11 VAL A 17 39.069 47.949 19.790 1.00 0.00 H new ATOM 0 HG12 VAL A 17 38.802 48.091 18.036 1.00 0.00 H new ATOM 0 HG13 VAL A 17 39.010 49.555 19.025 1.00 0.00 H new ATOM 0 HG21 VAL A 17 37.395 48.476 21.366 1.00 0.00 H new ATOM 0 HG22 VAL A 17 37.165 50.130 20.751 1.00 0.00 H new ATOM 0 HG23 VAL A 17 35.774 49.029 20.883 1.00 0.00 H new ATOM 287 N GLU A 18 34.377 47.982 18.064 1.00 0.00 N ATOM 288 CA GLU A 18 33.042 47.506 18.367 1.00 0.00 C ATOM 289 C GLU A 18 33.140 46.163 19.094 1.00 0.00 C ATOM 290 O GLU A 18 34.144 45.475 18.928 1.00 0.00 O ATOM 291 CB GLU A 18 32.234 47.363 17.082 1.00 0.00 C ATOM 292 CG GLU A 18 32.070 48.621 16.233 1.00 0.00 C ATOM 293 CD GLU A 18 31.212 49.709 16.883 1.00 0.00 C ATOM 294 OE1 GLU A 18 31.484 50.912 16.685 1.00 0.00 O ATOM 295 OE2 GLU A 18 30.188 49.395 17.528 1.00 0.00 O ATOM 0 H GLU A 18 34.951 47.275 17.605 1.00 0.00 H new ATOM 0 HA GLU A 18 32.534 48.224 19.011 1.00 0.00 H new ATOM 0 HB2 GLU A 18 32.705 46.596 16.467 1.00 0.00 H new ATOM 0 HB3 GLU A 18 31.241 46.997 17.343 1.00 0.00 H new ATOM 0 HG2 GLU A 18 33.056 49.032 16.018 1.00 0.00 H new ATOM 0 HG3 GLU A 18 31.624 48.345 15.277 1.00 0.00 H new ATOM 302 N PRO A 19 32.159 45.728 19.880 1.00 0.00 N ATOM 303 CA PRO A 19 32.260 44.494 20.633 1.00 0.00 C ATOM 304 C PRO A 19 32.500 43.217 19.826 1.00 0.00 C ATOM 305 O PRO A 19 33.133 42.297 20.340 1.00 0.00 O ATOM 306 CB PRO A 19 30.981 44.404 21.459 1.00 0.00 C ATOM 307 CG PRO A 19 30.626 45.873 21.679 1.00 0.00 C ATOM 308 CD PRO A 19 31.022 46.496 20.343 1.00 0.00 C ATOM 0 HA PRO A 19 33.163 44.545 21.241 1.00 0.00 H new ATOM 0 HB2 PRO A 19 30.192 43.871 20.929 1.00 0.00 H new ATOM 0 HB3 PRO A 19 31.142 43.880 22.401 1.00 0.00 H new ATOM 0 HG2 PRO A 19 29.566 46.009 21.895 1.00 0.00 H new ATOM 0 HG3 PRO A 19 31.179 46.307 22.512 1.00 0.00 H new ATOM 0 HD2 PRO A 19 30.200 46.449 19.629 1.00 0.00 H new ATOM 0 HD3 PRO A 19 31.281 47.548 20.462 1.00 0.00 H new ATOM 316 N SER A 20 32.047 43.139 18.578 1.00 0.00 N ATOM 317 CA SER A 20 32.344 42.049 17.671 1.00 0.00 C ATOM 318 C SER A 20 33.616 42.238 16.844 1.00 0.00 C ATOM 319 O SER A 20 33.818 41.534 15.857 1.00 0.00 O ATOM 320 CB SER A 20 31.145 41.720 16.787 1.00 0.00 C ATOM 321 OG SER A 20 30.054 41.257 17.551 1.00 0.00 O ATOM 0 H SER A 20 31.448 43.854 18.165 1.00 0.00 H new ATOM 0 HA SER A 20 32.550 41.192 18.312 1.00 0.00 H new ATOM 0 HB2 SER A 20 30.849 42.608 16.228 1.00 0.00 H new ATOM 0 HB3 SER A 20 31.427 40.962 16.056 1.00 0.00 H new ATOM 0 HG SER A 20 29.301 41.056 16.957 1.00 0.00 H new ATOM 327 N ASP A 21 34.485 43.182 17.194 1.00 0.00 N ATOM 328 CA ASP A 21 35.814 43.329 16.633 1.00 0.00 C ATOM 329 C ASP A 21 36.833 42.469 17.384 1.00 0.00 C ATOM 330 O ASP A 21 36.643 42.149 18.555 1.00 0.00 O ATOM 331 CB ASP A 21 36.203 44.804 16.599 1.00 0.00 C ATOM 332 CG ASP A 21 37.195 45.170 15.493 1.00 0.00 C ATOM 333 OD1 ASP A 21 37.497 44.324 14.624 1.00 0.00 O ATOM 334 OD2 ASP A 21 37.603 46.350 15.438 1.00 0.00 O ATOM 0 H ASP A 21 34.271 43.887 17.900 1.00 0.00 H new ATOM 0 HA ASP A 21 35.809 42.965 15.606 1.00 0.00 H new ATOM 0 HB2 ASP A 21 35.301 45.403 16.474 1.00 0.00 H new ATOM 0 HB3 ASP A 21 36.635 45.076 17.562 1.00 0.00 H new ATOM 339 N THR A 22 37.911 42.071 16.713 1.00 0.00 N ATOM 340 CA THR A 22 38.834 41.049 17.164 1.00 0.00 C ATOM 341 C THR A 22 40.203 41.577 17.599 1.00 0.00 C ATOM 342 O THR A 22 40.635 42.648 17.178 1.00 0.00 O ATOM 343 CB THR A 22 39.022 39.937 16.135 1.00 0.00 C ATOM 344 OG1 THR A 22 39.389 40.454 14.876 1.00 0.00 O ATOM 345 CG2 THR A 22 37.757 39.110 15.930 1.00 0.00 C ATOM 0 H THR A 22 38.169 42.469 15.810 1.00 0.00 H new ATOM 0 HA THR A 22 38.352 40.641 18.052 1.00 0.00 H new ATOM 0 HB THR A 22 39.813 39.305 16.539 1.00 0.00 H new ATOM 0 HG1 THR A 22 39.503 39.717 14.240 1.00 0.00 H new ATOM 0 HG21 THR A 22 37.946 38.334 15.189 1.00 0.00 H new ATOM 0 HG22 THR A 22 37.468 38.648 16.874 1.00 0.00 H new ATOM 0 HG23 THR A 22 36.952 39.757 15.581 1.00 0.00 H new ATOM 353 N ILE A 23 40.914 40.804 18.414 1.00 0.00 N ATOM 354 CA ILE A 23 42.225 41.155 18.921 1.00 0.00 C ATOM 355 C ILE A 23 43.257 41.300 17.801 1.00 0.00 C ATOM 356 O ILE A 23 44.119 42.172 17.890 1.00 0.00 O ATOM 357 CB ILE A 23 42.655 40.161 19.997 1.00 0.00 C ATOM 358 CG1 ILE A 23 41.712 40.097 21.195 1.00 0.00 C ATOM 359 CG2 ILE A 23 44.078 40.401 20.491 1.00 0.00 C ATOM 360 CD1 ILE A 23 41.448 41.408 21.931 1.00 0.00 C ATOM 0 H ILE A 23 40.583 39.898 18.744 1.00 0.00 H new ATOM 0 HA ILE A 23 42.162 42.139 19.386 1.00 0.00 H new ATOM 0 HB ILE A 23 42.613 39.198 19.489 1.00 0.00 H new ATOM 0 HG12 ILE A 23 40.756 39.700 20.854 1.00 0.00 H new ATOM 0 HG13 ILE A 23 42.118 39.381 21.910 1.00 0.00 H new ATOM 0 HG21 ILE A 23 44.327 39.664 21.254 1.00 0.00 H new ATOM 0 HG22 ILE A 23 44.773 40.309 19.657 1.00 0.00 H new ATOM 0 HG23 ILE A 23 44.152 41.402 20.915 1.00 0.00 H new ATOM 0 HD11 ILE A 23 40.764 41.228 22.760 1.00 0.00 H new ATOM 0 HD12 ILE A 23 42.388 41.805 22.315 1.00 0.00 H new ATOM 0 HD13 ILE A 23 41.004 42.128 21.244 1.00 0.00 H new ATOM 372 N GLU A 24 43.158 40.541 16.714 1.00 0.00 N ATOM 373 CA GLU A 24 43.986 40.733 15.541 1.00 0.00 C ATOM 374 C GLU A 24 43.796 42.122 14.928 1.00 0.00 C ATOM 375 O GLU A 24 44.783 42.777 14.602 1.00 0.00 O ATOM 376 CB GLU A 24 43.703 39.639 14.516 1.00 0.00 C ATOM 377 CG GLU A 24 44.630 39.736 13.307 1.00 0.00 C ATOM 378 CD GLU A 24 44.594 38.479 12.436 1.00 0.00 C ATOM 379 OE1 GLU A 24 45.635 37.799 12.315 1.00 0.00 O ATOM 380 OE2 GLU A 24 43.537 38.170 11.844 1.00 0.00 O ATOM 0 H GLU A 24 42.494 39.771 16.628 1.00 0.00 H new ATOM 0 HA GLU A 24 45.028 40.664 15.852 1.00 0.00 H new ATOM 0 HB2 GLU A 24 43.821 38.663 14.986 1.00 0.00 H new ATOM 0 HB3 GLU A 24 42.667 39.711 14.185 1.00 0.00 H new ATOM 0 HG2 GLU A 24 44.346 40.599 12.705 1.00 0.00 H new ATOM 0 HG3 GLU A 24 45.651 39.907 13.649 1.00 0.00 H new ATOM 387 N ASN A 25 42.562 42.610 14.847 1.00 0.00 N ATOM 388 CA ASN A 25 42.294 43.957 14.384 1.00 0.00 C ATOM 389 C ASN A 25 42.774 45.008 15.387 1.00 0.00 C ATOM 390 O ASN A 25 43.353 46.014 14.981 1.00 0.00 O ATOM 391 CB ASN A 25 40.818 44.139 14.040 1.00 0.00 C ATOM 392 CG ASN A 25 40.586 45.360 13.148 1.00 0.00 C ATOM 393 OD1 ASN A 25 41.495 45.942 12.559 1.00 0.00 O ATOM 394 ND2 ASN A 25 39.344 45.812 13.005 1.00 0.00 N ATOM 0 H ASN A 25 41.727 42.082 15.100 1.00 0.00 H new ATOM 0 HA ASN A 25 42.866 44.108 13.468 1.00 0.00 H new ATOM 0 HB2 ASN A 25 40.450 43.246 13.535 1.00 0.00 H new ATOM 0 HB3 ASN A 25 40.242 44.246 14.959 1.00 0.00 H new ATOM 0 HD21 ASN A 25 39.162 46.625 12.417 1.00 0.00 H new ATOM 0 HD22 ASN A 25 38.573 45.346 13.484 1.00 0.00 H new ATOM 401 N VAL A 26 42.628 44.779 16.688 1.00 0.00 N ATOM 402 CA VAL A 26 43.185 45.640 17.714 1.00 0.00 C ATOM 403 C VAL A 26 44.697 45.802 17.539 1.00 0.00 C ATOM 404 O VAL A 26 45.185 46.929 17.504 1.00 0.00 O ATOM 405 CB VAL A 26 42.817 45.141 19.108 1.00 0.00 C ATOM 406 CG1 VAL A 26 43.536 45.861 20.245 1.00 0.00 C ATOM 407 CG2 VAL A 26 41.319 45.297 19.359 1.00 0.00 C ATOM 0 H VAL A 26 42.113 43.980 17.059 1.00 0.00 H new ATOM 0 HA VAL A 26 42.744 46.631 17.602 1.00 0.00 H new ATOM 0 HB VAL A 26 43.128 44.096 19.113 1.00 0.00 H new ATOM 0 HG11 VAL A 26 43.216 45.444 21.200 1.00 0.00 H new ATOM 0 HG12 VAL A 26 44.613 45.731 20.135 1.00 0.00 H new ATOM 0 HG13 VAL A 26 43.294 46.923 20.214 1.00 0.00 H new ATOM 0 HG21 VAL A 26 41.078 44.935 20.359 1.00 0.00 H new ATOM 0 HG22 VAL A 26 41.044 46.349 19.278 1.00 0.00 H new ATOM 0 HG23 VAL A 26 40.764 44.719 18.620 1.00 0.00 H new ATOM 417 N LYS A 27 45.441 44.718 17.339 1.00 0.00 N ATOM 418 CA LYS A 27 46.867 44.756 17.083 1.00 0.00 C ATOM 419 C LYS A 27 47.217 45.417 15.748 1.00 0.00 C ATOM 420 O LYS A 27 48.180 46.177 15.687 1.00 0.00 O ATOM 421 CB LYS A 27 47.447 43.348 17.173 1.00 0.00 C ATOM 422 CG LYS A 27 47.456 42.795 18.595 1.00 0.00 C ATOM 423 CD LYS A 27 47.880 41.329 18.562 1.00 0.00 C ATOM 424 CE LYS A 27 47.918 40.685 19.945 1.00 0.00 C ATOM 425 NZ LYS A 27 48.444 39.315 19.851 1.00 0.00 N ATOM 0 H LYS A 27 45.057 43.773 17.352 1.00 0.00 H new ATOM 0 HA LYS A 27 47.320 45.381 17.852 1.00 0.00 H new ATOM 0 HB2 LYS A 27 46.868 42.681 16.534 1.00 0.00 H new ATOM 0 HB3 LYS A 27 48.466 43.356 16.786 1.00 0.00 H new ATOM 0 HG2 LYS A 27 48.142 43.370 19.217 1.00 0.00 H new ATOM 0 HG3 LYS A 27 46.466 42.889 19.041 1.00 0.00 H new ATOM 0 HD2 LYS A 27 47.191 40.772 17.927 1.00 0.00 H new ATOM 0 HD3 LYS A 27 48.867 41.253 18.105 1.00 0.00 H new ATOM 0 HE2 LYS A 27 48.543 41.277 20.613 1.00 0.00 H new ATOM 0 HE3 LYS A 27 46.917 40.670 20.375 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 48.146 38.771 20.686 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 48.075 38.860 18.992 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 49.483 39.344 19.809 1.00 0.00 H new ATOM 439 N ALA A 28 46.419 45.220 14.703 1.00 0.00 N ATOM 440 CA ALA A 28 46.596 45.885 13.428 1.00 0.00 C ATOM 441 C ALA A 28 46.298 47.385 13.485 1.00 0.00 C ATOM 442 O ALA A 28 46.978 48.174 12.833 1.00 0.00 O ATOM 443 CB ALA A 28 45.745 45.161 12.387 1.00 0.00 C ATOM 0 H ALA A 28 45.622 44.584 14.724 1.00 0.00 H new ATOM 0 HA ALA A 28 47.647 45.828 13.145 1.00 0.00 H new ATOM 0 HB1 ALA A 28 45.864 45.646 11.418 1.00 0.00 H new ATOM 0 HB2 ALA A 28 46.066 44.122 12.314 1.00 0.00 H new ATOM 0 HB3 ALA A 28 44.697 45.197 12.685 1.00 0.00 H new ATOM 449 N LYS A 29 45.350 47.823 14.309 1.00 0.00 N ATOM 450 CA LYS A 29 45.073 49.216 14.598 1.00 0.00 C ATOM 451 C LYS A 29 46.212 49.853 15.397 1.00 0.00 C ATOM 452 O LYS A 29 46.570 50.999 15.137 1.00 0.00 O ATOM 453 CB LYS A 29 43.736 49.341 15.322 1.00 0.00 C ATOM 454 CG LYS A 29 42.530 49.137 14.410 1.00 0.00 C ATOM 455 CD LYS A 29 41.217 49.044 15.182 1.00 0.00 C ATOM 456 CE LYS A 29 40.069 48.913 14.183 1.00 0.00 C ATOM 457 NZ LYS A 29 38.742 48.811 14.809 1.00 0.00 N ATOM 0 H LYS A 29 44.732 47.186 14.811 1.00 0.00 H new ATOM 0 HA LYS A 29 45.003 49.762 13.657 1.00 0.00 H new ATOM 0 HB2 LYS A 29 43.699 48.610 16.129 1.00 0.00 H new ATOM 0 HB3 LYS A 29 43.671 50.327 15.782 1.00 0.00 H new ATOM 0 HG2 LYS A 29 42.472 49.963 13.701 1.00 0.00 H new ATOM 0 HG3 LYS A 29 42.670 48.226 13.828 1.00 0.00 H new ATOM 0 HD2 LYS A 29 41.233 48.185 15.853 1.00 0.00 H new ATOM 0 HD3 LYS A 29 41.079 49.930 15.801 1.00 0.00 H new ATOM 0 HE2 LYS A 29 40.080 49.776 13.517 1.00 0.00 H new ATOM 0 HE3 LYS A 29 40.237 48.031 13.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 38.010 49.063 14.114 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 38.587 47.836 15.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 38.689 49.462 15.619 1.00 0.00 H new ATOM 471 N ILE A 30 46.838 49.110 16.304 1.00 0.00 N ATOM 472 CA ILE A 30 48.036 49.531 17.003 1.00 0.00 C ATOM 473 C ILE A 30 49.243 49.615 16.068 1.00 0.00 C ATOM 474 O ILE A 30 50.067 50.510 16.250 1.00 0.00 O ATOM 475 CB ILE A 30 48.302 48.644 18.216 1.00 0.00 C ATOM 476 CG1 ILE A 30 47.197 48.783 19.260 1.00 0.00 C ATOM 477 CG2 ILE A 30 49.648 48.952 18.865 1.00 0.00 C ATOM 478 CD1 ILE A 30 47.126 47.609 20.231 1.00 0.00 C ATOM 0 H ILE A 30 46.516 48.181 16.575 1.00 0.00 H new ATOM 0 HA ILE A 30 47.866 50.542 17.373 1.00 0.00 H new ATOM 0 HB ILE A 30 48.321 47.618 17.847 1.00 0.00 H new ATOM 0 HG12 ILE A 30 47.355 49.702 19.824 1.00 0.00 H new ATOM 0 HG13 ILE A 30 46.238 48.882 18.751 1.00 0.00 H new ATOM 0 HG21 ILE A 30 49.796 48.298 19.724 1.00 0.00 H new ATOM 0 HG22 ILE A 30 50.447 48.788 18.142 1.00 0.00 H new ATOM 0 HG23 ILE A 30 49.664 49.991 19.194 1.00 0.00 H new ATOM 0 HD11 ILE A 30 46.319 47.775 20.944 1.00 0.00 H new ATOM 0 HD12 ILE A 30 46.937 46.690 19.677 1.00 0.00 H new ATOM 0 HD13 ILE A 30 48.071 47.522 20.767 1.00 0.00 H new ATOM 490 N GLN A 31 49.366 48.770 15.048 1.00 0.00 N ATOM 491 CA GLN A 31 50.417 48.901 14.059 1.00 0.00 C ATOM 492 C GLN A 31 50.229 50.145 13.189 1.00 0.00 C ATOM 493 O GLN A 31 51.198 50.859 12.945 1.00 0.00 O ATOM 494 CB GLN A 31 50.541 47.634 13.217 1.00 0.00 C ATOM 495 CG GLN A 31 51.787 47.683 12.339 1.00 0.00 C ATOM 496 CD GLN A 31 52.062 46.375 11.593 1.00 0.00 C ATOM 497 OE1 GLN A 31 51.189 45.541 11.362 1.00 0.00 O ATOM 498 NE2 GLN A 31 53.309 46.128 11.202 1.00 0.00 N ATOM 0 H GLN A 31 48.740 47.981 14.889 1.00 0.00 H new ATOM 0 HA GLN A 31 51.357 49.032 14.596 1.00 0.00 H new ATOM 0 HB2 GLN A 31 50.585 46.762 13.869 1.00 0.00 H new ATOM 0 HB3 GLN A 31 49.655 47.520 12.592 1.00 0.00 H new ATOM 0 HG2 GLN A 31 51.679 48.489 11.614 1.00 0.00 H new ATOM 0 HG3 GLN A 31 52.649 47.926 12.960 1.00 0.00 H new ATOM 0 HE21 GLN A 31 54.045 46.809 11.386 1.00 0.00 H new ATOM 0 HE22 GLN A 31 53.529 45.257 10.718 1.00 0.00 H new ATOM 507 N ASP A 32 49.005 50.456 12.773 1.00 0.00 N ATOM 508 CA ASP A 32 48.665 51.686 12.087 1.00 0.00 C ATOM 509 C ASP A 32 49.057 52.938 12.875 1.00 0.00 C ATOM 510 O ASP A 32 49.536 53.904 12.285 1.00 0.00 O ATOM 511 CB ASP A 32 47.177 51.645 11.752 1.00 0.00 C ATOM 512 CG ASP A 32 46.583 53.021 11.440 1.00 0.00 C ATOM 513 OD1 ASP A 32 45.809 53.533 12.278 1.00 0.00 O ATOM 514 OD2 ASP A 32 46.879 53.598 10.371 1.00 0.00 O ATOM 0 H ASP A 32 48.205 49.839 12.910 1.00 0.00 H new ATOM 0 HA ASP A 32 49.245 51.755 11.167 1.00 0.00 H new ATOM 0 HB2 ASP A 32 47.024 50.989 10.895 1.00 0.00 H new ATOM 0 HB3 ASP A 32 46.636 51.206 12.590 1.00 0.00 H new ATOM 519 N LYS A 33 48.930 52.920 14.199 1.00 0.00 N ATOM 520 CA LYS A 33 49.424 53.968 15.068 1.00 0.00 C ATOM 521 C LYS A 33 50.941 53.936 15.269 1.00 0.00 C ATOM 522 O LYS A 33 51.639 54.835 14.806 1.00 0.00 O ATOM 523 CB LYS A 33 48.665 53.987 16.392 1.00 0.00 C ATOM 524 CG LYS A 33 47.169 54.272 16.285 1.00 0.00 C ATOM 525 CD LYS A 33 46.842 55.569 15.549 1.00 0.00 C ATOM 526 CE LYS A 33 45.353 55.893 15.631 1.00 0.00 C ATOM 527 NZ LYS A 33 45.027 57.087 14.837 1.00 0.00 N ATOM 0 H LYS A 33 48.471 52.160 14.701 1.00 0.00 H new ATOM 0 HA LYS A 33 49.228 54.910 14.555 1.00 0.00 H new ATOM 0 HB2 LYS A 33 48.800 53.023 16.882 1.00 0.00 H new ATOM 0 HB3 LYS A 33 49.116 54.740 17.039 1.00 0.00 H new ATOM 0 HG2 LYS A 33 46.686 53.441 15.771 1.00 0.00 H new ATOM 0 HG3 LYS A 33 46.744 54.317 17.288 1.00 0.00 H new ATOM 0 HD2 LYS A 33 47.419 56.388 15.978 1.00 0.00 H new ATOM 0 HD3 LYS A 33 47.140 55.482 14.504 1.00 0.00 H new ATOM 0 HE2 LYS A 33 44.772 55.044 15.271 1.00 0.00 H new ATOM 0 HE3 LYS A 33 45.070 56.055 16.671 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 44.009 57.285 14.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 45.565 57.901 15.197 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 45.277 56.921 13.841 1.00 0.00 H new ATOM 541 N GLU A 34 51.456 52.910 15.940 1.00 0.00 N ATOM 542 CA GLU A 34 52.763 52.879 16.567 1.00 0.00 C ATOM 543 C GLU A 34 53.781 51.940 15.918 1.00 0.00 C ATOM 544 O GLU A 34 54.909 51.840 16.397 1.00 0.00 O ATOM 545 CB GLU A 34 52.569 52.537 18.042 1.00 0.00 C ATOM 546 CG GLU A 34 51.916 53.643 18.865 1.00 0.00 C ATOM 547 CD GLU A 34 52.821 54.873 18.973 1.00 0.00 C ATOM 548 OE1 GLU A 34 53.819 54.822 19.722 1.00 0.00 O ATOM 549 OE2 GLU A 34 52.545 55.897 18.311 1.00 0.00 O ATOM 0 H GLU A 34 50.943 52.037 16.064 1.00 0.00 H new ATOM 0 HA GLU A 34 53.202 53.868 16.434 1.00 0.00 H new ATOM 0 HB2 GLU A 34 51.959 51.637 18.116 1.00 0.00 H new ATOM 0 HB3 GLU A 34 53.540 52.301 18.478 1.00 0.00 H new ATOM 0 HG2 GLU A 34 50.968 53.927 18.407 1.00 0.00 H new ATOM 0 HG3 GLU A 34 51.689 53.269 19.863 1.00 0.00 H new ATOM 556 N GLY A 35 53.414 51.243 14.845 1.00 0.00 N ATOM 557 CA GLY A 35 54.334 50.510 14.000 1.00 0.00 C ATOM 558 C GLY A 35 54.927 49.220 14.573 1.00 0.00 C ATOM 559 O GLY A 35 55.894 48.703 14.018 1.00 0.00 O ATOM 0 H GLY A 35 52.444 51.175 14.538 1.00 0.00 H new ATOM 0 HA2 GLY A 35 53.818 50.263 13.072 1.00 0.00 H new ATOM 0 HA3 GLY A 35 55.158 51.175 13.739 1.00 0.00 H new ATOM 563 N ILE A 36 54.372 48.677 15.654 1.00 0.00 N ATOM 564 CA ILE A 36 54.869 47.478 16.297 1.00 0.00 C ATOM 565 C ILE A 36 54.383 46.248 15.528 1.00 0.00 C ATOM 566 O ILE A 36 53.172 46.127 15.357 1.00 0.00 O ATOM 567 CB ILE A 36 54.458 47.429 17.766 1.00 0.00 C ATOM 568 CG1 ILE A 36 54.929 48.665 18.529 1.00 0.00 C ATOM 569 CG2 ILE A 36 55.011 46.176 18.439 1.00 0.00 C ATOM 570 CD1 ILE A 36 54.283 48.833 19.901 1.00 0.00 C ATOM 0 H ILE A 36 53.549 49.071 16.111 1.00 0.00 H new ATOM 0 HA ILE A 36 55.959 47.488 16.278 1.00 0.00 H new ATOM 0 HB ILE A 36 53.369 47.405 17.791 1.00 0.00 H new ATOM 0 HG12 ILE A 36 56.011 48.612 18.652 1.00 0.00 H new ATOM 0 HG13 ILE A 36 54.719 49.551 17.929 1.00 0.00 H new ATOM 0 HG21 ILE A 36 54.707 46.161 19.485 1.00 0.00 H new ATOM 0 HG22 ILE A 36 54.623 45.291 17.935 1.00 0.00 H new ATOM 0 HG23 ILE A 36 56.099 46.180 18.378 1.00 0.00 H new ATOM 0 HD11 ILE A 36 54.670 49.733 20.378 1.00 0.00 H new ATOM 0 HD12 ILE A 36 53.202 48.919 19.786 1.00 0.00 H new ATOM 0 HD13 ILE A 36 54.514 47.966 20.520 1.00 0.00 H new ATOM 582 N PRO A 37 55.245 45.328 15.106 1.00 0.00 N ATOM 583 CA PRO A 37 54.838 44.111 14.434 1.00 0.00 C ATOM 584 C PRO A 37 53.818 43.317 15.253 1.00 0.00 C ATOM 585 O PRO A 37 54.078 43.088 16.432 1.00 0.00 O ATOM 586 CB PRO A 37 56.113 43.305 14.204 1.00 0.00 C ATOM 587 CG PRO A 37 57.205 44.370 14.163 1.00 0.00 C ATOM 588 CD PRO A 37 56.691 45.393 15.172 1.00 0.00 C ATOM 0 HA PRO A 37 54.339 44.341 13.493 1.00 0.00 H new ATOM 0 HB2 PRO A 37 56.283 42.586 15.005 1.00 0.00 H new ATOM 0 HB3 PRO A 37 56.068 42.740 13.273 1.00 0.00 H new ATOM 0 HG2 PRO A 37 58.177 43.968 14.449 1.00 0.00 H new ATOM 0 HG3 PRO A 37 57.318 44.800 13.168 1.00 0.00 H new ATOM 0 HD2 PRO A 37 57.046 45.163 16.176 1.00 0.00 H new ATOM 0 HD3 PRO A 37 57.048 46.394 14.929 1.00 0.00 H new ATOM 596 N PRO A 38 52.691 42.870 14.709 1.00 0.00 N ATOM 597 CA PRO A 38 51.657 42.226 15.493 1.00 0.00 C ATOM 598 C PRO A 38 52.088 40.949 16.218 1.00 0.00 C ATOM 599 O PRO A 38 51.592 40.680 17.310 1.00 0.00 O ATOM 600 CB PRO A 38 50.490 41.977 14.544 1.00 0.00 C ATOM 601 CG PRO A 38 50.642 43.105 13.527 1.00 0.00 C ATOM 602 CD PRO A 38 52.158 43.216 13.407 1.00 0.00 C ATOM 0 HA PRO A 38 51.383 42.886 16.316 1.00 0.00 H new ATOM 0 HB2 PRO A 38 50.552 40.996 14.073 1.00 0.00 H new ATOM 0 HB3 PRO A 38 49.531 42.023 15.060 1.00 0.00 H new ATOM 0 HG2 PRO A 38 50.173 42.861 12.574 1.00 0.00 H new ATOM 0 HG3 PRO A 38 50.191 44.034 13.876 1.00 0.00 H new ATOM 0 HD2 PRO A 38 52.538 42.543 12.639 1.00 0.00 H new ATOM 0 HD3 PRO A 38 52.453 44.225 13.121 1.00 0.00 H new ATOM 610 N ASP A 39 53.070 40.210 15.711 1.00 0.00 N ATOM 611 CA ASP A 39 53.646 39.064 16.386 1.00 0.00 C ATOM 612 C ASP A 39 54.487 39.416 17.615 1.00 0.00 C ATOM 613 O ASP A 39 54.723 38.558 18.462 1.00 0.00 O ATOM 614 CB ASP A 39 54.446 38.227 15.393 1.00 0.00 C ATOM 615 CG ASP A 39 55.694 38.958 14.891 1.00 0.00 C ATOM 616 OD1 ASP A 39 55.626 39.587 13.813 1.00 0.00 O ATOM 617 OD2 ASP A 39 56.749 38.881 15.557 1.00 0.00 O ATOM 0 H ASP A 39 53.492 40.399 14.802 1.00 0.00 H new ATOM 0 HA ASP A 39 52.810 38.481 16.773 1.00 0.00 H new ATOM 0 HB2 ASP A 39 54.742 37.290 15.866 1.00 0.00 H new ATOM 0 HB3 ASP A 39 53.812 37.970 14.544 1.00 0.00 H new ATOM 622 N GLN A 40 54.884 40.677 17.762 1.00 0.00 N ATOM 623 CA GLN A 40 55.566 41.231 18.914 1.00 0.00 C ATOM 624 C GLN A 40 54.583 41.788 19.947 1.00 0.00 C ATOM 625 O GLN A 40 54.940 42.018 21.100 1.00 0.00 O ATOM 626 CB GLN A 40 56.512 42.316 18.405 1.00 0.00 C ATOM 627 CG GLN A 40 57.650 42.685 19.354 1.00 0.00 C ATOM 628 CD GLN A 40 58.421 43.907 18.850 1.00 0.00 C ATOM 629 OE1 GLN A 40 58.393 44.980 19.448 1.00 0.00 O ATOM 630 NE2 GLN A 40 59.124 43.804 17.726 1.00 0.00 N ATOM 0 H GLN A 40 54.726 41.375 17.035 1.00 0.00 H new ATOM 0 HA GLN A 40 56.124 40.448 19.427 1.00 0.00 H new ATOM 0 HB2 GLN A 40 56.942 41.986 17.459 1.00 0.00 H new ATOM 0 HB3 GLN A 40 55.930 43.213 18.195 1.00 0.00 H new ATOM 0 HG2 GLN A 40 57.247 42.890 20.346 1.00 0.00 H new ATOM 0 HG3 GLN A 40 58.330 41.840 19.455 1.00 0.00 H new ATOM 0 HE21 GLN A 40 59.153 42.918 17.222 1.00 0.00 H new ATOM 0 HE22 GLN A 40 59.634 44.611 17.368 1.00 0.00 H new ATOM 639 N GLN A 41 53.328 42.017 19.569 1.00 0.00 N ATOM 640 CA GLN A 41 52.333 42.635 20.421 1.00 0.00 C ATOM 641 C GLN A 41 51.657 41.601 21.324 1.00 0.00 C ATOM 642 O GLN A 41 50.785 40.861 20.876 1.00 0.00 O ATOM 643 CB GLN A 41 51.286 43.377 19.594 1.00 0.00 C ATOM 644 CG GLN A 41 51.825 44.579 18.825 1.00 0.00 C ATOM 645 CD GLN A 41 50.681 45.379 18.198 1.00 0.00 C ATOM 646 OE1 GLN A 41 49.691 45.679 18.863 1.00 0.00 O ATOM 647 NE2 GLN A 41 50.756 45.768 16.928 1.00 0.00 N ATOM 0 H GLN A 41 52.974 41.771 18.644 1.00 0.00 H new ATOM 0 HA GLN A 41 52.849 43.357 21.053 1.00 0.00 H new ATOM 0 HB2 GLN A 41 50.839 42.679 18.886 1.00 0.00 H new ATOM 0 HB3 GLN A 41 50.489 43.713 20.257 1.00 0.00 H new ATOM 0 HG2 GLN A 41 52.398 45.219 19.496 1.00 0.00 H new ATOM 0 HG3 GLN A 41 52.509 44.242 18.046 1.00 0.00 H new ATOM 0 HE21 GLN A 41 51.573 45.525 16.367 1.00 0.00 H new ATOM 0 HE22 GLN A 41 49.997 46.310 16.515 1.00 0.00 H new ATOM 656 N ARG A 42 52.006 41.597 22.608 1.00 0.00 N ATOM 657 CA ARG A 42 51.337 40.823 23.634 1.00 0.00 C ATOM 658 C ARG A 42 50.505 41.735 24.538 1.00 0.00 C ATOM 659 O ARG A 42 51.041 42.747 24.987 1.00 0.00 O ATOM 660 CB ARG A 42 52.331 39.986 24.435 1.00 0.00 C ATOM 661 CG ARG A 42 53.180 39.076 23.554 1.00 0.00 C ATOM 662 CD ARG A 42 54.101 38.186 24.385 1.00 0.00 C ATOM 663 NE ARG A 42 53.401 37.038 24.962 1.00 0.00 N ATOM 664 CZ ARG A 42 53.969 35.965 25.531 1.00 0.00 C ATOM 665 NH1 ARG A 42 55.292 35.861 25.720 1.00 0.00 N ATOM 666 NH2 ARG A 42 53.192 34.960 25.954 1.00 0.00 N ATOM 0 H ARG A 42 52.785 42.150 22.967 1.00 0.00 H new ATOM 0 HA ARG A 42 50.655 40.126 23.146 1.00 0.00 H new ATOM 0 HB2 ARG A 42 52.985 40.649 25.001 1.00 0.00 H new ATOM 0 HB3 ARG A 42 51.788 39.379 25.160 1.00 0.00 H new ATOM 0 HG2 ARG A 42 52.529 38.454 22.940 1.00 0.00 H new ATOM 0 HG3 ARG A 42 53.777 39.682 22.873 1.00 0.00 H new ATOM 0 HD2 ARG A 42 54.920 37.831 23.759 1.00 0.00 H new ATOM 0 HD3 ARG A 42 54.545 38.776 25.186 1.00 0.00 H new ATOM 0 HE ARG A 42 52.382 37.056 24.928 1.00 0.00 H new ATOM 0 HH11 ARG A 42 55.910 36.617 25.426 1.00 0.00 H new ATOM 0 HH12 ARG A 42 55.681 35.025 26.157 1.00 0.00 H new ATOM 0 HH21 ARG A 42 52.180 35.016 25.842 1.00 0.00 H new ATOM 0 HH22 ARG A 42 53.612 34.138 26.388 1.00 0.00 H new ATOM 680 N LEU A 43 49.241 41.406 24.790 1.00 0.00 N ATOM 681 CA LEU A 43 48.299 42.205 25.548 1.00 0.00 C ATOM 682 C LEU A 43 47.583 41.383 26.621 1.00 0.00 C ATOM 683 O LEU A 43 47.262 40.216 26.409 1.00 0.00 O ATOM 684 CB LEU A 43 47.289 42.846 24.601 1.00 0.00 C ATOM 685 CG LEU A 43 47.847 43.895 23.644 1.00 0.00 C ATOM 686 CD1 LEU A 43 46.795 44.279 22.608 1.00 0.00 C ATOM 687 CD2 LEU A 43 48.269 45.167 24.375 1.00 0.00 C ATOM 0 H LEU A 43 48.833 40.534 24.453 1.00 0.00 H new ATOM 0 HA LEU A 43 48.859 42.985 26.064 1.00 0.00 H new ATOM 0 HB2 LEU A 43 46.821 42.057 24.012 1.00 0.00 H new ATOM 0 HB3 LEU A 43 46.503 43.308 25.198 1.00 0.00 H new ATOM 0 HG LEU A 43 48.719 43.450 23.166 1.00 0.00 H new ATOM 0 HD11 LEU A 43 47.207 45.028 21.932 1.00 0.00 H new ATOM 0 HD12 LEU A 43 46.506 43.396 22.038 1.00 0.00 H new ATOM 0 HD13 LEU A 43 45.920 44.688 23.113 1.00 0.00 H new ATOM 0 HD21 LEU A 43 48.660 45.887 23.656 1.00 0.00 H new ATOM 0 HD22 LEU A 43 47.407 45.596 24.886 1.00 0.00 H new ATOM 0 HD23 LEU A 43 49.041 44.927 25.106 1.00 0.00 H new ATOM 699 N ILE A 44 47.325 42.010 27.765 1.00 0.00 N ATOM 700 CA ILE A 44 46.687 41.433 28.931 1.00 0.00 C ATOM 701 C ILE A 44 45.485 42.277 29.361 1.00 0.00 C ATOM 702 O ILE A 44 45.553 43.503 29.398 1.00 0.00 O ATOM 703 CB ILE A 44 47.695 41.245 30.062 1.00 0.00 C ATOM 704 CG1 ILE A 44 48.747 40.210 29.677 1.00 0.00 C ATOM 705 CG2 ILE A 44 47.040 40.847 31.381 1.00 0.00 C ATOM 706 CD1 ILE A 44 49.924 40.077 30.641 1.00 0.00 C ATOM 0 H ILE A 44 47.572 42.990 27.905 1.00 0.00 H new ATOM 0 HA ILE A 44 46.310 40.444 28.671 1.00 0.00 H new ATOM 0 HB ILE A 44 48.170 42.214 30.215 1.00 0.00 H new ATOM 0 HG12 ILE A 44 48.260 39.239 29.589 1.00 0.00 H new ATOM 0 HG13 ILE A 44 49.135 40.462 28.690 1.00 0.00 H new ATOM 0 HG21 ILE A 44 47.807 40.728 32.147 1.00 0.00 H new ATOM 0 HG22 ILE A 44 46.338 41.623 31.688 1.00 0.00 H new ATOM 0 HG23 ILE A 44 46.506 39.905 31.253 1.00 0.00 H new ATOM 0 HD11 ILE A 44 50.611 39.315 30.273 1.00 0.00 H new ATOM 0 HD12 ILE A 44 50.445 41.032 30.713 1.00 0.00 H new ATOM 0 HD13 ILE A 44 49.557 39.789 31.626 1.00 0.00 H new ATOM 718 N PHE A 45 44.400 41.605 29.736 1.00 0.00 N ATOM 719 CA PHE A 45 43.274 42.173 30.449 1.00 0.00 C ATOM 720 C PHE A 45 42.670 41.151 31.415 1.00 0.00 C ATOM 721 O PHE A 45 42.640 39.961 31.111 1.00 0.00 O ATOM 722 CB PHE A 45 42.227 42.671 29.457 1.00 0.00 C ATOM 723 CG PHE A 45 41.121 43.476 30.095 1.00 0.00 C ATOM 724 CD1 PHE A 45 41.385 44.775 30.543 1.00 0.00 C ATOM 725 CD2 PHE A 45 39.844 42.927 30.263 1.00 0.00 C ATOM 726 CE1 PHE A 45 40.374 45.532 31.147 1.00 0.00 C ATOM 727 CE2 PHE A 45 38.830 43.684 30.863 1.00 0.00 C ATOM 728 CZ PHE A 45 39.093 44.988 31.301 1.00 0.00 C ATOM 0 H PHE A 45 44.283 40.611 29.541 1.00 0.00 H new ATOM 0 HA PHE A 45 43.624 43.020 31.039 1.00 0.00 H new ATOM 0 HB2 PHE A 45 42.718 43.282 28.700 1.00 0.00 H new ATOM 0 HB3 PHE A 45 41.791 41.815 28.942 1.00 0.00 H new ATOM 0 HD1 PHE A 45 42.373 45.195 30.422 1.00 0.00 H new ATOM 0 HD2 PHE A 45 39.641 41.920 29.930 1.00 0.00 H new ATOM 0 HE1 PHE A 45 40.582 46.534 31.493 1.00 0.00 H new ATOM 0 HE2 PHE A 45 37.844 43.262 30.988 1.00 0.00 H new ATOM 0 HZ PHE A 45 38.308 45.573 31.757 1.00 0.00 H new ATOM 738 N ALA A 46 42.199 41.597 32.575 1.00 0.00 N ATOM 739 CA ALA A 46 41.641 40.775 33.630 1.00 0.00 C ATOM 740 C ALA A 46 42.479 39.538 33.962 1.00 0.00 C ATOM 741 O ALA A 46 41.968 38.427 34.080 1.00 0.00 O ATOM 742 CB ALA A 46 40.173 40.498 33.319 1.00 0.00 C ATOM 0 H ALA A 46 42.198 42.589 32.811 1.00 0.00 H new ATOM 0 HA ALA A 46 41.680 41.329 34.568 1.00 0.00 H new ATOM 0 HB1 ALA A 46 39.744 39.880 34.108 1.00 0.00 H new ATOM 0 HB2 ALA A 46 39.629 41.441 33.261 1.00 0.00 H new ATOM 0 HB3 ALA A 46 40.095 39.975 32.366 1.00 0.00 H new ATOM 748 N GLY A 47 43.795 39.710 34.055 1.00 0.00 N ATOM 749 CA GLY A 47 44.761 38.672 34.354 1.00 0.00 C ATOM 750 C GLY A 47 44.982 37.619 33.267 1.00 0.00 C ATOM 751 O GLY A 47 45.674 36.636 33.521 1.00 0.00 O ATOM 0 H GLY A 47 44.231 40.622 33.916 1.00 0.00 H new ATOM 0 HA2 GLY A 47 45.718 39.147 34.570 1.00 0.00 H new ATOM 0 HA3 GLY A 47 44.445 38.163 35.265 1.00 0.00 H new ATOM 755 N LYS A 48 44.416 37.785 32.075 1.00 0.00 N ATOM 756 CA LYS A 48 44.434 36.837 30.979 1.00 0.00 C ATOM 757 C LYS A 48 45.227 37.388 29.793 1.00 0.00 C ATOM 758 O LYS A 48 45.082 38.559 29.449 1.00 0.00 O ATOM 759 CB LYS A 48 42.999 36.524 30.565 1.00 0.00 C ATOM 760 CG LYS A 48 42.220 35.772 31.641 1.00 0.00 C ATOM 761 CD LYS A 48 40.710 35.777 31.420 1.00 0.00 C ATOM 762 CE LYS A 48 40.119 37.171 31.605 1.00 0.00 C ATOM 763 NZ LYS A 48 38.648 37.149 31.581 1.00 0.00 N ATOM 0 H LYS A 48 43.904 38.636 31.841 1.00 0.00 H new ATOM 0 HA LYS A 48 44.925 35.921 31.308 1.00 0.00 H new ATOM 0 HB2 LYS A 48 42.482 37.455 30.333 1.00 0.00 H new ATOM 0 HB3 LYS A 48 43.011 35.930 29.651 1.00 0.00 H new ATOM 0 HG2 LYS A 48 42.570 34.740 31.676 1.00 0.00 H new ATOM 0 HG3 LYS A 48 42.438 36.216 32.612 1.00 0.00 H new ATOM 0 HD2 LYS A 48 40.488 35.418 30.415 1.00 0.00 H new ATOM 0 HD3 LYS A 48 40.237 35.086 32.118 1.00 0.00 H new ATOM 0 HE2 LYS A 48 40.461 37.588 32.552 1.00 0.00 H new ATOM 0 HE3 LYS A 48 40.486 37.829 30.817 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 38.284 38.115 31.710 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 38.321 36.775 30.667 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 38.297 36.542 32.349 1.00 0.00 H new ATOM 777 N GLN A 49 46.026 36.547 29.141 1.00 0.00 N ATOM 778 CA GLN A 49 46.723 36.882 27.916 1.00 0.00 C ATOM 779 C GLN A 49 45.769 36.776 26.724 1.00 0.00 C ATOM 780 O GLN A 49 45.167 35.727 26.510 1.00 0.00 O ATOM 781 CB GLN A 49 47.942 35.982 27.733 1.00 0.00 C ATOM 782 CG GLN A 49 48.987 36.116 28.836 1.00 0.00 C ATOM 783 CD GLN A 49 50.239 35.267 28.609 1.00 0.00 C ATOM 784 OE1 GLN A 49 50.466 34.684 27.551 1.00 0.00 O ATOM 785 NE2 GLN A 49 51.136 35.188 29.588 1.00 0.00 N ATOM 0 H GLN A 49 46.206 35.596 29.462 1.00 0.00 H new ATOM 0 HA GLN A 49 47.077 37.911 27.977 1.00 0.00 H new ATOM 0 HB2 GLN A 49 47.610 34.945 27.686 1.00 0.00 H new ATOM 0 HB3 GLN A 49 48.409 36.211 26.775 1.00 0.00 H new ATOM 0 HG2 GLN A 49 49.280 37.163 28.921 1.00 0.00 H new ATOM 0 HG3 GLN A 49 48.536 35.833 29.787 1.00 0.00 H new ATOM 0 HE21 GLN A 49 50.967 35.664 30.474 1.00 0.00 H new ATOM 0 HE22 GLN A 49 51.993 34.651 29.453 1.00 0.00 H new ATOM 794 N LEU A 50 45.602 37.854 25.963 1.00 0.00 N ATOM 795 CA LEU A 50 44.611 37.950 24.910 1.00 0.00 C ATOM 796 C LEU A 50 45.067 37.264 23.620 1.00 0.00 C ATOM 797 O LEU A 50 46.240 37.337 23.259 1.00 0.00 O ATOM 798 CB LEU A 50 44.237 39.412 24.686 1.00 0.00 C ATOM 799 CG LEU A 50 43.732 40.154 25.922 1.00 0.00 C ATOM 800 CD1 LEU A 50 43.430 41.609 25.571 1.00 0.00 C ATOM 801 CD2 LEU A 50 42.471 39.533 26.515 1.00 0.00 C ATOM 0 H LEU A 50 46.165 38.698 26.068 1.00 0.00 H new ATOM 0 HA LEU A 50 43.718 37.412 25.229 1.00 0.00 H new ATOM 0 HB2 LEU A 50 45.110 39.938 24.298 1.00 0.00 H new ATOM 0 HB3 LEU A 50 43.468 39.459 23.915 1.00 0.00 H new ATOM 0 HG LEU A 50 44.526 40.085 26.666 1.00 0.00 H new ATOM 0 HD11 LEU A 50 43.071 42.130 26.458 1.00 0.00 H new ATOM 0 HD12 LEU A 50 44.338 42.092 25.209 1.00 0.00 H new ATOM 0 HD13 LEU A 50 42.666 41.645 24.795 1.00 0.00 H new ATOM 0 HD21 LEU A 50 42.161 40.104 27.390 1.00 0.00 H new ATOM 0 HD22 LEU A 50 41.674 39.547 25.771 1.00 0.00 H new ATOM 0 HD23 LEU A 50 42.676 38.503 26.808 1.00 0.00 H new ATOM 813 N GLU A 51 44.143 36.609 22.923 1.00 0.00 N ATOM 814 CA GLU A 51 44.384 35.838 21.720 1.00 0.00 C ATOM 815 C GLU A 51 43.722 36.441 20.478 1.00 0.00 C ATOM 816 O GLU A 51 42.591 36.918 20.528 1.00 0.00 O ATOM 817 CB GLU A 51 43.926 34.392 21.888 1.00 0.00 C ATOM 818 CG GLU A 51 44.722 33.599 22.919 1.00 0.00 C ATOM 819 CD GLU A 51 46.229 33.573 22.652 1.00 0.00 C ATOM 820 OE1 GLU A 51 47.001 33.508 23.632 1.00 0.00 O ATOM 821 OE2 GLU A 51 46.669 33.599 21.483 1.00 0.00 O ATOM 0 H GLU A 51 43.161 36.605 23.200 1.00 0.00 H new ATOM 0 HA GLU A 51 45.463 35.864 21.565 1.00 0.00 H new ATOM 0 HB2 GLU A 51 42.875 34.387 22.175 1.00 0.00 H new ATOM 0 HB3 GLU A 51 43.996 33.887 20.925 1.00 0.00 H new ATOM 0 HG2 GLU A 51 44.545 34.025 23.906 1.00 0.00 H new ATOM 0 HG3 GLU A 51 44.349 32.575 22.942 1.00 0.00 H new ATOM 828 N ASP A 52 44.430 36.367 19.355 1.00 0.00 N ATOM 829 CA ASP A 52 44.189 37.118 18.140 1.00 0.00 C ATOM 830 C ASP A 52 42.802 36.918 17.525 1.00 0.00 C ATOM 831 O ASP A 52 42.182 37.880 17.080 1.00 0.00 O ATOM 832 CB ASP A 52 45.281 36.762 17.135 1.00 0.00 C ATOM 833 CG ASP A 52 46.671 37.097 17.680 1.00 0.00 C ATOM 834 OD1 ASP A 52 47.039 38.291 17.714 1.00 0.00 O ATOM 835 OD2 ASP A 52 47.397 36.177 18.116 1.00 0.00 O ATOM 0 H ASP A 52 45.233 35.743 19.270 1.00 0.00 H new ATOM 0 HA ASP A 52 44.218 38.175 18.405 1.00 0.00 H new ATOM 0 HB2 ASP A 52 45.228 35.699 16.898 1.00 0.00 H new ATOM 0 HB3 ASP A 52 45.113 37.305 16.205 1.00 0.00 H new ATOM 840 N GLY A 53 42.299 35.687 17.510 1.00 0.00 N ATOM 841 CA GLY A 53 41.049 35.343 16.862 1.00 0.00 C ATOM 842 C GLY A 53 39.774 35.713 17.623 1.00 0.00 C ATOM 843 O GLY A 53 38.697 35.636 17.036 1.00 0.00 O ATOM 0 H GLY A 53 42.759 34.893 17.956 1.00 0.00 H new ATOM 0 HA2 GLY A 53 41.021 35.831 15.888 1.00 0.00 H new ATOM 0 HA3 GLY A 53 41.041 34.268 16.680 1.00 0.00 H new ATOM 847 N ARG A 54 39.855 36.079 18.899 1.00 0.00 N ATOM 848 CA ARG A 54 38.693 36.300 19.737 1.00 0.00 C ATOM 849 C ARG A 54 38.172 37.736 19.643 1.00 0.00 C ATOM 850 O ARG A 54 38.943 38.657 19.381 1.00 0.00 O ATOM 851 CB ARG A 54 38.978 35.889 21.178 1.00 0.00 C ATOM 852 CG ARG A 54 39.530 34.479 21.369 1.00 0.00 C ATOM 853 CD ARG A 54 38.771 33.370 20.645 1.00 0.00 C ATOM 854 NE ARG A 54 37.389 33.214 21.100 1.00 0.00 N ATOM 855 CZ ARG A 54 36.971 32.499 22.153 1.00 0.00 C ATOM 856 NH1 ARG A 54 37.798 31.871 23.000 1.00 0.00 N ATOM 857 NH2 ARG A 54 35.667 32.355 22.424 1.00 0.00 N ATOM 0 H ARG A 54 40.741 36.231 19.380 1.00 0.00 H new ATOM 0 HA ARG A 54 37.893 35.663 19.360 1.00 0.00 H new ATOM 0 HB2 ARG A 54 39.688 36.598 21.605 1.00 0.00 H new ATOM 0 HB3 ARG A 54 38.055 35.978 21.751 1.00 0.00 H new ATOM 0 HG2 ARG A 54 40.567 34.465 21.032 1.00 0.00 H new ATOM 0 HG3 ARG A 54 39.538 34.253 22.435 1.00 0.00 H new ATOM 0 HD2 ARG A 54 38.771 33.579 19.575 1.00 0.00 H new ATOM 0 HD3 ARG A 54 39.300 32.427 20.786 1.00 0.00 H new ATOM 0 HE ARG A 54 36.671 33.699 20.561 1.00 0.00 H new ATOM 0 HH11 ARG A 54 38.807 31.923 22.860 1.00 0.00 H new ATOM 0 HH12 ARG A 54 37.418 31.341 23.785 1.00 0.00 H new ATOM 0 HH21 ARG A 54 34.970 32.794 21.823 1.00 0.00 H new ATOM 0 HH22 ARG A 54 35.371 31.806 23.231 1.00 0.00 H new ATOM 871 N THR A 55 36.878 37.933 19.875 1.00 0.00 N ATOM 872 CA THR A 55 36.276 39.252 19.918 1.00 0.00 C ATOM 873 C THR A 55 36.385 39.891 21.305 1.00 0.00 C ATOM 874 O THR A 55 36.471 39.195 22.315 1.00 0.00 O ATOM 875 CB THR A 55 34.826 39.306 19.446 1.00 0.00 C ATOM 876 OG1 THR A 55 33.943 38.745 20.392 1.00 0.00 O ATOM 877 CG2 THR A 55 34.563 38.623 18.108 1.00 0.00 C ATOM 0 H THR A 55 36.217 37.174 20.039 1.00 0.00 H new ATOM 0 HA THR A 55 36.862 39.828 19.202 1.00 0.00 H new ATOM 0 HB THR A 55 34.642 40.373 19.322 1.00 0.00 H new ATOM 0 HG1 THR A 55 33.928 37.771 20.288 1.00 0.00 H new ATOM 0 HG21 THR A 55 33.507 38.713 17.855 1.00 0.00 H new ATOM 0 HG22 THR A 55 35.163 39.099 17.332 1.00 0.00 H new ATOM 0 HG23 THR A 55 34.831 37.569 18.179 1.00 0.00 H new ATOM 885 N LEU A 56 36.297 41.216 21.366 1.00 0.00 N ATOM 886 CA LEU A 56 36.181 41.946 22.613 1.00 0.00 C ATOM 887 C LEU A 56 35.011 41.446 23.461 1.00 0.00 C ATOM 888 O LEU A 56 35.162 41.266 24.668 1.00 0.00 O ATOM 889 CB LEU A 56 36.048 43.438 22.320 1.00 0.00 C ATOM 890 CG LEU A 56 37.264 44.082 21.659 1.00 0.00 C ATOM 891 CD1 LEU A 56 36.979 45.558 21.397 1.00 0.00 C ATOM 892 CD2 LEU A 56 38.528 43.994 22.511 1.00 0.00 C ATOM 0 H LEU A 56 36.305 41.814 20.540 1.00 0.00 H new ATOM 0 HA LEU A 56 37.086 41.774 23.196 1.00 0.00 H new ATOM 0 HB2 LEU A 56 35.182 43.590 21.676 1.00 0.00 H new ATOM 0 HB3 LEU A 56 35.845 43.959 23.256 1.00 0.00 H new ATOM 0 HG LEU A 56 37.439 43.532 20.735 1.00 0.00 H new ATOM 0 HD11 LEU A 56 37.847 46.018 20.925 1.00 0.00 H new ATOM 0 HD12 LEU A 56 36.116 45.650 20.738 1.00 0.00 H new ATOM 0 HD13 LEU A 56 36.770 46.061 22.341 1.00 0.00 H new ATOM 0 HD21 LEU A 56 39.355 44.470 21.985 1.00 0.00 H new ATOM 0 HD22 LEU A 56 38.362 44.502 23.461 1.00 0.00 H new ATOM 0 HD23 LEU A 56 38.770 42.947 22.696 1.00 0.00 H new ATOM 904 N SER A 57 33.874 41.139 22.844 1.00 0.00 N ATOM 905 CA SER A 57 32.706 40.613 23.520 1.00 0.00 C ATOM 906 C SER A 57 32.890 39.215 24.114 1.00 0.00 C ATOM 907 O SER A 57 32.250 38.906 25.117 1.00 0.00 O ATOM 908 CB SER A 57 31.490 40.638 22.597 1.00 0.00 C ATOM 909 OG SER A 57 31.539 39.662 21.581 1.00 0.00 O ATOM 0 H SER A 57 33.742 41.254 21.839 1.00 0.00 H new ATOM 0 HA SER A 57 32.544 41.277 24.369 1.00 0.00 H new ATOM 0 HB2 SER A 57 30.589 40.488 23.191 1.00 0.00 H new ATOM 0 HB3 SER A 57 31.410 41.624 22.140 1.00 0.00 H new ATOM 0 HG SER A 57 32.472 39.493 21.334 1.00 0.00 H new ATOM 915 N ASP A 58 33.772 38.378 23.574 1.00 0.00 N ATOM 916 CA ASP A 58 34.048 37.064 24.118 1.00 0.00 C ATOM 917 C ASP A 58 34.816 37.143 25.440 1.00 0.00 C ATOM 918 O ASP A 58 34.628 36.309 26.322 1.00 0.00 O ATOM 919 CB ASP A 58 34.823 36.212 23.117 1.00 0.00 C ATOM 920 CG ASP A 58 34.085 35.997 21.793 1.00 0.00 C ATOM 921 OD1 ASP A 58 32.910 35.573 21.794 1.00 0.00 O ATOM 922 OD2 ASP A 58 34.690 36.252 20.729 1.00 0.00 O ATOM 0 H ASP A 58 34.316 38.600 22.740 1.00 0.00 H new ATOM 0 HA ASP A 58 33.085 36.593 24.316 1.00 0.00 H new ATOM 0 HB2 ASP A 58 35.783 36.687 22.915 1.00 0.00 H new ATOM 0 HB3 ASP A 58 35.036 35.242 23.566 1.00 0.00 H new ATOM 927 N TYR A 59 35.630 38.181 25.605 1.00 0.00 N ATOM 928 CA TYR A 59 36.263 38.552 26.854 1.00 0.00 C ATOM 929 C TYR A 59 35.408 39.479 27.720 1.00 0.00 C ATOM 930 O TYR A 59 35.865 39.902 28.779 1.00 0.00 O ATOM 931 CB TYR A 59 37.626 39.163 26.542 1.00 0.00 C ATOM 932 CG TYR A 59 38.646 38.226 25.941 1.00 0.00 C ATOM 933 CD1 TYR A 59 39.145 37.164 26.706 1.00 0.00 C ATOM 934 CD2 TYR A 59 39.152 38.460 24.657 1.00 0.00 C ATOM 935 CE1 TYR A 59 40.153 36.336 26.198 1.00 0.00 C ATOM 936 CE2 TYR A 59 40.180 37.658 24.148 1.00 0.00 C ATOM 937 CZ TYR A 59 40.684 36.590 24.918 1.00 0.00 C ATOM 938 OH TYR A 59 41.696 35.820 24.425 1.00 0.00 O ATOM 0 H TYR A 59 35.873 38.808 24.838 1.00 0.00 H new ATOM 0 HA TYR A 59 36.386 37.651 27.455 1.00 0.00 H new ATOM 0 HB2 TYR A 59 37.480 39.998 25.857 1.00 0.00 H new ATOM 0 HB3 TYR A 59 38.038 39.575 27.463 1.00 0.00 H new ATOM 0 HD1 TYR A 59 38.749 36.983 27.694 1.00 0.00 H new ATOM 0 HD2 TYR A 59 38.748 39.262 24.057 1.00 0.00 H new ATOM 0 HE1 TYR A 59 40.522 35.507 26.784 1.00 0.00 H new ATOM 0 HE2 TYR A 59 40.586 37.857 23.167 1.00 0.00 H new ATOM 0 HH TYR A 59 41.465 35.514 23.523 1.00 0.00 H new ATOM 948 N ASN A 60 34.187 39.803 27.301 1.00 0.00 N ATOM 949 CA ASN A 60 33.299 40.761 27.926 1.00 0.00 C ATOM 950 C ASN A 60 33.923 42.139 28.150 1.00 0.00 C ATOM 951 O ASN A 60 33.687 42.779 29.172 1.00 0.00 O ATOM 952 CB ASN A 60 32.641 40.141 29.156 1.00 0.00 C ATOM 953 CG ASN A 60 31.481 40.976 29.702 1.00 0.00 C ATOM 954 OD1 ASN A 60 30.653 41.511 28.967 1.00 0.00 O ATOM 955 ND2 ASN A 60 31.373 41.105 31.021 1.00 0.00 N ATOM 0 H ASN A 60 33.775 39.377 26.471 1.00 0.00 H new ATOM 0 HA ASN A 60 32.499 40.987 27.221 1.00 0.00 H new ATOM 0 HB2 ASN A 60 32.276 39.146 28.903 1.00 0.00 H new ATOM 0 HB3 ASN A 60 33.390 40.016 29.938 1.00 0.00 H new ATOM 0 HD21 ASN A 60 30.606 41.646 31.419 1.00 0.00 H new ATOM 0 HD22 ASN A 60 32.058 40.663 31.634 1.00 0.00 H new ATOM 962 N ILE A 61 34.752 42.613 27.223 1.00 0.00 N ATOM 963 CA ILE A 61 35.447 43.880 27.321 1.00 0.00 C ATOM 964 C ILE A 61 34.488 45.013 26.951 1.00 0.00 C ATOM 965 O ILE A 61 34.123 45.188 25.790 1.00 0.00 O ATOM 966 CB ILE A 61 36.722 43.863 26.482 1.00 0.00 C ATOM 967 CG1 ILE A 61 37.719 42.848 27.034 1.00 0.00 C ATOM 968 CG2 ILE A 61 37.391 45.235 26.435 1.00 0.00 C ATOM 969 CD1 ILE A 61 38.921 42.571 26.135 1.00 0.00 C ATOM 0 H ILE A 61 34.960 42.107 26.362 1.00 0.00 H new ATOM 0 HA ILE A 61 35.771 44.053 28.347 1.00 0.00 H new ATOM 0 HB ILE A 61 36.428 43.582 25.471 1.00 0.00 H new ATOM 0 HG12 ILE A 61 38.080 43.204 27.999 1.00 0.00 H new ATOM 0 HG13 ILE A 61 37.196 41.909 27.216 1.00 0.00 H new ATOM 0 HG21 ILE A 61 38.295 45.179 25.828 1.00 0.00 H new ATOM 0 HG22 ILE A 61 36.704 45.960 25.997 1.00 0.00 H new ATOM 0 HG23 ILE A 61 37.652 45.547 27.446 1.00 0.00 H new ATOM 0 HD11 ILE A 61 39.571 41.838 26.612 1.00 0.00 H new ATOM 0 HD12 ILE A 61 38.577 42.181 25.177 1.00 0.00 H new ATOM 0 HD13 ILE A 61 39.475 43.496 25.973 1.00 0.00 H new ATOM 981 N GLN A 62 34.080 45.792 27.949 1.00 0.00 N ATOM 982 CA GLN A 62 33.226 46.954 27.817 1.00 0.00 C ATOM 983 C GLN A 62 34.034 48.241 27.633 1.00 0.00 C ATOM 984 O GLN A 62 35.255 48.254 27.765 1.00 0.00 O ATOM 985 CB GLN A 62 32.264 47.003 29.000 1.00 0.00 C ATOM 986 CG GLN A 62 31.252 45.862 28.957 1.00 0.00 C ATOM 987 CD GLN A 62 30.232 45.945 30.094 1.00 0.00 C ATOM 988 OE1 GLN A 62 30.558 45.805 31.272 1.00 0.00 O ATOM 989 NE2 GLN A 62 28.952 46.160 29.799 1.00 0.00 N ATOM 0 H GLN A 62 34.353 45.616 28.916 1.00 0.00 H new ATOM 0 HA GLN A 62 32.632 46.868 26.907 1.00 0.00 H new ATOM 0 HB2 GLN A 62 32.830 46.952 29.930 1.00 0.00 H new ATOM 0 HB3 GLN A 62 31.736 47.957 29.000 1.00 0.00 H new ATOM 0 HG2 GLN A 62 30.729 45.880 28.001 1.00 0.00 H new ATOM 0 HG3 GLN A 62 31.779 44.910 29.014 1.00 0.00 H new ATOM 0 HE21 GLN A 62 28.665 46.278 28.827 1.00 0.00 H new ATOM 0 HE22 GLN A 62 28.258 46.207 30.545 1.00 0.00 H new ATOM 998 N LYS A 63 33.362 49.335 27.289 1.00 0.00 N ATOM 999 CA LYS A 63 33.975 50.586 26.890 1.00 0.00 C ATOM 1000 C LYS A 63 34.958 51.161 27.913 1.00 0.00 C ATOM 1001 O LYS A 63 34.807 51.024 29.125 1.00 0.00 O ATOM 1002 CB LYS A 63 32.918 51.600 26.462 1.00 0.00 C ATOM 1003 CG LYS A 63 32.099 52.177 27.612 1.00 0.00 C ATOM 1004 CD LYS A 63 31.054 53.163 27.095 1.00 0.00 C ATOM 1005 CE LYS A 63 30.338 53.842 28.259 1.00 0.00 C ATOM 1006 NZ LYS A 63 29.298 54.758 27.766 1.00 0.00 N ATOM 0 H LYS A 63 32.343 49.371 27.282 1.00 0.00 H new ATOM 0 HA LYS A 63 34.594 50.355 26.023 1.00 0.00 H new ATOM 0 HB2 LYS A 63 33.409 52.418 25.935 1.00 0.00 H new ATOM 0 HB3 LYS A 63 32.241 51.124 25.752 1.00 0.00 H new ATOM 0 HG2 LYS A 63 31.606 51.370 28.154 1.00 0.00 H new ATOM 0 HG3 LYS A 63 32.760 52.679 28.319 1.00 0.00 H new ATOM 0 HD2 LYS A 63 31.533 53.914 26.467 1.00 0.00 H new ATOM 0 HD3 LYS A 63 30.330 52.640 26.470 1.00 0.00 H new ATOM 0 HE2 LYS A 63 29.889 53.088 28.906 1.00 0.00 H new ATOM 0 HE3 LYS A 63 31.058 54.393 28.864 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 28.823 55.210 28.573 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 29.734 55.488 27.168 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 28.601 54.224 27.208 1.00 0.00 H new ATOM 1020 N GLU A 64 35.988 51.818 27.388 1.00 0.00 N ATOM 1021 CA GLU A 64 37.076 52.447 28.109 1.00 0.00 C ATOM 1022 C GLU A 64 37.856 51.520 29.045 1.00 0.00 C ATOM 1023 O GLU A 64 38.532 51.972 29.967 1.00 0.00 O ATOM 1024 CB GLU A 64 36.618 53.759 28.739 1.00 0.00 C ATOM 1025 CG GLU A 64 36.074 54.718 27.685 1.00 0.00 C ATOM 1026 CD GLU A 64 35.780 56.121 28.220 1.00 0.00 C ATOM 1027 OE1 GLU A 64 35.646 57.046 27.390 1.00 0.00 O ATOM 1028 OE2 GLU A 64 35.670 56.313 29.450 1.00 0.00 O ATOM 0 H GLU A 64 36.086 51.929 26.379 1.00 0.00 H new ATOM 0 HA GLU A 64 37.836 52.699 27.370 1.00 0.00 H new ATOM 0 HB2 GLU A 64 35.848 53.558 29.484 1.00 0.00 H new ATOM 0 HB3 GLU A 64 37.453 54.225 29.262 1.00 0.00 H new ATOM 0 HG2 GLU A 64 36.794 54.794 26.870 1.00 0.00 H new ATOM 0 HG3 GLU A 64 35.159 54.300 27.265 1.00 0.00 H new ATOM 1035 N SER A 65 37.799 50.220 28.777 1.00 0.00 N ATOM 1036 CA SER A 65 38.712 49.235 29.321 1.00 0.00 C ATOM 1037 C SER A 65 40.165 49.599 29.007 1.00 0.00 C ATOM 1038 O SER A 65 40.479 50.072 27.917 1.00 0.00 O ATOM 1039 CB SER A 65 38.434 47.843 28.762 1.00 0.00 C ATOM 1040 OG SER A 65 37.215 47.344 29.265 1.00 0.00 O ATOM 0 H SER A 65 37.096 49.817 28.158 1.00 0.00 H new ATOM 0 HA SER A 65 38.556 49.229 30.400 1.00 0.00 H new ATOM 0 HB2 SER A 65 38.396 47.883 27.673 1.00 0.00 H new ATOM 0 HB3 SER A 65 39.248 47.168 29.028 1.00 0.00 H new ATOM 0 HG SER A 65 36.468 47.763 28.788 1.00 0.00 H new ATOM 1046 N THR A 66 41.043 49.338 29.971 1.00 0.00 N ATOM 1047 CA THR A 66 42.461 49.630 29.912 1.00 0.00 C ATOM 1048 C THR A 66 43.261 48.331 29.798 1.00 0.00 C ATOM 1049 O THR A 66 43.338 47.537 30.732 1.00 0.00 O ATOM 1050 CB THR A 66 42.906 50.490 31.093 1.00 0.00 C ATOM 1051 OG1 THR A 66 42.670 49.883 32.343 1.00 0.00 O ATOM 1052 CG2 THR A 66 42.183 51.833 31.130 1.00 0.00 C ATOM 0 H THR A 66 40.768 48.899 30.849 1.00 0.00 H new ATOM 0 HA THR A 66 42.660 50.220 29.017 1.00 0.00 H new ATOM 0 HB THR A 66 43.977 50.620 30.935 1.00 0.00 H new ATOM 0 HG1 THR A 66 42.768 48.912 32.259 1.00 0.00 H new ATOM 0 HG21 THR A 66 42.532 52.410 31.986 1.00 0.00 H new ATOM 0 HG22 THR A 66 42.391 52.383 30.212 1.00 0.00 H new ATOM 0 HG23 THR A 66 41.109 51.666 31.218 1.00 0.00 H new ATOM 1060 N LEU A 67 43.845 48.093 28.626 1.00 0.00 N ATOM 1061 CA LEU A 67 44.629 46.919 28.302 1.00 0.00 C ATOM 1062 C LEU A 67 46.105 47.187 28.608 1.00 0.00 C ATOM 1063 O LEU A 67 46.619 48.258 28.292 1.00 0.00 O ATOM 1064 CB LEU A 67 44.411 46.538 26.839 1.00 0.00 C ATOM 1065 CG LEU A 67 43.140 45.755 26.525 1.00 0.00 C ATOM 1066 CD1 LEU A 67 41.846 46.491 26.861 1.00 0.00 C ATOM 1067 CD2 LEU A 67 43.108 45.408 25.040 1.00 0.00 C ATOM 0 H LEU A 67 43.777 48.747 27.846 1.00 0.00 H new ATOM 0 HA LEU A 67 44.308 46.076 28.914 1.00 0.00 H new ATOM 0 HB2 LEU A 67 44.405 47.452 26.245 1.00 0.00 H new ATOM 0 HB3 LEU A 67 45.266 45.949 26.508 1.00 0.00 H new ATOM 0 HG LEU A 67 43.181 44.868 27.157 1.00 0.00 H new ATOM 0 HD11 LEU A 67 40.993 45.862 26.606 1.00 0.00 H new ATOM 0 HD12 LEU A 67 41.823 46.719 27.927 1.00 0.00 H new ATOM 0 HD13 LEU A 67 41.796 47.418 26.291 1.00 0.00 H new ATOM 0 HD21 LEU A 67 42.200 44.849 24.817 1.00 0.00 H new ATOM 0 HD22 LEU A 67 43.123 46.325 24.452 1.00 0.00 H new ATOM 0 HD23 LEU A 67 43.978 44.802 24.789 1.00 0.00 H new ATOM 1079 N HIS A 68 46.778 46.211 29.208 1.00 0.00 N ATOM 1080 CA HIS A 68 48.140 46.312 29.693 1.00 0.00 C ATOM 1081 C HIS A 68 49.104 45.401 28.931 1.00 0.00 C ATOM 1082 O HIS A 68 48.693 44.486 28.220 1.00 0.00 O ATOM 1083 CB HIS A 68 48.164 46.051 31.196 1.00 0.00 C ATOM 1084 CG HIS A 68 47.785 47.252 32.017 1.00 0.00 C ATOM 1085 ND1 HIS A 68 48.677 48.053 32.729 1.00 0.00 N ATOM 1086 CD2 HIS A 68 46.526 47.779 32.152 1.00 0.00 C ATOM 1087 CE1 HIS A 68 47.960 49.054 33.243 1.00 0.00 C ATOM 1088 NE2 HIS A 68 46.660 48.909 32.935 1.00 0.00 N ATOM 0 H HIS A 68 46.368 45.292 29.374 1.00 0.00 H new ATOM 0 HA HIS A 68 48.496 47.326 29.508 1.00 0.00 H new ATOM 0 HB2 HIS A 68 47.481 45.233 31.426 1.00 0.00 H new ATOM 0 HB3 HIS A 68 49.163 45.724 31.484 1.00 0.00 H new ATOM 0 HD2 HIS A 68 45.612 47.388 31.730 1.00 0.00 H new ATOM 0 HE1 HIS A 68 48.368 49.867 33.825 1.00 0.00 H new ATOM 0 HE2 HIS A 68 45.903 49.527 33.229 1.00 0.00 H new ATOM 1096 N LEU A 69 50.404 45.653 29.068 1.00 0.00 N ATOM 1097 CA LEU A 69 51.463 44.915 28.410 1.00 0.00 C ATOM 1098 C LEU A 69 52.696 44.760 29.302 1.00 0.00 C ATOM 1099 O LEU A 69 53.067 45.681 30.024 1.00 0.00 O ATOM 1100 CB LEU A 69 51.783 45.561 27.065 1.00 0.00 C ATOM 1101 CG LEU A 69 52.336 46.983 27.114 1.00 0.00 C ATOM 1102 CD1 LEU A 69 53.858 47.011 27.013 1.00 0.00 C ATOM 1103 CD2 LEU A 69 51.788 47.811 25.956 1.00 0.00 C ATOM 0 H LEU A 69 50.754 46.404 29.663 1.00 0.00 H new ATOM 0 HA LEU A 69 51.115 43.900 28.220 1.00 0.00 H new ATOM 0 HB2 LEU A 69 52.505 44.931 26.545 1.00 0.00 H new ATOM 0 HB3 LEU A 69 50.874 45.568 26.463 1.00 0.00 H new ATOM 0 HG LEU A 69 52.027 47.397 28.074 1.00 0.00 H new ATOM 0 HD11 LEU A 69 54.206 48.043 27.052 1.00 0.00 H new ATOM 0 HD12 LEU A 69 54.288 46.451 27.843 1.00 0.00 H new ATOM 0 HD13 LEU A 69 54.169 46.559 26.071 1.00 0.00 H new ATOM 0 HD21 LEU A 69 52.193 48.822 26.008 1.00 0.00 H new ATOM 0 HD22 LEU A 69 52.078 47.352 25.011 1.00 0.00 H new ATOM 0 HD23 LEU A 69 50.701 47.852 26.021 1.00 0.00 H new ATOM 1115 N VAL A 70 53.360 43.611 29.207 1.00 0.00 N ATOM 1116 CA VAL A 70 54.587 43.295 29.910 1.00 0.00 C ATOM 1117 C VAL A 70 55.732 43.213 28.898 1.00 0.00 C ATOM 1118 O VAL A 70 55.702 42.392 27.984 1.00 0.00 O ATOM 1119 CB VAL A 70 54.451 42.010 30.721 1.00 0.00 C ATOM 1120 CG1 VAL A 70 55.760 41.609 31.394 1.00 0.00 C ATOM 1121 CG2 VAL A 70 53.392 42.147 31.811 1.00 0.00 C ATOM 0 H VAL A 70 53.039 42.847 28.612 1.00 0.00 H new ATOM 0 HA VAL A 70 54.806 44.086 30.627 1.00 0.00 H new ATOM 0 HB VAL A 70 54.160 41.242 30.005 1.00 0.00 H new ATOM 0 HG11 VAL A 70 55.612 40.689 31.959 1.00 0.00 H new ATOM 0 HG12 VAL A 70 56.525 41.449 30.635 1.00 0.00 H new ATOM 0 HG13 VAL A 70 56.079 42.402 32.070 1.00 0.00 H new ATOM 0 HG21 VAL A 70 53.321 41.213 32.369 1.00 0.00 H new ATOM 0 HG22 VAL A 70 53.669 42.955 32.488 1.00 0.00 H new ATOM 0 HG23 VAL A 70 52.428 42.371 31.355 1.00 0.00 H new