USER MOD reduce.3.24.130724 H: found=0, std=0, add=547, rem=0, adj=14 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 -27:sc= 1.25 USER MOD Set 1.2: A 57 SER OG : rot -86:sc= 0.344 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 169:sc= 1.24 (180deg=1.09) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 140:sc= 0.373 (180deg=-0.359!) USER MOD Single : A 12 THR OG1 : rot 180:sc= -0.122 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0.0117 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.179 USER MOD Single : A 25 ASN : amide:sc= -0.529 K(o=-0.53,f=-2.5) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 164:sc= 1.49 (180deg=1.17) USER MOD Single : A 31 GLN : amide:sc= -0.0924 K(o=-0.092,f=-1.2) USER MOD Single : A 33 LYS NZ :NH3+ 175:sc= 0.833 (180deg=0.821) USER MOD Single : A 40 GLN : amide:sc=-0.00373 X(o=-0.0037,f=-0.26) USER MOD Single : A 41 GLN : amide:sc= 1.32 K(o=1.3,f=-2.3!) USER MOD Single : A 48 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0637) USER MOD Single : A 49 GLN : amide:sc= 0.858 K(o=0.86,f=-6.5!) USER MOD Single : A 59 TYR OH : rot 30:sc= 0.226 USER MOD Single : A 60 ASN : amide:sc= 0 X(o=0,f=0) 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 67:sc= 1.44 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= -0.039 X(o=-0.039,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 33.030 51.671 20.089 1.00 0.00 N ATOM 2 CA MET A 1 33.288 52.042 21.489 1.00 0.00 C ATOM 3 C MET A 1 34.749 52.464 21.658 1.00 0.00 C ATOM 4 O MET A 1 35.631 51.890 21.023 1.00 0.00 O ATOM 5 CB MET A 1 32.891 50.949 22.477 1.00 0.00 C ATOM 6 CG MET A 1 33.634 49.628 22.305 1.00 0.00 C ATOM 7 SD MET A 1 33.180 48.355 23.508 1.00 0.00 S ATOM 8 CE MET A 1 34.308 47.037 22.990 1.00 0.00 C ATOM 0 H1 MET A 1 32.099 51.212 20.017 1.00 0.00 H new ATOM 0 H2 MET A 1 33.042 52.525 19.496 1.00 0.00 H new ATOM 0 H3 MET A 1 33.766 51.013 19.763 1.00 0.00 H new ATOM 0 HA MET A 1 32.650 52.893 21.727 1.00 0.00 H new ATOM 0 HB2 MET A 1 33.061 51.315 23.489 1.00 0.00 H new ATOM 0 HB3 MET A 1 31.821 50.763 22.380 1.00 0.00 H new ATOM 0 HG2 MET A 1 33.445 49.247 21.302 1.00 0.00 H new ATOM 0 HG3 MET A 1 34.705 49.815 22.379 1.00 0.00 H new ATOM 0 HE1 MET A 1 34.166 46.165 23.628 1.00 0.00 H new ATOM 0 HE2 MET A 1 34.101 46.767 21.955 1.00 0.00 H new ATOM 0 HE3 MET A 1 35.338 47.385 23.075 1.00 0.00 H new ATOM 20 N GLN A 2 34.998 53.434 22.533 1.00 0.00 N ATOM 21 CA GLN A 2 36.331 53.826 22.947 1.00 0.00 C ATOM 22 C GLN A 2 36.874 52.850 23.993 1.00 0.00 C ATOM 23 O GLN A 2 36.154 52.496 24.924 1.00 0.00 O ATOM 24 CB GLN A 2 36.274 55.257 23.471 1.00 0.00 C ATOM 25 CG GLN A 2 37.624 55.824 23.901 1.00 0.00 C ATOM 26 CD GLN A 2 37.473 57.264 24.396 1.00 0.00 C ATOM 27 OE1 GLN A 2 37.171 57.525 25.558 1.00 0.00 O ATOM 28 NE2 GLN A 2 37.643 58.269 23.541 1.00 0.00 N ATOM 0 H GLN A 2 34.260 53.977 22.980 1.00 0.00 H new ATOM 0 HA GLN A 2 37.018 53.792 22.101 1.00 0.00 H new ATOM 0 HB2 GLN A 2 35.854 55.898 22.696 1.00 0.00 H new ATOM 0 HB3 GLN A 2 35.591 55.294 24.320 1.00 0.00 H new ATOM 0 HG2 GLN A 2 38.049 55.205 24.691 1.00 0.00 H new ATOM 0 HG3 GLN A 2 38.320 55.793 23.063 1.00 0.00 H new ATOM 0 HE21 GLN A 2 37.894 58.077 22.571 1.00 0.00 H new ATOM 0 HE22 GLN A 2 37.522 59.232 23.855 1.00 0.00 H new ATOM 37 N ILE A 3 38.139 52.450 23.889 1.00 0.00 N ATOM 38 CA ILE A 3 38.870 51.749 24.925 1.00 0.00 C ATOM 39 C ILE A 3 40.250 52.372 25.146 1.00 0.00 C ATOM 40 O ILE A 3 40.743 53.094 24.282 1.00 0.00 O ATOM 41 CB ILE A 3 38.973 50.251 24.654 1.00 0.00 C ATOM 42 CG1 ILE A 3 39.741 49.935 23.373 1.00 0.00 C ATOM 43 CG2 ILE A 3 37.597 49.593 24.668 1.00 0.00 C ATOM 44 CD1 ILE A 3 40.158 48.472 23.246 1.00 0.00 C ATOM 0 H ILE A 3 38.696 52.614 23.050 1.00 0.00 H new ATOM 0 HA ILE A 3 38.298 51.861 25.846 1.00 0.00 H new ATOM 0 HB ILE A 3 39.556 49.822 25.469 1.00 0.00 H new ATOM 0 HG12 ILE A 3 39.123 50.202 22.516 1.00 0.00 H new ATOM 0 HG13 ILE A 3 40.632 50.561 23.331 1.00 0.00 H new ATOM 0 HG21 ILE A 3 37.702 48.526 24.472 1.00 0.00 H new ATOM 0 HG22 ILE A 3 37.134 49.739 25.644 1.00 0.00 H new ATOM 0 HG23 ILE A 3 36.970 50.043 23.898 1.00 0.00 H new ATOM 0 HD11 ILE A 3 40.698 48.328 22.310 1.00 0.00 H new ATOM 0 HD12 ILE A 3 40.803 48.204 24.083 1.00 0.00 H new ATOM 0 HD13 ILE A 3 39.271 47.839 23.254 1.00 0.00 H new ATOM 56 N PHE A 4 40.886 52.067 26.274 1.00 0.00 N ATOM 57 CA PHE A 4 42.218 52.529 26.608 1.00 0.00 C ATOM 58 C PHE A 4 43.239 51.390 26.622 1.00 0.00 C ATOM 59 O PHE A 4 42.942 50.308 27.126 1.00 0.00 O ATOM 60 CB PHE A 4 42.222 53.214 27.972 1.00 0.00 C ATOM 61 CG PHE A 4 41.129 54.234 28.189 1.00 0.00 C ATOM 62 CD1 PHE A 4 41.152 55.442 27.485 1.00 0.00 C ATOM 63 CD2 PHE A 4 40.102 53.978 29.106 1.00 0.00 C ATOM 64 CE1 PHE A 4 40.141 56.389 27.690 1.00 0.00 C ATOM 65 CE2 PHE A 4 39.095 54.926 29.320 1.00 0.00 C ATOM 66 CZ PHE A 4 39.111 56.128 28.602 1.00 0.00 C ATOM 0 H PHE A 4 40.473 51.476 26.996 1.00 0.00 H new ATOM 0 HA PHE A 4 42.506 53.238 25.832 1.00 0.00 H new ATOM 0 HB2 PHE A 4 42.140 52.449 28.744 1.00 0.00 H new ATOM 0 HB3 PHE A 4 43.186 53.704 28.110 1.00 0.00 H new ATOM 0 HD1 PHE A 4 41.948 55.644 26.784 1.00 0.00 H new ATOM 0 HD2 PHE A 4 40.087 53.045 29.650 1.00 0.00 H new ATOM 0 HE1 PHE A 4 40.156 57.321 27.145 1.00 0.00 H new ATOM 0 HE2 PHE A 4 38.310 54.731 30.035 1.00 0.00 H new ATOM 0 HZ PHE A 4 38.327 56.856 28.752 1.00 0.00 H new ATOM 76 N VAL A 5 44.457 51.647 26.155 1.00 0.00 N ATOM 77 CA VAL A 5 45.597 50.767 26.308 1.00 0.00 C ATOM 78 C VAL A 5 46.719 51.464 27.081 1.00 0.00 C ATOM 79 O VAL A 5 47.166 52.540 26.692 1.00 0.00 O ATOM 80 CB VAL A 5 46.096 50.236 24.967 1.00 0.00 C ATOM 81 CG1 VAL A 5 47.241 49.246 25.152 1.00 0.00 C ATOM 82 CG2 VAL A 5 44.992 49.520 24.193 1.00 0.00 C ATOM 0 H VAL A 5 44.678 52.502 25.645 1.00 0.00 H new ATOM 0 HA VAL A 5 45.268 49.904 26.886 1.00 0.00 H new ATOM 0 HB VAL A 5 46.435 51.109 24.409 1.00 0.00 H new ATOM 0 HG11 VAL A 5 47.573 48.887 24.178 1.00 0.00 H new ATOM 0 HG12 VAL A 5 48.070 49.739 25.659 1.00 0.00 H new ATOM 0 HG13 VAL A 5 46.899 48.403 25.752 1.00 0.00 H new ATOM 0 HG21 VAL A 5 45.389 49.157 23.245 1.00 0.00 H new ATOM 0 HG22 VAL A 5 44.625 48.677 24.779 1.00 0.00 H new ATOM 0 HG23 VAL A 5 44.173 50.213 24.002 1.00 0.00 H new ATOM 92 N LYS A 6 47.187 50.837 28.157 1.00 0.00 N ATOM 93 CA LYS A 6 48.337 51.238 28.942 1.00 0.00 C ATOM 94 C LYS A 6 49.599 50.509 28.475 1.00 0.00 C ATOM 95 O LYS A 6 49.584 49.295 28.287 1.00 0.00 O ATOM 96 CB LYS A 6 48.087 50.988 30.425 1.00 0.00 C ATOM 97 CG LYS A 6 46.881 51.704 31.030 1.00 0.00 C ATOM 98 CD LYS A 6 46.977 53.227 31.026 1.00 0.00 C ATOM 99 CE LYS A 6 45.801 53.900 31.727 1.00 0.00 C ATOM 100 NZ LYS A 6 45.910 53.825 33.192 1.00 0.00 N ATOM 0 H LYS A 6 46.746 49.991 28.519 1.00 0.00 H new ATOM 0 HA LYS A 6 48.492 52.307 28.795 1.00 0.00 H new ATOM 0 HB2 LYS A 6 47.962 49.916 30.576 1.00 0.00 H new ATOM 0 HB3 LYS A 6 48.977 51.286 30.979 1.00 0.00 H new ATOM 0 HG2 LYS A 6 45.987 51.408 30.481 1.00 0.00 H new ATOM 0 HG3 LYS A 6 46.751 51.364 32.058 1.00 0.00 H new ATOM 0 HD2 LYS A 6 47.904 53.528 31.513 1.00 0.00 H new ATOM 0 HD3 LYS A 6 47.029 53.580 29.996 1.00 0.00 H new ATOM 0 HE2 LYS A 6 45.748 54.945 31.421 1.00 0.00 H new ATOM 0 HE3 LYS A 6 44.872 53.427 31.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 45.090 54.295 33.626 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 45.934 52.828 33.488 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 46.783 54.299 33.500 1.00 0.00 H new ATOM 168 N LYS A 11 52.053 55.528 28.141 1.00 0.00 N ATOM 169 CA LYS A 11 50.952 56.093 27.386 1.00 0.00 C ATOM 170 C LYS A 11 49.599 55.626 27.928 1.00 0.00 C ATOM 171 O LYS A 11 49.509 54.597 28.594 1.00 0.00 O ATOM 172 CB LYS A 11 51.063 55.764 25.900 1.00 0.00 C ATOM 173 CG LYS A 11 52.265 56.401 25.209 1.00 0.00 C ATOM 174 CD LYS A 11 52.093 56.274 23.698 1.00 0.00 C ATOM 175 CE LYS A 11 53.254 56.921 22.949 1.00 0.00 C ATOM 176 NZ LYS A 11 52.955 57.000 21.510 1.00 0.00 N ATOM 0 HA LYS A 11 51.014 57.175 27.503 1.00 0.00 H new ATOM 0 HB2 LYS A 11 51.121 54.682 25.782 1.00 0.00 H new ATOM 0 HB3 LYS A 11 50.153 56.091 25.397 1.00 0.00 H new ATOM 0 HG2 LYS A 11 52.349 57.450 25.492 1.00 0.00 H new ATOM 0 HG3 LYS A 11 53.185 55.910 25.526 1.00 0.00 H new ATOM 0 HD2 LYS A 11 52.024 55.221 23.425 1.00 0.00 H new ATOM 0 HD3 LYS A 11 51.157 56.743 23.396 1.00 0.00 H new ATOM 0 HE2 LYS A 11 53.439 57.920 23.344 1.00 0.00 H new ATOM 0 HE3 LYS A 11 54.164 56.343 23.107 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 53.290 57.911 21.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 53.435 56.223 21.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 51.928 56.922 21.364 1.00 0.00 H new ATOM 190 N THR A 12 48.546 56.358 27.577 1.00 0.00 N ATOM 191 CA THR A 12 47.169 55.917 27.673 1.00 0.00 C ATOM 192 C THR A 12 46.521 56.120 26.302 1.00 0.00 C ATOM 193 O THR A 12 45.919 57.157 26.029 1.00 0.00 O ATOM 194 CB THR A 12 46.411 56.632 28.788 1.00 0.00 C ATOM 195 OG1 THR A 12 47.086 56.454 30.013 1.00 0.00 O ATOM 196 CG2 THR A 12 45.008 56.061 28.979 1.00 0.00 C ATOM 0 H THR A 12 48.637 57.304 27.207 1.00 0.00 H new ATOM 0 HA THR A 12 47.134 54.862 27.943 1.00 0.00 H new ATOM 0 HB THR A 12 46.350 57.682 28.503 1.00 0.00 H new ATOM 0 HG1 THR A 12 46.597 56.916 30.726 1.00 0.00 H new ATOM 0 HG21 THR A 12 44.503 56.598 29.782 1.00 0.00 H new ATOM 0 HG22 THR A 12 44.441 56.173 28.055 1.00 0.00 H new ATOM 0 HG23 THR A 12 45.077 55.004 29.237 1.00 0.00 H new ATOM 204 N ILE A 13 46.708 55.142 25.420 1.00 0.00 N ATOM 205 CA ILE A 13 46.316 55.214 24.028 1.00 0.00 C ATOM 206 C ILE A 13 44.811 54.958 23.929 1.00 0.00 C ATOM 207 O ILE A 13 44.350 53.897 24.344 1.00 0.00 O ATOM 208 CB ILE A 13 47.105 54.220 23.178 1.00 0.00 C ATOM 209 CG1 ILE A 13 48.613 54.379 23.350 1.00 0.00 C ATOM 210 CG2 ILE A 13 46.710 54.349 21.710 1.00 0.00 C ATOM 211 CD1 ILE A 13 49.462 53.390 22.556 1.00 0.00 C ATOM 0 H ILE A 13 47.149 54.256 25.667 1.00 0.00 H new ATOM 0 HA ILE A 13 46.541 56.207 23.639 1.00 0.00 H new ATOM 0 HB ILE A 13 46.851 53.219 23.527 1.00 0.00 H new ATOM 0 HG12 ILE A 13 48.892 55.391 23.057 1.00 0.00 H new ATOM 0 HG13 ILE A 13 48.856 54.275 24.408 1.00 0.00 H new ATOM 0 HG21 ILE A 13 47.280 53.635 21.116 1.00 0.00 H new ATOM 0 HG22 ILE A 13 45.645 54.144 21.600 1.00 0.00 H new ATOM 0 HG23 ILE A 13 46.922 55.360 21.364 1.00 0.00 H new ATOM 0 HD11 ILE A 13 50.518 53.584 22.744 1.00 0.00 H new ATOM 0 HD12 ILE A 13 49.219 52.373 22.864 1.00 0.00 H new ATOM 0 HD13 ILE A 13 49.256 53.506 21.492 1.00 0.00 H new ATOM 223 N THR A 14 44.049 55.883 23.352 1.00 0.00 N ATOM 224 CA THR A 14 42.670 55.626 22.990 1.00 0.00 C ATOM 225 C THR A 14 42.598 54.854 21.670 1.00 0.00 C ATOM 226 O THR A 14 43.293 55.196 20.717 1.00 0.00 O ATOM 227 CB THR A 14 41.814 56.887 22.906 1.00 0.00 C ATOM 228 OG1 THR A 14 42.323 57.798 21.957 1.00 0.00 O ATOM 229 CG2 THR A 14 41.715 57.624 24.237 1.00 0.00 C ATOM 0 H THR A 14 44.373 56.824 23.126 1.00 0.00 H new ATOM 0 HA THR A 14 42.254 55.023 23.797 1.00 0.00 H new ATOM 0 HB THR A 14 40.825 56.537 22.611 1.00 0.00 H new ATOM 0 HG1 THR A 14 41.751 58.593 21.927 1.00 0.00 H new ATOM 0 HG21 THR A 14 41.094 58.512 24.116 1.00 0.00 H new ATOM 0 HG22 THR A 14 41.268 56.968 24.984 1.00 0.00 H new ATOM 0 HG23 THR A 14 42.712 57.920 24.564 1.00 0.00 H new ATOM 237 N LEU A 15 41.751 53.830 21.613 1.00 0.00 N ATOM 238 CA LEU A 15 41.441 53.083 20.410 1.00 0.00 C ATOM 239 C LEU A 15 39.930 53.019 20.186 1.00 0.00 C ATOM 240 O LEU A 15 39.154 52.982 21.139 1.00 0.00 O ATOM 241 CB LEU A 15 42.031 51.678 20.473 1.00 0.00 C ATOM 242 CG LEU A 15 43.545 51.588 20.643 1.00 0.00 C ATOM 243 CD1 LEU A 15 43.928 50.121 20.815 1.00 0.00 C ATOM 244 CD2 LEU A 15 44.328 52.131 19.452 1.00 0.00 C ATOM 0 H LEU A 15 41.248 53.491 22.433 1.00 0.00 H new ATOM 0 HA LEU A 15 41.892 53.604 19.566 1.00 0.00 H new ATOM 0 HB2 LEU A 15 41.561 51.146 21.301 1.00 0.00 H new ATOM 0 HB3 LEU A 15 41.757 51.151 19.559 1.00 0.00 H new ATOM 0 HG LEU A 15 43.799 52.196 21.511 1.00 0.00 H new ATOM 0 HD11 LEU A 15 45.008 50.039 20.938 1.00 0.00 H new ATOM 0 HD12 LEU A 15 43.431 49.716 21.696 1.00 0.00 H new ATOM 0 HD13 LEU A 15 43.619 49.559 19.934 1.00 0.00 H new ATOM 0 HD21 LEU A 15 45.397 52.034 19.644 1.00 0.00 H new ATOM 0 HD22 LEU A 15 44.068 51.566 18.557 1.00 0.00 H new ATOM 0 HD23 LEU A 15 44.080 53.182 19.302 1.00 0.00 H new ATOM 256 N GLU A 16 39.530 52.952 18.920 1.00 0.00 N ATOM 257 CA GLU A 16 38.155 52.777 18.498 1.00 0.00 C ATOM 258 C GLU A 16 37.934 51.352 17.985 1.00 0.00 C ATOM 259 O GLU A 16 38.589 50.914 17.043 1.00 0.00 O ATOM 260 CB GLU A 16 37.797 53.820 17.443 1.00 0.00 C ATOM 261 CG GLU A 16 37.599 55.228 17.997 1.00 0.00 C ATOM 262 CD GLU A 16 36.294 55.382 18.780 1.00 0.00 C ATOM 263 OE1 GLU A 16 35.222 55.018 18.248 1.00 0.00 O ATOM 264 OE2 GLU A 16 36.313 55.956 19.889 1.00 0.00 O ATOM 0 H GLU A 16 40.181 53.021 18.137 1.00 0.00 H new ATOM 0 HA GLU A 16 37.493 52.924 19.352 1.00 0.00 H new ATOM 0 HB2 GLU A 16 38.586 53.845 16.691 1.00 0.00 H new ATOM 0 HB3 GLU A 16 36.883 53.509 16.936 1.00 0.00 H new ATOM 0 HG2 GLU A 16 38.438 55.479 18.646 1.00 0.00 H new ATOM 0 HG3 GLU A 16 37.609 55.942 17.173 1.00 0.00 H new ATOM 271 N VAL A 17 37.034 50.620 18.636 1.00 0.00 N ATOM 272 CA VAL A 17 36.787 49.212 18.403 1.00 0.00 C ATOM 273 C VAL A 17 35.295 48.875 18.445 1.00 0.00 C ATOM 274 O VAL A 17 34.519 49.565 19.103 1.00 0.00 O ATOM 275 CB VAL A 17 37.534 48.334 19.402 1.00 0.00 C ATOM 276 CG1 VAL A 17 39.047 48.516 19.322 1.00 0.00 C ATOM 277 CG2 VAL A 17 37.102 48.583 20.845 1.00 0.00 C ATOM 0 H VAL A 17 36.438 51.011 19.366 1.00 0.00 H new ATOM 0 HA VAL A 17 37.161 49.002 17.401 1.00 0.00 H new ATOM 0 HB VAL A 17 37.274 47.314 19.119 1.00 0.00 H new ATOM 0 HG11 VAL A 17 39.531 47.869 20.054 1.00 0.00 H new ATOM 0 HG12 VAL A 17 39.393 48.255 18.322 1.00 0.00 H new ATOM 0 HG13 VAL A 17 39.300 49.555 19.533 1.00 0.00 H new ATOM 0 HG21 VAL A 17 37.666 47.931 21.511 1.00 0.00 H new ATOM 0 HG22 VAL A 17 37.293 49.623 21.108 1.00 0.00 H new ATOM 0 HG23 VAL A 17 36.037 48.373 20.948 1.00 0.00 H new ATOM 287 N GLU A 18 34.905 47.765 17.824 1.00 0.00 N ATOM 288 CA GLU A 18 33.624 47.122 18.039 1.00 0.00 C ATOM 289 C GLU A 18 33.788 45.879 18.914 1.00 0.00 C ATOM 290 O GLU A 18 34.848 45.256 18.869 1.00 0.00 O ATOM 291 CB GLU A 18 32.978 46.761 16.704 1.00 0.00 C ATOM 292 CG GLU A 18 32.559 47.953 15.847 1.00 0.00 C ATOM 293 CD GLU A 18 31.277 48.609 16.364 1.00 0.00 C ATOM 294 OE1 GLU A 18 30.186 48.285 15.848 1.00 0.00 O ATOM 295 OE2 GLU A 18 31.350 49.442 17.294 1.00 0.00 O ATOM 0 H GLU A 18 35.489 47.281 17.142 1.00 0.00 H new ATOM 0 HA GLU A 18 32.969 47.821 18.559 1.00 0.00 H new ATOM 0 HB2 GLU A 18 33.677 46.150 16.133 1.00 0.00 H new ATOM 0 HB3 GLU A 18 32.100 46.145 16.897 1.00 0.00 H new ATOM 0 HG2 GLU A 18 33.363 48.689 15.833 1.00 0.00 H new ATOM 0 HG3 GLU A 18 32.409 47.625 14.818 1.00 0.00 H new ATOM 302 N PRO A 19 32.794 45.436 19.680 1.00 0.00 N ATOM 303 CA PRO A 19 32.891 44.241 20.493 1.00 0.00 C ATOM 304 C PRO A 19 33.193 42.949 19.731 1.00 0.00 C ATOM 305 O PRO A 19 33.654 41.971 20.316 1.00 0.00 O ATOM 306 CB PRO A 19 31.562 44.127 21.235 1.00 0.00 C ATOM 307 CG PRO A 19 31.057 45.567 21.289 1.00 0.00 C ATOM 308 CD PRO A 19 31.557 46.134 19.964 1.00 0.00 C ATOM 0 HA PRO A 19 33.749 44.350 21.157 1.00 0.00 H new ATOM 0 HB2 PRO A 19 30.863 43.477 20.709 1.00 0.00 H new ATOM 0 HB3 PRO A 19 31.695 43.711 22.234 1.00 0.00 H new ATOM 0 HG2 PRO A 19 29.971 45.615 21.368 1.00 0.00 H new ATOM 0 HG3 PRO A 19 31.463 46.109 22.143 1.00 0.00 H new ATOM 0 HD2 PRO A 19 30.827 45.976 19.170 1.00 0.00 H new ATOM 0 HD3 PRO A 19 31.722 47.209 20.036 1.00 0.00 H new ATOM 316 N SER A 20 32.947 42.930 18.424 1.00 0.00 N ATOM 317 CA SER A 20 33.255 41.848 17.510 1.00 0.00 C ATOM 318 C SER A 20 34.611 41.973 16.812 1.00 0.00 C ATOM 319 O SER A 20 34.950 41.103 16.013 1.00 0.00 O ATOM 320 CB SER A 20 32.127 41.732 16.491 1.00 0.00 C ATOM 321 OG SER A 20 31.887 42.976 15.870 1.00 0.00 O ATOM 0 H SER A 20 32.502 43.718 17.953 1.00 0.00 H new ATOM 0 HA SER A 20 33.335 40.939 18.107 1.00 0.00 H new ATOM 0 HB2 SER A 20 32.386 40.988 15.738 1.00 0.00 H new ATOM 0 HB3 SER A 20 31.219 41.385 16.984 1.00 0.00 H new ATOM 0 HG SER A 20 31.161 42.882 15.218 1.00 0.00 H new ATOM 327 N ASP A 21 35.402 43.008 17.084 1.00 0.00 N ATOM 328 CA ASP A 21 36.747 43.127 16.558 1.00 0.00 C ATOM 329 C ASP A 21 37.666 42.036 17.113 1.00 0.00 C ATOM 330 O ASP A 21 37.525 41.618 18.260 1.00 0.00 O ATOM 331 CB ASP A 21 37.340 44.511 16.805 1.00 0.00 C ATOM 332 CG ASP A 21 36.754 45.618 15.926 1.00 0.00 C ATOM 333 OD1 ASP A 21 35.978 45.335 14.988 1.00 0.00 O ATOM 334 OD2 ASP A 21 37.117 46.794 16.149 1.00 0.00 O ATOM 0 H ASP A 21 35.121 43.788 17.679 1.00 0.00 H new ATOM 0 HA ASP A 21 36.673 42.991 15.479 1.00 0.00 H new ATOM 0 HB2 ASP A 21 37.188 44.776 17.851 1.00 0.00 H new ATOM 0 HB3 ASP A 21 38.417 44.466 16.641 1.00 0.00 H new ATOM 339 N THR A 22 38.603 41.570 16.294 1.00 0.00 N ATOM 340 CA THR A 22 39.539 40.524 16.659 1.00 0.00 C ATOM 341 C THR A 22 40.735 41.067 17.444 1.00 0.00 C ATOM 342 O THR A 22 41.057 42.251 17.382 1.00 0.00 O ATOM 343 CB THR A 22 40.025 39.724 15.455 1.00 0.00 C ATOM 344 OG1 THR A 22 40.869 40.514 14.648 1.00 0.00 O ATOM 345 CG2 THR A 22 38.892 39.198 14.579 1.00 0.00 C ATOM 0 H THR A 22 38.732 41.917 15.344 1.00 0.00 H new ATOM 0 HA THR A 22 38.981 39.848 17.307 1.00 0.00 H new ATOM 0 HB THR A 22 40.560 38.869 15.868 1.00 0.00 H new ATOM 0 HG1 THR A 22 41.175 39.987 13.880 1.00 0.00 H new ATOM 0 HG21 THR A 22 39.309 38.639 13.742 1.00 0.00 H new ATOM 0 HG22 THR A 22 38.250 38.544 15.169 1.00 0.00 H new ATOM 0 HG23 THR A 22 38.306 40.035 14.200 1.00 0.00 H new ATOM 353 N ILE A 23 41.450 40.190 18.143 1.00 0.00 N ATOM 354 CA ILE A 23 42.644 40.583 18.862 1.00 0.00 C ATOM 355 C ILE A 23 43.738 41.027 17.888 1.00 0.00 C ATOM 356 O ILE A 23 44.381 42.048 18.121 1.00 0.00 O ATOM 357 CB ILE A 23 43.107 39.488 19.819 1.00 0.00 C ATOM 358 CG1 ILE A 23 42.008 38.885 20.687 1.00 0.00 C ATOM 359 CG2 ILE A 23 44.226 40.020 20.710 1.00 0.00 C ATOM 360 CD1 ILE A 23 41.030 39.853 21.345 1.00 0.00 C ATOM 0 H ILE A 23 41.217 39.200 18.223 1.00 0.00 H new ATOM 0 HA ILE A 23 42.405 41.445 19.486 1.00 0.00 H new ATOM 0 HB ILE A 23 43.459 38.676 19.182 1.00 0.00 H new ATOM 0 HG12 ILE A 23 41.435 38.191 20.072 1.00 0.00 H new ATOM 0 HG13 ILE A 23 42.482 38.298 21.473 1.00 0.00 H new ATOM 0 HG21 ILE A 23 44.553 39.235 21.391 1.00 0.00 H new ATOM 0 HG22 ILE A 23 45.065 40.336 20.090 1.00 0.00 H new ATOM 0 HG23 ILE A 23 43.860 40.870 21.285 1.00 0.00 H new ATOM 0 HD11 ILE A 23 40.302 39.292 21.932 1.00 0.00 H new ATOM 0 HD12 ILE A 23 41.576 40.534 21.998 1.00 0.00 H new ATOM 0 HD13 ILE A 23 40.512 40.426 20.576 1.00 0.00 H new ATOM 372 N GLU A 24 43.899 40.354 16.752 1.00 0.00 N ATOM 373 CA GLU A 24 44.792 40.771 15.690 1.00 0.00 C ATOM 374 C GLU A 24 44.445 42.147 15.117 1.00 0.00 C ATOM 375 O GLU A 24 45.351 42.886 14.738 1.00 0.00 O ATOM 376 CB GLU A 24 44.821 39.768 14.541 1.00 0.00 C ATOM 377 CG GLU A 24 45.348 38.382 14.900 1.00 0.00 C ATOM 378 CD GLU A 24 44.227 37.466 15.395 1.00 0.00 C ATOM 379 OE1 GLU A 24 43.873 37.534 16.592 1.00 0.00 O ATOM 380 OE2 GLU A 24 43.691 36.691 14.574 1.00 0.00 O ATOM 0 H GLU A 24 43.400 39.488 16.546 1.00 0.00 H new ATOM 0 HA GLU A 24 45.774 40.826 16.160 1.00 0.00 H new ATOM 0 HB2 GLU A 24 43.811 39.664 14.146 1.00 0.00 H new ATOM 0 HB3 GLU A 24 45.436 40.176 13.739 1.00 0.00 H new ATOM 0 HG2 GLU A 24 45.825 37.936 14.027 1.00 0.00 H new ATOM 0 HG3 GLU A 24 46.113 38.471 15.671 1.00 0.00 H new ATOM 387 N ASN A 25 43.168 42.512 15.057 1.00 0.00 N ATOM 388 CA ASN A 25 42.746 43.831 14.630 1.00 0.00 C ATOM 389 C ASN A 25 43.157 44.895 15.651 1.00 0.00 C ATOM 390 O ASN A 25 43.707 45.924 15.267 1.00 0.00 O ATOM 391 CB ASN A 25 41.247 43.828 14.347 1.00 0.00 C ATOM 392 CG ASN A 25 40.751 45.136 13.727 1.00 0.00 C ATOM 393 OD1 ASN A 25 41.510 45.968 13.236 1.00 0.00 O ATOM 394 ND2 ASN A 25 39.437 45.330 13.668 1.00 0.00 N ATOM 0 H ASN A 25 42.396 41.893 15.306 1.00 0.00 H new ATOM 0 HA ASN A 25 43.253 44.091 13.701 1.00 0.00 H new ATOM 0 HB2 ASN A 25 41.012 43.002 13.675 1.00 0.00 H new ATOM 0 HB3 ASN A 25 40.708 43.646 15.277 1.00 0.00 H new ATOM 0 HD21 ASN A 25 39.065 46.166 13.217 1.00 0.00 H new ATOM 0 HD22 ASN A 25 38.801 44.643 14.074 1.00 0.00 H new ATOM 401 N VAL A 26 42.985 44.661 16.949 1.00 0.00 N ATOM 402 CA VAL A 26 43.439 45.601 17.955 1.00 0.00 C ATOM 403 C VAL A 26 44.963 45.735 17.959 1.00 0.00 C ATOM 404 O VAL A 26 45.465 46.855 18.011 1.00 0.00 O ATOM 405 CB VAL A 26 42.883 45.279 19.339 1.00 0.00 C ATOM 406 CG1 VAL A 26 43.336 46.296 20.382 1.00 0.00 C ATOM 407 CG2 VAL A 26 41.358 45.335 19.312 1.00 0.00 C ATOM 0 H VAL A 26 42.534 43.826 17.323 1.00 0.00 H new ATOM 0 HA VAL A 26 43.036 46.577 17.682 1.00 0.00 H new ATOM 0 HB VAL A 26 43.250 44.286 19.601 1.00 0.00 H new ATOM 0 HG11 VAL A 26 42.919 46.031 21.354 1.00 0.00 H new ATOM 0 HG12 VAL A 26 44.424 46.295 20.442 1.00 0.00 H new ATOM 0 HG13 VAL A 26 42.989 47.289 20.097 1.00 0.00 H new ATOM 0 HG21 VAL A 26 40.968 45.104 20.303 1.00 0.00 H new ATOM 0 HG22 VAL A 26 41.036 46.334 19.019 1.00 0.00 H new ATOM 0 HG23 VAL A 26 40.980 44.607 18.595 1.00 0.00 H new ATOM 417 N LYS A 27 45.706 44.646 17.782 1.00 0.00 N ATOM 418 CA LYS A 27 47.146 44.689 17.621 1.00 0.00 C ATOM 419 C LYS A 27 47.569 45.514 16.404 1.00 0.00 C ATOM 420 O LYS A 27 48.526 46.280 16.491 1.00 0.00 O ATOM 421 CB LYS A 27 47.708 43.272 17.568 1.00 0.00 C ATOM 422 CG LYS A 27 47.611 42.548 18.908 1.00 0.00 C ATOM 423 CD LYS A 27 47.974 41.070 18.795 1.00 0.00 C ATOM 424 CE LYS A 27 47.914 40.418 20.173 1.00 0.00 C ATOM 425 NZ LYS A 27 47.968 38.951 20.079 1.00 0.00 N ATOM 0 H LYS A 27 45.317 43.704 17.747 1.00 0.00 H new ATOM 0 HA LYS A 27 47.567 45.196 18.490 1.00 0.00 H new ATOM 0 HB2 LYS A 27 47.170 42.701 16.811 1.00 0.00 H new ATOM 0 HB3 LYS A 27 48.752 43.311 17.256 1.00 0.00 H new ATOM 0 HG2 LYS A 27 48.274 43.029 19.627 1.00 0.00 H new ATOM 0 HG3 LYS A 27 46.597 42.642 19.297 1.00 0.00 H new ATOM 0 HD2 LYS A 27 47.286 40.568 18.114 1.00 0.00 H new ATOM 0 HD3 LYS A 27 48.974 40.962 18.375 1.00 0.00 H new ATOM 0 HE2 LYS A 27 48.744 40.775 20.782 1.00 0.00 H new ATOM 0 HE3 LYS A 27 46.996 40.718 20.679 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 47.925 38.540 21.033 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 47.162 38.609 19.518 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 48.856 38.665 19.619 1.00 0.00 H new ATOM 439 N ALA A 28 46.837 45.432 15.297 1.00 0.00 N ATOM 440 CA ALA A 28 47.075 46.240 14.117 1.00 0.00 C ATOM 441 C ALA A 28 46.658 47.703 14.271 1.00 0.00 C ATOM 442 O ALA A 28 47.335 48.583 13.742 1.00 0.00 O ATOM 443 CB ALA A 28 46.388 45.566 12.933 1.00 0.00 C ATOM 0 H ALA A 28 46.050 44.790 15.198 1.00 0.00 H new ATOM 0 HA ALA A 28 48.151 46.291 13.949 1.00 0.00 H new ATOM 0 HB1 ALA A 28 46.553 46.157 12.032 1.00 0.00 H new ATOM 0 HB2 ALA A 28 46.801 44.567 12.793 1.00 0.00 H new ATOM 0 HB3 ALA A 28 45.318 45.492 13.127 1.00 0.00 H new ATOM 449 N LYS A 29 45.615 48.007 15.038 1.00 0.00 N ATOM 450 CA LYS A 29 45.232 49.356 15.407 1.00 0.00 C ATOM 451 C LYS A 29 46.278 50.021 16.305 1.00 0.00 C ATOM 452 O LYS A 29 46.494 51.224 16.179 1.00 0.00 O ATOM 453 CB LYS A 29 43.855 49.352 16.064 1.00 0.00 C ATOM 454 CG LYS A 29 42.725 49.122 15.063 1.00 0.00 C ATOM 455 CD LYS A 29 41.368 48.932 15.735 1.00 0.00 C ATOM 456 CE LYS A 29 40.286 48.785 14.670 1.00 0.00 C ATOM 457 NZ LYS A 29 38.928 48.698 15.232 1.00 0.00 N ATOM 0 H LYS A 29 44.997 47.296 15.429 1.00 0.00 H new ATOM 0 HA LYS A 29 45.178 49.952 14.496 1.00 0.00 H new ATOM 0 HB2 LYS A 29 43.823 48.574 16.827 1.00 0.00 H new ATOM 0 HB3 LYS A 29 43.697 50.303 16.572 1.00 0.00 H new ATOM 0 HG2 LYS A 29 42.672 49.971 14.381 1.00 0.00 H new ATOM 0 HG3 LYS A 29 42.953 48.243 14.460 1.00 0.00 H new ATOM 0 HD2 LYS A 29 41.387 48.048 16.373 1.00 0.00 H new ATOM 0 HD3 LYS A 29 41.147 49.784 16.378 1.00 0.00 H new ATOM 0 HE2 LYS A 29 40.337 49.635 13.990 1.00 0.00 H new ATOM 0 HE3 LYS A 29 40.486 47.891 14.079 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 38.230 48.871 14.481 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 38.778 47.750 15.632 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 38.816 49.411 15.980 1.00 0.00 H new ATOM 471 N ILE A 30 46.963 49.251 17.146 1.00 0.00 N ATOM 472 CA ILE A 30 48.118 49.675 17.912 1.00 0.00 C ATOM 473 C ILE A 30 49.330 49.891 17.001 1.00 0.00 C ATOM 474 O ILE A 30 49.985 50.925 17.108 1.00 0.00 O ATOM 475 CB ILE A 30 48.404 48.691 19.043 1.00 0.00 C ATOM 476 CG1 ILE A 30 47.294 48.765 20.088 1.00 0.00 C ATOM 477 CG2 ILE A 30 49.755 48.938 19.709 1.00 0.00 C ATOM 478 CD1 ILE A 30 47.290 47.592 21.064 1.00 0.00 C ATOM 0 H ILE A 30 46.714 48.276 17.315 1.00 0.00 H new ATOM 0 HA ILE A 30 47.898 50.637 18.374 1.00 0.00 H new ATOM 0 HB ILE A 30 48.438 47.695 18.601 1.00 0.00 H new ATOM 0 HG12 ILE A 30 47.398 49.693 20.650 1.00 0.00 H new ATOM 0 HG13 ILE A 30 46.331 48.806 19.579 1.00 0.00 H new ATOM 0 HG21 ILE A 30 49.906 48.210 20.506 1.00 0.00 H new ATOM 0 HG22 ILE A 30 50.549 48.837 18.969 1.00 0.00 H new ATOM 0 HG23 ILE A 30 49.776 49.944 20.128 1.00 0.00 H new ATOM 0 HD11 ILE A 30 46.474 47.714 21.776 1.00 0.00 H new ATOM 0 HD12 ILE A 30 47.155 46.661 20.513 1.00 0.00 H new ATOM 0 HD13 ILE A 30 48.238 47.562 21.601 1.00 0.00 H new ATOM 490 N GLN A 31 49.603 48.985 16.067 1.00 0.00 N ATOM 491 CA GLN A 31 50.668 49.121 15.095 1.00 0.00 C ATOM 492 C GLN A 31 50.550 50.422 14.298 1.00 0.00 C ATOM 493 O GLN A 31 51.558 51.079 14.050 1.00 0.00 O ATOM 494 CB GLN A 31 50.647 47.913 14.163 1.00 0.00 C ATOM 495 CG GLN A 31 51.808 47.862 13.174 1.00 0.00 C ATOM 496 CD GLN A 31 51.657 46.733 12.152 1.00 0.00 C ATOM 497 OE1 GLN A 31 50.633 46.064 12.042 1.00 0.00 O ATOM 498 NE2 GLN A 31 52.681 46.475 11.344 1.00 0.00 N ATOM 0 H GLN A 31 49.074 48.118 15.968 1.00 0.00 H new ATOM 0 HA GLN A 31 51.619 49.162 15.625 1.00 0.00 H new ATOM 0 HB2 GLN A 31 50.658 47.004 14.765 1.00 0.00 H new ATOM 0 HB3 GLN A 31 49.710 47.915 13.606 1.00 0.00 H new ATOM 0 HG2 GLN A 31 51.877 48.815 12.650 1.00 0.00 H new ATOM 0 HG3 GLN A 31 52.742 47.730 13.721 1.00 0.00 H new ATOM 0 HE21 GLN A 31 53.540 47.020 11.420 1.00 0.00 H new ATOM 0 HE22 GLN A 31 52.607 45.733 10.648 1.00 0.00 H new ATOM 507 N ASP A 32 49.338 50.838 13.944 1.00 0.00 N ATOM 508 CA ASP A 32 49.084 52.060 13.209 1.00 0.00 C ATOM 509 C ASP A 32 49.469 53.337 13.959 1.00 0.00 C ATOM 510 O ASP A 32 49.716 54.360 13.325 1.00 0.00 O ATOM 511 CB ASP A 32 47.621 52.076 12.777 1.00 0.00 C ATOM 512 CG ASP A 32 47.374 53.001 11.583 1.00 0.00 C ATOM 513 OD1 ASP A 32 47.884 52.721 10.477 1.00 0.00 O ATOM 514 OD2 ASP A 32 46.630 53.995 11.731 1.00 0.00 O ATOM 0 H ASP A 32 48.489 50.319 14.168 1.00 0.00 H new ATOM 0 HA ASP A 32 49.735 52.058 12.335 1.00 0.00 H new ATOM 0 HB2 ASP A 32 47.310 51.064 12.519 1.00 0.00 H new ATOM 0 HB3 ASP A 32 47.001 52.396 13.615 1.00 0.00 H new ATOM 519 N LYS A 33 49.588 53.288 15.282 1.00 0.00 N ATOM 520 CA LYS A 33 50.043 54.371 16.131 1.00 0.00 C ATOM 521 C LYS A 33 51.502 54.229 16.572 1.00 0.00 C ATOM 522 O LYS A 33 52.254 55.199 16.525 1.00 0.00 O ATOM 523 CB LYS A 33 49.091 54.533 17.313 1.00 0.00 C ATOM 524 CG LYS A 33 47.702 54.985 16.872 1.00 0.00 C ATOM 525 CD LYS A 33 46.782 55.346 18.035 1.00 0.00 C ATOM 526 CE LYS A 33 45.459 55.874 17.488 1.00 0.00 C ATOM 527 NZ LYS A 33 44.587 56.431 18.534 1.00 0.00 N ATOM 0 H LYS A 33 49.357 52.448 15.812 1.00 0.00 H new ATOM 0 HA LYS A 33 50.024 55.285 15.537 1.00 0.00 H new ATOM 0 HB2 LYS A 33 49.011 53.586 17.847 1.00 0.00 H new ATOM 0 HB3 LYS A 33 49.503 55.260 18.013 1.00 0.00 H new ATOM 0 HG2 LYS A 33 47.801 55.850 16.216 1.00 0.00 H new ATOM 0 HG3 LYS A 33 47.239 54.191 16.286 1.00 0.00 H new ATOM 0 HD2 LYS A 33 46.607 54.470 18.660 1.00 0.00 H new ATOM 0 HD3 LYS A 33 47.254 56.099 18.666 1.00 0.00 H new ATOM 0 HE2 LYS A 33 45.661 56.644 16.743 1.00 0.00 H new ATOM 0 HE3 LYS A 33 44.935 55.066 16.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 43.742 56.850 18.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 44.299 55.673 19.186 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 45.102 57.164 19.062 1.00 0.00 H new ATOM 541 N GLU A 34 51.930 53.030 16.958 1.00 0.00 N ATOM 542 CA GLU A 34 53.173 52.779 17.659 1.00 0.00 C ATOM 543 C GLU A 34 54.250 52.059 16.846 1.00 0.00 C ATOM 544 O GLU A 34 55.376 51.919 17.318 1.00 0.00 O ATOM 545 CB GLU A 34 52.876 51.998 18.936 1.00 0.00 C ATOM 546 CG GLU A 34 51.859 52.645 19.874 1.00 0.00 C ATOM 547 CD GLU A 34 52.268 54.056 20.301 1.00 0.00 C ATOM 548 OE1 GLU A 34 53.298 54.219 20.990 1.00 0.00 O ATOM 549 OE2 GLU A 34 51.592 55.043 19.940 1.00 0.00 O ATOM 0 H GLU A 34 51.396 52.179 16.782 1.00 0.00 H new ATOM 0 HA GLU A 34 53.595 53.760 17.876 1.00 0.00 H new ATOM 0 HB2 GLU A 34 52.513 51.008 18.661 1.00 0.00 H new ATOM 0 HB3 GLU A 34 53.809 51.856 19.481 1.00 0.00 H new ATOM 0 HG2 GLU A 34 50.889 52.686 19.379 1.00 0.00 H new ATOM 0 HG3 GLU A 34 51.739 52.022 20.760 1.00 0.00 H new ATOM 556 N GLY A 35 53.939 51.566 15.650 1.00 0.00 N ATOM 557 CA GLY A 35 54.880 50.913 14.764 1.00 0.00 C ATOM 558 C GLY A 35 55.306 49.493 15.143 1.00 0.00 C ATOM 559 O GLY A 35 56.137 48.901 14.458 1.00 0.00 O ATOM 0 H GLY A 35 52.996 51.615 15.265 1.00 0.00 H new ATOM 0 HA2 GLY A 35 54.443 50.883 13.766 1.00 0.00 H new ATOM 0 HA3 GLY A 35 55.775 51.532 14.702 1.00 0.00 H new ATOM 563 N ILE A 36 54.749 48.925 16.210 1.00 0.00 N ATOM 564 CA ILE A 36 55.080 47.617 16.737 1.00 0.00 C ATOM 565 C ILE A 36 54.257 46.555 16.008 1.00 0.00 C ATOM 566 O ILE A 36 53.033 46.597 16.112 1.00 0.00 O ATOM 567 CB ILE A 36 54.856 47.558 18.246 1.00 0.00 C ATOM 568 CG1 ILE A 36 55.606 48.679 18.962 1.00 0.00 C ATOM 569 CG2 ILE A 36 55.264 46.197 18.803 1.00 0.00 C ATOM 570 CD1 ILE A 36 55.416 48.724 20.475 1.00 0.00 C ATOM 0 H ILE A 36 54.021 49.392 16.751 1.00 0.00 H new ATOM 0 HA ILE A 36 56.138 47.421 16.566 1.00 0.00 H new ATOM 0 HB ILE A 36 53.790 47.698 18.428 1.00 0.00 H new ATOM 0 HG12 ILE A 36 56.670 48.577 18.748 1.00 0.00 H new ATOM 0 HG13 ILE A 36 55.287 49.633 18.543 1.00 0.00 H new ATOM 0 HG21 ILE A 36 55.095 46.179 19.880 1.00 0.00 H new ATOM 0 HG22 ILE A 36 54.668 45.417 18.329 1.00 0.00 H new ATOM 0 HG23 ILE A 36 56.320 46.022 18.598 1.00 0.00 H new ATOM 0 HD11 ILE A 36 55.989 49.554 20.889 1.00 0.00 H new ATOM 0 HD12 ILE A 36 54.359 48.861 20.705 1.00 0.00 H new ATOM 0 HD13 ILE A 36 55.764 47.789 20.913 1.00 0.00 H new ATOM 582 N PRO A 37 54.849 45.599 15.297 1.00 0.00 N ATOM 583 CA PRO A 37 54.099 44.609 14.550 1.00 0.00 C ATOM 584 C PRO A 37 53.398 43.612 15.474 1.00 0.00 C ATOM 585 O PRO A 37 53.967 43.261 16.506 1.00 0.00 O ATOM 586 CB PRO A 37 55.112 43.949 13.618 1.00 0.00 C ATOM 587 CG PRO A 37 56.422 44.059 14.393 1.00 0.00 C ATOM 588 CD PRO A 37 56.273 45.387 15.129 1.00 0.00 C ATOM 0 HA PRO A 37 53.287 45.059 13.978 1.00 0.00 H new ATOM 0 HB2 PRO A 37 54.852 42.911 13.411 1.00 0.00 H new ATOM 0 HB3 PRO A 37 55.168 44.461 12.657 1.00 0.00 H new ATOM 0 HG2 PRO A 37 56.553 43.227 15.084 1.00 0.00 H new ATOM 0 HG3 PRO A 37 57.286 44.060 13.728 1.00 0.00 H new ATOM 0 HD2 PRO A 37 56.778 45.356 16.094 1.00 0.00 H new ATOM 0 HD3 PRO A 37 56.723 46.200 14.560 1.00 0.00 H new ATOM 596 N PRO A 38 52.202 43.127 15.155 1.00 0.00 N ATOM 597 CA PRO A 38 51.429 42.236 15.996 1.00 0.00 C ATOM 598 C PRO A 38 52.163 41.024 16.574 1.00 0.00 C ATOM 599 O PRO A 38 51.926 40.681 17.730 1.00 0.00 O ATOM 600 CB PRO A 38 50.251 41.788 15.137 1.00 0.00 C ATOM 601 CG PRO A 38 49.976 43.021 14.280 1.00 0.00 C ATOM 602 CD PRO A 38 51.380 43.574 14.049 1.00 0.00 C ATOM 0 HA PRO A 38 51.147 42.787 16.893 1.00 0.00 H new ATOM 0 HB2 PRO A 38 50.500 40.919 14.528 1.00 0.00 H new ATOM 0 HB3 PRO A 38 49.388 41.515 15.744 1.00 0.00 H new ATOM 0 HG2 PRO A 38 49.481 42.764 13.344 1.00 0.00 H new ATOM 0 HG3 PRO A 38 49.335 43.738 14.793 1.00 0.00 H new ATOM 0 HD2 PRO A 38 51.783 43.218 13.101 1.00 0.00 H new ATOM 0 HD3 PRO A 38 51.362 44.663 13.998 1.00 0.00 H new ATOM 610 N ASP A 39 53.089 40.403 15.848 1.00 0.00 N ATOM 611 CA ASP A 39 53.829 39.252 16.322 1.00 0.00 C ATOM 612 C ASP A 39 54.808 39.565 17.456 1.00 0.00 C ATOM 613 O ASP A 39 55.301 38.651 18.112 1.00 0.00 O ATOM 614 CB ASP A 39 54.490 38.501 15.170 1.00 0.00 C ATOM 615 CG ASP A 39 55.712 39.198 14.567 1.00 0.00 C ATOM 616 OD1 ASP A 39 55.524 40.098 13.720 1.00 0.00 O ATOM 617 OD2 ASP A 39 56.859 38.830 14.896 1.00 0.00 O ATOM 0 H ASP A 39 53.345 40.693 14.904 1.00 0.00 H new ATOM 0 HA ASP A 39 53.091 38.586 16.770 1.00 0.00 H new ATOM 0 HB2 ASP A 39 54.789 37.514 15.522 1.00 0.00 H new ATOM 0 HB3 ASP A 39 53.751 38.348 14.383 1.00 0.00 H new ATOM 622 N GLN A 40 55.074 40.837 17.737 1.00 0.00 N ATOM 623 CA GLN A 40 55.900 41.307 18.831 1.00 0.00 C ATOM 624 C GLN A 40 55.089 41.760 20.047 1.00 0.00 C ATOM 625 O GLN A 40 55.676 42.082 21.078 1.00 0.00 O ATOM 626 CB GLN A 40 56.841 42.386 18.303 1.00 0.00 C ATOM 627 CG GLN A 40 57.819 41.837 17.269 1.00 0.00 C ATOM 628 CD GLN A 40 58.838 42.849 16.743 1.00 0.00 C ATOM 629 OE1 GLN A 40 58.970 43.989 17.185 1.00 0.00 O ATOM 630 NE2 GLN A 40 59.634 42.453 15.754 1.00 0.00 N ATOM 0 H GLN A 40 54.698 41.602 17.177 1.00 0.00 H new ATOM 0 HA GLN A 40 56.493 40.474 19.207 1.00 0.00 H new ATOM 0 HB2 GLN A 40 56.256 43.190 17.857 1.00 0.00 H new ATOM 0 HB3 GLN A 40 57.398 42.820 19.134 1.00 0.00 H new ATOM 0 HG2 GLN A 40 58.357 40.998 17.709 1.00 0.00 H new ATOM 0 HG3 GLN A 40 57.251 41.444 16.426 1.00 0.00 H new ATOM 0 HE21 GLN A 40 59.543 41.512 15.372 1.00 0.00 H new ATOM 0 HE22 GLN A 40 60.336 43.090 15.378 1.00 0.00 H new ATOM 639 N GLN A 41 53.762 41.750 19.964 1.00 0.00 N ATOM 640 CA GLN A 41 52.845 42.185 20.998 1.00 0.00 C ATOM 641 C GLN A 41 52.204 41.014 21.745 1.00 0.00 C ATOM 642 O GLN A 41 52.014 39.944 21.173 1.00 0.00 O ATOM 643 CB GLN A 41 51.727 43.033 20.397 1.00 0.00 C ATOM 644 CG GLN A 41 52.146 44.260 19.590 1.00 0.00 C ATOM 645 CD GLN A 41 50.932 45.020 19.051 1.00 0.00 C ATOM 646 OE1 GLN A 41 49.861 45.049 19.652 1.00 0.00 O ATOM 647 NE2 GLN A 41 51.009 45.650 17.882 1.00 0.00 N ATOM 0 H GLN A 41 53.278 41.420 19.129 1.00 0.00 H new ATOM 0 HA GLN A 41 53.437 42.767 21.704 1.00 0.00 H new ATOM 0 HB2 GLN A 41 51.125 42.393 19.752 1.00 0.00 H new ATOM 0 HB3 GLN A 41 51.080 43.366 21.209 1.00 0.00 H new ATOM 0 HG2 GLN A 41 52.742 44.923 20.217 1.00 0.00 H new ATOM 0 HG3 GLN A 41 52.781 43.951 18.760 1.00 0.00 H new ATOM 0 HE21 GLN A 41 51.883 45.646 17.357 1.00 0.00 H new ATOM 0 HE22 GLN A 41 50.194 46.137 17.511 1.00 0.00 H new ATOM 656 N ARG A 42 51.764 41.237 22.980 1.00 0.00 N ATOM 657 CA ARG A 42 50.689 40.535 23.652 1.00 0.00 C ATOM 658 C ARG A 42 49.710 41.567 24.214 1.00 0.00 C ATOM 659 O ARG A 42 50.152 42.627 24.653 1.00 0.00 O ATOM 660 CB ARG A 42 51.202 39.675 24.803 1.00 0.00 C ATOM 661 CG ARG A 42 52.008 38.447 24.387 1.00 0.00 C ATOM 662 CD ARG A 42 52.430 37.668 25.628 1.00 0.00 C ATOM 663 NE ARG A 42 53.353 36.578 25.306 1.00 0.00 N ATOM 664 CZ ARG A 42 53.133 35.257 25.328 1.00 0.00 C ATOM 665 NH1 ARG A 42 51.963 34.691 25.654 1.00 0.00 N ATOM 666 NH2 ARG A 42 54.140 34.427 25.020 1.00 0.00 N ATOM 0 H ARG A 42 52.178 41.959 23.570 1.00 0.00 H new ATOM 0 HA ARG A 42 50.207 39.879 22.927 1.00 0.00 H new ATOM 0 HB2 ARG A 42 51.822 40.295 25.450 1.00 0.00 H new ATOM 0 HB3 ARG A 42 50.350 39.346 25.398 1.00 0.00 H new ATOM 0 HG2 ARG A 42 51.411 37.812 23.732 1.00 0.00 H new ATOM 0 HG3 ARG A 42 52.888 38.752 23.820 1.00 0.00 H new ATOM 0 HD2 ARG A 42 52.904 38.346 26.338 1.00 0.00 H new ATOM 0 HD3 ARG A 42 51.546 37.261 26.118 1.00 0.00 H new ATOM 0 HE ARG A 42 54.292 36.864 25.027 1.00 0.00 H new ATOM 0 HH11 ARG A 42 51.167 35.276 25.907 1.00 0.00 H new ATOM 0 HH12 ARG A 42 51.869 33.675 25.649 1.00 0.00 H new ATOM 0 HH21 ARG A 42 55.055 34.805 24.774 1.00 0.00 H new ATOM 0 HH22 ARG A 42 53.991 33.418 25.031 1.00 0.00 H new ATOM 680 N LEU A 43 48.415 41.265 24.245 1.00 0.00 N ATOM 681 CA LEU A 43 47.405 42.102 24.859 1.00 0.00 C ATOM 682 C LEU A 43 46.730 41.394 26.035 1.00 0.00 C ATOM 683 O LEU A 43 46.365 40.224 25.943 1.00 0.00 O ATOM 684 CB LEU A 43 46.386 42.567 23.822 1.00 0.00 C ATOM 685 CG LEU A 43 46.945 43.390 22.665 1.00 0.00 C ATOM 686 CD1 LEU A 43 45.811 43.816 21.739 1.00 0.00 C ATOM 687 CD2 LEU A 43 47.665 44.659 23.111 1.00 0.00 C ATOM 0 H LEU A 43 48.037 40.412 23.833 1.00 0.00 H new ATOM 0 HA LEU A 43 47.899 42.986 25.261 1.00 0.00 H new ATOM 0 HB2 LEU A 43 45.887 41.689 23.411 1.00 0.00 H new ATOM 0 HB3 LEU A 43 45.624 43.159 24.329 1.00 0.00 H new ATOM 0 HG LEU A 43 47.666 42.744 22.164 1.00 0.00 H new ATOM 0 HD11 LEU A 43 46.216 44.403 20.915 1.00 0.00 H new ATOM 0 HD12 LEU A 43 45.312 42.931 21.344 1.00 0.00 H new ATOM 0 HD13 LEU A 43 45.093 44.419 22.296 1.00 0.00 H new ATOM 0 HD21 LEU A 43 48.036 45.193 22.236 1.00 0.00 H new ATOM 0 HD22 LEU A 43 46.972 45.297 23.659 1.00 0.00 H new ATOM 0 HD23 LEU A 43 48.502 44.394 23.757 1.00 0.00 H new ATOM 699 N ILE A 44 46.570 42.117 27.139 1.00 0.00 N ATOM 700 CA ILE A 44 45.987 41.650 28.381 1.00 0.00 C ATOM 701 C ILE A 44 44.799 42.529 28.777 1.00 0.00 C ATOM 702 O ILE A 44 44.833 43.748 28.623 1.00 0.00 O ATOM 703 CB ILE A 44 47.058 41.546 29.463 1.00 0.00 C ATOM 704 CG1 ILE A 44 47.992 40.381 29.149 1.00 0.00 C ATOM 705 CG2 ILE A 44 46.473 41.388 30.863 1.00 0.00 C ATOM 706 CD1 ILE A 44 49.225 40.279 30.042 1.00 0.00 C ATOM 0 H ILE A 44 46.860 43.094 27.188 1.00 0.00 H new ATOM 0 HA ILE A 44 45.589 40.644 28.246 1.00 0.00 H new ATOM 0 HB ILE A 44 47.613 42.484 29.460 1.00 0.00 H new ATOM 0 HG12 ILE A 44 47.428 39.452 29.228 1.00 0.00 H new ATOM 0 HG13 ILE A 44 48.319 40.468 28.113 1.00 0.00 H new ATOM 0 HG21 ILE A 44 47.282 41.319 31.590 1.00 0.00 H new ATOM 0 HG22 ILE A 44 45.848 42.250 31.096 1.00 0.00 H new ATOM 0 HG23 ILE A 44 45.870 40.481 30.905 1.00 0.00 H new ATOM 0 HD11 ILE A 44 49.824 39.420 29.739 1.00 0.00 H new ATOM 0 HD12 ILE A 44 49.819 41.188 29.947 1.00 0.00 H new ATOM 0 HD13 ILE A 44 48.914 40.156 31.079 1.00 0.00 H new ATOM 718 N PHE A 45 43.758 41.901 29.316 1.00 0.00 N ATOM 719 CA PHE A 45 42.653 42.560 29.985 1.00 0.00 C ATOM 720 C PHE A 45 42.397 41.929 31.355 1.00 0.00 C ATOM 721 O PHE A 45 42.069 40.746 31.415 1.00 0.00 O ATOM 722 CB PHE A 45 41.403 42.480 29.114 1.00 0.00 C ATOM 723 CG PHE A 45 40.205 43.200 29.686 1.00 0.00 C ATOM 724 CD1 PHE A 45 40.304 44.542 30.073 1.00 0.00 C ATOM 725 CD2 PHE A 45 38.988 42.527 29.843 1.00 0.00 C ATOM 726 CE1 PHE A 45 39.201 45.201 30.627 1.00 0.00 C ATOM 727 CE2 PHE A 45 37.873 43.193 30.368 1.00 0.00 C ATOM 728 CZ PHE A 45 37.979 44.531 30.765 1.00 0.00 C ATOM 0 H PHE A 45 43.662 40.886 29.296 1.00 0.00 H new ATOM 0 HA PHE A 45 42.909 43.608 30.141 1.00 0.00 H new ATOM 0 HB2 PHE A 45 41.630 42.897 28.133 1.00 0.00 H new ATOM 0 HB3 PHE A 45 41.145 41.432 28.963 1.00 0.00 H new ATOM 0 HD1 PHE A 45 41.236 45.071 29.943 1.00 0.00 H new ATOM 0 HD2 PHE A 45 38.908 41.488 29.558 1.00 0.00 H new ATOM 0 HE1 PHE A 45 39.292 46.228 30.949 1.00 0.00 H new ATOM 0 HE2 PHE A 45 36.931 42.674 30.466 1.00 0.00 H new ATOM 0 HZ PHE A 45 37.122 45.044 31.176 1.00 0.00 H new ATOM 738 N ALA A 46 42.529 42.687 32.440 1.00 0.00 N ATOM 739 CA ALA A 46 42.133 42.289 33.776 1.00 0.00 C ATOM 740 C ALA A 46 42.623 40.905 34.204 1.00 0.00 C ATOM 741 O ALA A 46 41.861 40.079 34.700 1.00 0.00 O ATOM 742 CB ALA A 46 40.628 42.504 33.908 1.00 0.00 C ATOM 0 H ALA A 46 42.928 43.625 32.406 1.00 0.00 H new ATOM 0 HA ALA A 46 42.644 42.926 34.499 1.00 0.00 H new ATOM 0 HB1 ALA A 46 40.305 42.211 34.907 1.00 0.00 H new ATOM 0 HB2 ALA A 46 40.395 43.556 33.745 1.00 0.00 H new ATOM 0 HB3 ALA A 46 40.107 41.898 33.166 1.00 0.00 H new ATOM 748 N GLY A 47 43.902 40.618 33.973 1.00 0.00 N ATOM 749 CA GLY A 47 44.541 39.350 34.257 1.00 0.00 C ATOM 750 C GLY A 47 44.315 38.226 33.243 1.00 0.00 C ATOM 751 O GLY A 47 44.734 37.100 33.499 1.00 0.00 O ATOM 0 H GLY A 47 44.543 41.298 33.565 1.00 0.00 H new ATOM 0 HA2 GLY A 47 45.614 39.521 34.342 1.00 0.00 H new ATOM 0 HA3 GLY A 47 44.195 39.005 35.231 1.00 0.00 H new ATOM 755 N LYS A 48 43.665 38.482 32.111 1.00 0.00 N ATOM 756 CA LYS A 48 43.431 37.535 31.040 1.00 0.00 C ATOM 757 C LYS A 48 44.276 37.871 29.809 1.00 0.00 C ATOM 758 O LYS A 48 44.226 39.004 29.335 1.00 0.00 O ATOM 759 CB LYS A 48 41.955 37.496 30.659 1.00 0.00 C ATOM 760 CG LYS A 48 41.074 37.062 31.827 1.00 0.00 C ATOM 761 CD LYS A 48 39.593 37.052 31.457 1.00 0.00 C ATOM 762 CE LYS A 48 38.734 36.501 32.592 1.00 0.00 C ATOM 763 NZ LYS A 48 38.858 37.281 33.833 1.00 0.00 N ATOM 0 H LYS A 48 43.271 39.401 31.912 1.00 0.00 H new ATOM 0 HA LYS A 48 43.726 36.551 31.405 1.00 0.00 H new ATOM 0 HB2 LYS A 48 41.643 38.483 30.317 1.00 0.00 H new ATOM 0 HB3 LYS A 48 41.814 36.810 29.824 1.00 0.00 H new ATOM 0 HG2 LYS A 48 41.372 36.066 32.155 1.00 0.00 H new ATOM 0 HG3 LYS A 48 41.232 37.735 32.669 1.00 0.00 H new ATOM 0 HD2 LYS A 48 39.271 38.065 31.215 1.00 0.00 H new ATOM 0 HD3 LYS A 48 39.445 36.448 30.562 1.00 0.00 H new ATOM 0 HE2 LYS A 48 37.690 36.490 32.279 1.00 0.00 H new ATOM 0 HE3 LYS A 48 39.019 35.467 32.788 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 38.156 36.947 34.524 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 39.814 37.161 34.224 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 38.691 38.287 33.629 1.00 0.00 H new ATOM 777 N GLN A 49 45.009 36.904 29.266 1.00 0.00 N ATOM 778 CA GLN A 49 45.628 37.039 27.962 1.00 0.00 C ATOM 779 C GLN A 49 44.579 36.937 26.853 1.00 0.00 C ATOM 780 O GLN A 49 43.790 35.995 26.830 1.00 0.00 O ATOM 781 CB GLN A 49 46.698 35.975 27.738 1.00 0.00 C ATOM 782 CG GLN A 49 47.972 36.202 28.546 1.00 0.00 C ATOM 783 CD GLN A 49 49.106 35.362 27.956 1.00 0.00 C ATOM 784 OE1 GLN A 49 49.691 35.719 26.936 1.00 0.00 O ATOM 785 NE2 GLN A 49 49.421 34.200 28.522 1.00 0.00 N ATOM 0 H GLN A 49 45.187 36.008 29.720 1.00 0.00 H new ATOM 0 HA GLN A 49 46.099 38.021 27.930 1.00 0.00 H new ATOM 0 HB2 GLN A 49 46.286 34.999 27.994 1.00 0.00 H new ATOM 0 HB3 GLN A 49 46.952 35.946 26.678 1.00 0.00 H new ATOM 0 HG2 GLN A 49 48.242 37.258 28.531 1.00 0.00 H new ATOM 0 HG3 GLN A 49 47.808 35.930 29.589 1.00 0.00 H new ATOM 0 HE21 GLN A 49 48.939 33.898 29.369 1.00 0.00 H new ATOM 0 HE22 GLN A 49 50.144 33.611 28.109 1.00 0.00 H new ATOM 794 N LEU A 50 44.597 37.883 25.918 1.00 0.00 N ATOM 795 CA LEU A 50 43.696 37.915 24.785 1.00 0.00 C ATOM 796 C LEU A 50 44.277 37.084 23.639 1.00 0.00 C ATOM 797 O LEU A 50 45.335 37.414 23.108 1.00 0.00 O ATOM 798 CB LEU A 50 43.420 39.364 24.394 1.00 0.00 C ATOM 799 CG LEU A 50 42.905 40.271 25.508 1.00 0.00 C ATOM 800 CD1 LEU A 50 42.609 41.662 24.953 1.00 0.00 C ATOM 801 CD2 LEU A 50 41.622 39.741 26.143 1.00 0.00 C ATOM 0 H LEU A 50 45.255 38.662 25.933 1.00 0.00 H new ATOM 0 HA LEU A 50 42.737 37.466 25.045 1.00 0.00 H new ATOM 0 HB2 LEU A 50 44.340 39.794 23.998 1.00 0.00 H new ATOM 0 HB3 LEU A 50 42.692 39.368 23.583 1.00 0.00 H new ATOM 0 HG LEU A 50 43.686 40.305 26.267 1.00 0.00 H new ATOM 0 HD11 LEU A 50 42.242 42.303 25.755 1.00 0.00 H new ATOM 0 HD12 LEU A 50 43.521 42.089 24.536 1.00 0.00 H new ATOM 0 HD13 LEU A 50 41.852 41.589 24.172 1.00 0.00 H new ATOM 0 HD21 LEU A 50 41.297 40.422 26.929 1.00 0.00 H new ATOM 0 HD22 LEU A 50 40.844 39.666 25.383 1.00 0.00 H new ATOM 0 HD23 LEU A 50 41.808 38.756 26.570 1.00 0.00 H new ATOM 813 N GLU A 51 43.607 35.989 23.290 1.00 0.00 N ATOM 814 CA GLU A 51 44.115 34.977 22.386 1.00 0.00 C ATOM 815 C GLU A 51 43.791 35.214 20.909 1.00 0.00 C ATOM 816 O GLU A 51 42.771 35.806 20.563 1.00 0.00 O ATOM 817 CB GLU A 51 43.637 33.595 22.822 1.00 0.00 C ATOM 818 CG GLU A 51 44.324 33.148 24.109 1.00 0.00 C ATOM 819 CD GLU A 51 43.823 31.788 24.604 1.00 0.00 C ATOM 820 OE1 GLU A 51 43.571 30.889 23.774 1.00 0.00 O ATOM 821 OE2 GLU A 51 43.739 31.606 25.837 1.00 0.00 O ATOM 0 H GLU A 51 42.672 35.781 23.641 1.00 0.00 H new ATOM 0 HA GLU A 51 45.201 35.042 22.455 1.00 0.00 H new ATOM 0 HB2 GLU A 51 42.557 33.612 22.971 1.00 0.00 H new ATOM 0 HB3 GLU A 51 43.838 32.873 22.031 1.00 0.00 H new ATOM 0 HG2 GLU A 51 45.400 33.096 23.943 1.00 0.00 H new ATOM 0 HG3 GLU A 51 44.157 33.896 24.884 1.00 0.00 H new ATOM 828 N ASP A 52 44.630 34.670 20.032 1.00 0.00 N ATOM 829 CA ASP A 52 44.514 34.850 18.599 1.00 0.00 C ATOM 830 C ASP A 52 43.216 34.258 18.047 1.00 0.00 C ATOM 831 O ASP A 52 42.788 33.178 18.448 1.00 0.00 O ATOM 832 CB ASP A 52 45.717 34.262 17.868 1.00 0.00 C ATOM 833 CG ASP A 52 47.001 35.075 18.050 1.00 0.00 C ATOM 834 OD1 ASP A 52 47.234 35.992 17.231 1.00 0.00 O ATOM 835 OD2 ASP A 52 47.769 34.785 18.991 1.00 0.00 O ATOM 0 H ASP A 52 45.419 34.084 20.307 1.00 0.00 H new ATOM 0 HA ASP A 52 44.490 35.925 18.420 1.00 0.00 H new ATOM 0 HB2 ASP A 52 45.887 33.246 18.224 1.00 0.00 H new ATOM 0 HB3 ASP A 52 45.488 34.193 16.805 1.00 0.00 H new ATOM 840 N GLY A 53 42.599 34.987 17.122 1.00 0.00 N ATOM 841 CA GLY A 53 41.357 34.650 16.457 1.00 0.00 C ATOM 842 C GLY A 53 40.087 35.043 17.216 1.00 0.00 C ATOM 843 O GLY A 53 39.030 35.140 16.596 1.00 0.00 O ATOM 0 H GLY A 53 42.979 35.878 16.803 1.00 0.00 H new ATOM 0 HA2 GLY A 53 41.343 35.134 15.481 1.00 0.00 H new ATOM 0 HA3 GLY A 53 41.338 33.575 16.280 1.00 0.00 H new ATOM 847 N ARG A 54 40.167 35.290 18.521 1.00 0.00 N ATOM 848 CA ARG A 54 39.045 35.636 19.370 1.00 0.00 C ATOM 849 C ARG A 54 38.677 37.118 19.272 1.00 0.00 C ATOM 850 O ARG A 54 39.382 37.891 18.627 1.00 0.00 O ATOM 851 CB ARG A 54 39.307 35.192 20.807 1.00 0.00 C ATOM 852 CG ARG A 54 39.668 33.714 20.922 1.00 0.00 C ATOM 853 CD ARG A 54 39.594 33.224 22.365 1.00 0.00 C ATOM 854 NE ARG A 54 38.216 33.007 22.806 1.00 0.00 N ATOM 855 CZ ARG A 54 37.791 32.900 24.072 1.00 0.00 C ATOM 856 NH1 ARG A 54 38.598 33.143 25.113 1.00 0.00 N ATOM 857 NH2 ARG A 54 36.524 32.557 24.342 1.00 0.00 N ATOM 0 H ARG A 54 41.051 35.252 19.029 1.00 0.00 H new ATOM 0 HA ARG A 54 38.172 35.093 19.009 1.00 0.00 H new ATOM 0 HB2 ARG A 54 40.117 35.791 21.224 1.00 0.00 H new ATOM 0 HB3 ARG A 54 38.421 35.391 21.409 1.00 0.00 H new ATOM 0 HG2 ARG A 54 38.991 33.125 20.303 1.00 0.00 H new ATOM 0 HG3 ARG A 54 40.674 33.554 20.535 1.00 0.00 H new ATOM 0 HD2 ARG A 54 40.155 32.294 22.460 1.00 0.00 H new ATOM 0 HD3 ARG A 54 40.072 33.953 23.019 1.00 0.00 H new ATOM 0 HE ARG A 54 37.508 32.929 22.076 1.00 0.00 H new ATOM 0 HH11 ARG A 54 39.567 33.419 24.954 1.00 0.00 H new ATOM 0 HH12 ARG A 54 38.243 33.053 26.065 1.00 0.00 H new ATOM 0 HH21 ARG A 54 35.872 32.374 23.580 1.00 0.00 H new ATOM 0 HH22 ARG A 54 36.212 32.479 25.310 1.00 0.00 H new ATOM 871 N THR A 55 37.581 37.525 19.904 1.00 0.00 N ATOM 872 CA THR A 55 37.039 38.869 19.852 1.00 0.00 C ATOM 873 C THR A 55 36.865 39.510 21.229 1.00 0.00 C ATOM 874 O THR A 55 36.837 38.826 22.250 1.00 0.00 O ATOM 875 CB THR A 55 35.719 38.924 19.088 1.00 0.00 C ATOM 876 OG1 THR A 55 34.692 38.239 19.767 1.00 0.00 O ATOM 877 CG2 THR A 55 35.806 38.342 17.680 1.00 0.00 C ATOM 0 H THR A 55 37.027 36.899 20.489 1.00 0.00 H new ATOM 0 HA THR A 55 37.786 39.452 19.313 1.00 0.00 H new ATOM 0 HB THR A 55 35.492 39.988 19.018 1.00 0.00 H new ATOM 0 HG1 THR A 55 35.083 37.539 20.331 1.00 0.00 H new ATOM 0 HG21 THR A 55 34.832 38.414 17.196 1.00 0.00 H new ATOM 0 HG22 THR A 55 36.542 38.900 17.101 1.00 0.00 H new ATOM 0 HG23 THR A 55 36.107 37.296 17.737 1.00 0.00 H new ATOM 885 N LEU A 56 36.739 40.834 21.276 1.00 0.00 N ATOM 886 CA LEU A 56 36.713 41.593 22.509 1.00 0.00 C ATOM 887 C LEU A 56 35.550 41.238 23.439 1.00 0.00 C ATOM 888 O LEU A 56 35.718 41.154 24.653 1.00 0.00 O ATOM 889 CB LEU A 56 36.718 43.085 22.188 1.00 0.00 C ATOM 890 CG LEU A 56 37.815 43.569 21.244 1.00 0.00 C ATOM 891 CD1 LEU A 56 37.772 45.091 21.145 1.00 0.00 C ATOM 892 CD2 LEU A 56 39.217 43.153 21.679 1.00 0.00 C ATOM 0 H LEU A 56 36.651 41.413 20.441 1.00 0.00 H new ATOM 0 HA LEU A 56 37.612 41.323 23.062 1.00 0.00 H new ATOM 0 HB2 LEU A 56 35.753 43.345 21.753 1.00 0.00 H new ATOM 0 HB3 LEU A 56 36.804 43.636 23.124 1.00 0.00 H new ATOM 0 HG LEU A 56 37.617 43.100 20.280 1.00 0.00 H new ATOM 0 HD11 LEU A 56 38.556 45.434 20.470 1.00 0.00 H new ATOM 0 HD12 LEU A 56 36.801 45.403 20.761 1.00 0.00 H new ATOM 0 HD13 LEU A 56 37.928 45.524 22.133 1.00 0.00 H new ATOM 0 HD21 LEU A 56 39.947 43.530 20.963 1.00 0.00 H new ATOM 0 HD22 LEU A 56 39.429 43.565 22.665 1.00 0.00 H new ATOM 0 HD23 LEU A 56 39.278 42.065 21.720 1.00 0.00 H new ATOM 904 N SER A 57 34.378 40.967 22.870 1.00 0.00 N ATOM 905 CA SER A 57 33.197 40.502 23.570 1.00 0.00 C ATOM 906 C SER A 57 33.392 39.165 24.290 1.00 0.00 C ATOM 907 O SER A 57 32.818 38.976 25.360 1.00 0.00 O ATOM 908 CB SER A 57 32.021 40.386 22.607 1.00 0.00 C ATOM 909 OG SER A 57 32.363 39.587 21.496 1.00 0.00 O ATOM 0 H SER A 57 34.225 41.072 21.867 1.00 0.00 H new ATOM 0 HA SER A 57 32.994 41.250 24.337 1.00 0.00 H new ATOM 0 HB2 SER A 57 31.164 39.953 23.123 1.00 0.00 H new ATOM 0 HB3 SER A 57 31.722 41.378 22.269 1.00 0.00 H new ATOM 0 HG SER A 57 32.796 40.142 20.815 1.00 0.00 H new ATOM 915 N ASP A 58 34.245 38.276 23.792 1.00 0.00 N ATOM 916 CA ASP A 58 34.545 37.009 24.429 1.00 0.00 C ATOM 917 C ASP A 58 35.241 37.178 25.780 1.00 0.00 C ATOM 918 O ASP A 58 35.236 36.264 26.602 1.00 0.00 O ATOM 919 CB ASP A 58 35.410 36.142 23.518 1.00 0.00 C ATOM 920 CG ASP A 58 34.789 35.889 22.142 1.00 0.00 C ATOM 921 OD1 ASP A 58 33.606 35.488 22.086 1.00 0.00 O ATOM 922 OD2 ASP A 58 35.469 36.075 21.110 1.00 0.00 O ATOM 0 H ASP A 58 34.753 38.423 22.920 1.00 0.00 H new ATOM 0 HA ASP A 58 33.588 36.520 24.608 1.00 0.00 H new ATOM 0 HB2 ASP A 58 36.380 36.622 23.387 1.00 0.00 H new ATOM 0 HB3 ASP A 58 35.592 35.185 24.007 1.00 0.00 H new ATOM 927 N TYR A 59 35.813 38.354 26.027 1.00 0.00 N ATOM 928 CA TYR A 59 36.460 38.768 27.256 1.00 0.00 C ATOM 929 C TYR A 59 35.703 39.883 27.979 1.00 0.00 C ATOM 930 O TYR A 59 36.249 40.496 28.894 1.00 0.00 O ATOM 931 CB TYR A 59 37.908 39.142 26.948 1.00 0.00 C ATOM 932 CG TYR A 59 38.752 37.985 26.470 1.00 0.00 C ATOM 933 CD1 TYR A 59 39.514 37.263 27.396 1.00 0.00 C ATOM 934 CD2 TYR A 59 38.792 37.642 25.113 1.00 0.00 C ATOM 935 CE1 TYR A 59 40.326 36.204 26.970 1.00 0.00 C ATOM 936 CE2 TYR A 59 39.597 36.583 24.677 1.00 0.00 C ATOM 937 CZ TYR A 59 40.375 35.862 25.604 1.00 0.00 C ATOM 938 OH TYR A 59 41.150 34.825 25.177 1.00 0.00 O ATOM 0 H TYR A 59 35.835 39.089 25.320 1.00 0.00 H new ATOM 0 HA TYR A 59 36.452 37.933 27.956 1.00 0.00 H new ATOM 0 HB2 TYR A 59 37.917 39.923 26.188 1.00 0.00 H new ATOM 0 HB3 TYR A 59 38.362 39.564 27.845 1.00 0.00 H new ATOM 0 HD1 TYR A 59 39.476 37.524 28.443 1.00 0.00 H new ATOM 0 HD2 TYR A 59 38.200 38.196 24.400 1.00 0.00 H new ATOM 0 HE1 TYR A 59 40.914 35.651 27.688 1.00 0.00 H new ATOM 0 HE2 TYR A 59 39.622 36.319 23.630 1.00 0.00 H new ATOM 0 HH TYR A 59 41.218 34.153 25.887 1.00 0.00 H new ATOM 948 N ASN A 60 34.455 40.153 27.608 1.00 0.00 N ATOM 949 CA ASN A 60 33.585 41.125 28.237 1.00 0.00 C ATOM 950 C ASN A 60 34.151 42.546 28.307 1.00 0.00 C ATOM 951 O ASN A 60 33.862 43.299 29.233 1.00 0.00 O ATOM 952 CB ASN A 60 33.047 40.571 29.553 1.00 0.00 C ATOM 953 CG ASN A 60 32.327 39.234 29.359 1.00 0.00 C ATOM 954 OD1 ASN A 60 32.795 38.177 29.775 1.00 0.00 O ATOM 955 ND2 ASN A 60 31.175 39.234 28.692 1.00 0.00 N ATOM 0 H ASN A 60 34.008 39.675 26.825 1.00 0.00 H new ATOM 0 HA ASN A 60 32.728 41.272 27.580 1.00 0.00 H new ATOM 0 HB2 ASN A 60 33.870 40.441 30.256 1.00 0.00 H new ATOM 0 HB3 ASN A 60 32.360 41.292 29.996 1.00 0.00 H new ATOM 0 HD21 ASN A 60 30.681 38.357 28.527 1.00 0.00 H new ATOM 0 HD22 ASN A 60 30.786 40.111 28.346 1.00 0.00 H new ATOM 962 N ILE A 61 34.936 42.943 27.309 1.00 0.00 N ATOM 963 CA ILE A 61 35.431 44.295 27.150 1.00 0.00 C ATOM 964 C ILE A 61 34.283 45.205 26.711 1.00 0.00 C ATOM 965 O ILE A 61 33.511 44.848 25.824 1.00 0.00 O ATOM 966 CB ILE A 61 36.607 44.305 26.178 1.00 0.00 C ATOM 967 CG1 ILE A 61 37.799 43.542 26.752 1.00 0.00 C ATOM 968 CG2 ILE A 61 37.035 45.723 25.814 1.00 0.00 C ATOM 969 CD1 ILE A 61 38.801 43.089 25.693 1.00 0.00 C ATOM 0 H ILE A 61 35.250 42.311 26.572 1.00 0.00 H new ATOM 0 HA ILE A 61 35.805 44.681 28.098 1.00 0.00 H new ATOM 0 HB ILE A 61 36.266 43.808 25.270 1.00 0.00 H new ATOM 0 HG12 ILE A 61 38.310 44.175 27.477 1.00 0.00 H new ATOM 0 HG13 ILE A 61 37.435 42.669 27.293 1.00 0.00 H new ATOM 0 HG21 ILE A 61 37.875 45.683 25.120 1.00 0.00 H new ATOM 0 HG22 ILE A 61 36.201 46.246 25.345 1.00 0.00 H new ATOM 0 HG23 ILE A 61 37.335 46.255 26.717 1.00 0.00 H new ATOM 0 HD11 ILE A 61 39.621 42.554 26.173 1.00 0.00 H new ATOM 0 HD12 ILE A 61 38.305 42.430 24.981 1.00 0.00 H new ATOM 0 HD13 ILE A 61 39.194 43.960 25.168 1.00 0.00 H new ATOM 981 N GLN A 62 34.172 46.380 27.325 1.00 0.00 N ATOM 982 CA GLN A 62 33.141 47.370 27.091 1.00 0.00 C ATOM 983 C GLN A 62 33.726 48.778 26.959 1.00 0.00 C ATOM 984 O GLN A 62 34.922 48.972 27.166 1.00 0.00 O ATOM 985 CB GLN A 62 32.117 47.287 28.220 1.00 0.00 C ATOM 986 CG GLN A 62 31.320 45.986 28.220 1.00 0.00 C ATOM 987 CD GLN A 62 30.175 46.008 29.235 1.00 0.00 C ATOM 988 OE1 GLN A 62 28.995 46.021 28.886 1.00 0.00 O ATOM 989 NE2 GLN A 62 30.462 45.987 30.533 1.00 0.00 N ATOM 0 H GLN A 62 34.839 46.677 28.037 1.00 0.00 H new ATOM 0 HA GLN A 62 32.648 47.158 26.142 1.00 0.00 H new ATOM 0 HB2 GLN A 62 32.631 47.389 29.175 1.00 0.00 H new ATOM 0 HB3 GLN A 62 31.427 48.127 28.138 1.00 0.00 H new ATOM 0 HG2 GLN A 62 30.916 45.810 27.223 1.00 0.00 H new ATOM 0 HG3 GLN A 62 31.987 45.154 28.445 1.00 0.00 H new ATOM 0 HE21 GLN A 62 31.435 45.976 30.840 1.00 0.00 H new ATOM 0 HE22 GLN A 62 29.710 45.982 31.222 1.00 0.00 H new ATOM 998 N LYS A 63 32.907 49.778 26.646 1.00 0.00 N ATOM 999 CA LYS A 63 33.272 51.179 26.604 1.00 0.00 C ATOM 1000 C LYS A 63 34.105 51.606 27.815 1.00 0.00 C ATOM 1001 O LYS A 63 33.756 51.295 28.951 1.00 0.00 O ATOM 1002 CB LYS A 63 31.998 52.013 26.505 1.00 0.00 C ATOM 1003 CG LYS A 63 32.227 53.519 26.591 1.00 0.00 C ATOM 1004 CD LYS A 63 30.971 54.333 26.292 1.00 0.00 C ATOM 1005 CE LYS A 63 29.807 54.095 27.249 1.00 0.00 C ATOM 1006 NZ LYS A 63 30.016 54.682 28.581 1.00 0.00 N ATOM 0 H LYS A 63 31.929 49.620 26.405 1.00 0.00 H new ATOM 0 HA LYS A 63 33.901 51.343 25.729 1.00 0.00 H new ATOM 0 HB2 LYS A 63 31.501 51.786 25.562 1.00 0.00 H new ATOM 0 HB3 LYS A 63 31.319 51.714 27.303 1.00 0.00 H new ATOM 0 HG2 LYS A 63 32.586 53.770 27.589 1.00 0.00 H new ATOM 0 HG3 LYS A 63 33.012 53.802 25.889 1.00 0.00 H new ATOM 0 HD2 LYS A 63 31.229 55.392 26.313 1.00 0.00 H new ATOM 0 HD3 LYS A 63 30.641 54.105 25.278 1.00 0.00 H new ATOM 0 HE2 LYS A 63 28.898 54.512 26.815 1.00 0.00 H new ATOM 0 HE3 LYS A 63 29.646 53.022 27.354 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 29.190 54.484 29.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 30.866 54.267 29.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 30.141 55.711 28.491 1.00 0.00 H new ATOM 1020 N GLU A 64 35.194 52.329 27.566 1.00 0.00 N ATOM 1021 CA GLU A 64 36.084 52.906 28.553 1.00 0.00 C ATOM 1022 C GLU A 64 36.697 51.875 29.505 1.00 0.00 C ATOM 1023 O GLU A 64 36.996 52.171 30.659 1.00 0.00 O ATOM 1024 CB GLU A 64 35.434 54.114 29.218 1.00 0.00 C ATOM 1025 CG GLU A 64 35.189 55.260 28.240 1.00 0.00 C ATOM 1026 CD GLU A 64 34.342 56.398 28.813 1.00 0.00 C ATOM 1027 OE1 GLU A 64 33.334 56.142 29.509 1.00 0.00 O ATOM 1028 OE2 GLU A 64 34.642 57.581 28.543 1.00 0.00 O ATOM 0 H GLU A 64 35.490 52.536 26.612 1.00 0.00 H new ATOM 0 HA GLU A 64 36.964 53.289 28.036 1.00 0.00 H new ATOM 0 HB2 GLU A 64 34.486 53.813 29.664 1.00 0.00 H new ATOM 0 HB3 GLU A 64 36.071 54.464 30.030 1.00 0.00 H new ATOM 0 HG2 GLU A 64 36.150 55.662 27.920 1.00 0.00 H new ATOM 0 HG3 GLU A 64 34.696 54.866 27.351 1.00 0.00 H new ATOM 1035 N SER A 65 36.900 50.653 29.022 1.00 0.00 N ATOM 1036 CA SER A 65 37.735 49.642 29.637 1.00 0.00 C ATOM 1037 C SER A 65 39.223 49.933 29.430 1.00 0.00 C ATOM 1038 O SER A 65 39.592 50.537 28.425 1.00 0.00 O ATOM 1039 CB SER A 65 37.442 48.256 29.070 1.00 0.00 C ATOM 1040 OG SER A 65 36.098 47.879 29.273 1.00 0.00 O ATOM 0 H SER A 65 36.467 50.333 28.156 1.00 0.00 H new ATOM 0 HA SER A 65 37.502 49.665 30.702 1.00 0.00 H new ATOM 0 HB2 SER A 65 37.665 48.245 28.003 1.00 0.00 H new ATOM 0 HB3 SER A 65 38.099 47.525 29.540 1.00 0.00 H new ATOM 0 HG SER A 65 35.512 48.460 28.744 1.00 0.00 H new ATOM 1046 N THR A 66 40.074 49.447 30.328 1.00 0.00 N ATOM 1047 CA THR A 66 41.510 49.638 30.278 1.00 0.00 C ATOM 1048 C THR A 66 42.255 48.311 30.120 1.00 0.00 C ATOM 1049 O THR A 66 42.208 47.450 30.996 1.00 0.00 O ATOM 1050 CB THR A 66 42.020 50.411 31.491 1.00 0.00 C ATOM 1051 OG1 THR A 66 41.324 51.625 31.660 1.00 0.00 O ATOM 1052 CG2 THR A 66 43.488 50.801 31.344 1.00 0.00 C ATOM 0 H THR A 66 39.770 48.895 31.130 1.00 0.00 H new ATOM 0 HA THR A 66 41.717 50.239 29.392 1.00 0.00 H new ATOM 0 HB THR A 66 41.873 49.741 32.338 1.00 0.00 H new ATOM 0 HG1 THR A 66 41.673 52.095 32.446 1.00 0.00 H new ATOM 0 HG21 THR A 66 43.809 51.349 32.230 1.00 0.00 H new ATOM 0 HG22 THR A 66 44.094 49.902 31.234 1.00 0.00 H new ATOM 0 HG23 THR A 66 43.611 51.431 30.463 1.00 0.00 H new ATOM 1060 N LEU A 67 42.968 48.172 29.005 1.00 0.00 N ATOM 1061 CA LEU A 67 43.788 47.042 28.617 1.00 0.00 C ATOM 1062 C LEU A 67 45.275 47.356 28.797 1.00 0.00 C ATOM 1063 O LEU A 67 45.665 48.518 28.884 1.00 0.00 O ATOM 1064 CB LEU A 67 43.492 46.682 27.164 1.00 0.00 C ATOM 1065 CG LEU A 67 42.209 45.900 26.899 1.00 0.00 C ATOM 1066 CD1 LEU A 67 40.921 46.688 27.120 1.00 0.00 C ATOM 1067 CD2 LEU A 67 42.216 45.424 25.448 1.00 0.00 C ATOM 0 H LEU A 67 42.984 48.908 28.299 1.00 0.00 H new ATOM 0 HA LEU A 67 43.548 46.194 29.259 1.00 0.00 H new ATOM 0 HB2 LEU A 67 43.453 47.605 26.586 1.00 0.00 H new ATOM 0 HB3 LEU A 67 44.330 46.101 26.780 1.00 0.00 H new ATOM 0 HG LEU A 67 42.207 45.082 27.619 1.00 0.00 H new ATOM 0 HD11 LEU A 67 40.063 46.050 26.907 1.00 0.00 H new ATOM 0 HD12 LEU A 67 40.874 47.026 28.155 1.00 0.00 H new ATOM 0 HD13 LEU A 67 40.904 47.552 26.456 1.00 0.00 H new ATOM 0 HD21 LEU A 67 41.304 44.863 25.245 1.00 0.00 H new ATOM 0 HD22 LEU A 67 42.268 46.286 24.783 1.00 0.00 H new ATOM 0 HD23 LEU A 67 43.081 44.783 25.280 1.00 0.00 H new ATOM 1079 N HIS A 68 46.120 46.330 28.779 1.00 0.00 N ATOM 1080 CA HIS A 68 47.563 46.448 28.845 1.00 0.00 C ATOM 1081 C HIS A 68 48.243 45.850 27.612 1.00 0.00 C ATOM 1082 O HIS A 68 47.900 44.754 27.174 1.00 0.00 O ATOM 1083 CB HIS A 68 48.075 45.799 30.128 1.00 0.00 C ATOM 1084 CG HIS A 68 47.677 46.551 31.368 1.00 0.00 C ATOM 1085 ND1 HIS A 68 46.468 46.416 32.049 1.00 0.00 N ATOM 1086 CD2 HIS A 68 48.424 47.528 31.976 1.00 0.00 C ATOM 1087 CE1 HIS A 68 46.495 47.325 33.028 1.00 0.00 C ATOM 1088 NE2 HIS A 68 47.655 48.002 33.019 1.00 0.00 N ATOM 0 H HIS A 68 45.803 45.363 28.716 1.00 0.00 H new ATOM 0 HA HIS A 68 47.818 47.508 28.858 1.00 0.00 H new ATOM 0 HB2 HIS A 68 47.693 44.780 30.190 1.00 0.00 H new ATOM 0 HB3 HIS A 68 49.162 45.730 30.085 1.00 0.00 H new ATOM 0 HD2 HIS A 68 49.413 47.859 31.695 1.00 0.00 H new ATOM 0 HE1 HIS A 68 45.693 47.493 33.731 1.00 0.00 H new ATOM 0 HE2 HIS A 68 47.922 48.740 33.671 1.00 0.00 H new ATOM 1096 N LEU A 69 49.239 46.559 27.086 1.00 0.00 N ATOM 1097 CA LEU A 69 50.176 46.064 26.098 1.00 0.00 C ATOM 1098 C LEU A 69 51.408 45.481 26.790 1.00 0.00 C ATOM 1099 O LEU A 69 51.973 46.114 27.679 1.00 0.00 O ATOM 1100 CB LEU A 69 50.530 47.204 25.148 1.00 0.00 C ATOM 1101 CG LEU A 69 51.636 46.922 24.135 1.00 0.00 C ATOM 1102 CD1 LEU A 69 51.268 45.831 23.134 1.00 0.00 C ATOM 1103 CD2 LEU A 69 51.944 48.191 23.345 1.00 0.00 C ATOM 0 H LEU A 69 49.416 47.528 27.350 1.00 0.00 H new ATOM 0 HA LEU A 69 49.730 45.258 25.515 1.00 0.00 H new ATOM 0 HB2 LEU A 69 49.630 47.486 24.602 1.00 0.00 H new ATOM 0 HB3 LEU A 69 50.825 48.067 25.745 1.00 0.00 H new ATOM 0 HG LEU A 69 52.498 46.582 24.710 1.00 0.00 H new ATOM 0 HD11 LEU A 69 52.096 45.678 22.442 1.00 0.00 H new ATOM 0 HD12 LEU A 69 51.064 44.902 23.667 1.00 0.00 H new ATOM 0 HD13 LEU A 69 50.380 46.132 22.578 1.00 0.00 H new ATOM 0 HD21 LEU A 69 52.734 47.987 22.622 1.00 0.00 H new ATOM 0 HD22 LEU A 69 51.047 48.519 22.819 1.00 0.00 H new ATOM 0 HD23 LEU A 69 52.271 48.975 24.028 1.00 0.00 H new ATOM 1115 N VAL A 70 51.836 44.301 26.348 1.00 0.00 N ATOM 1116 CA VAL A 70 53.042 43.606 26.751 1.00 0.00 C ATOM 1117 C VAL A 70 53.867 43.276 25.507 1.00 0.00 C ATOM 1118 O VAL A 70 53.323 43.049 24.429 1.00 0.00 O ATOM 1119 CB VAL A 70 52.679 42.378 27.581 1.00 0.00 C ATOM 1120 CG1 VAL A 70 53.792 41.351 27.769 1.00 0.00 C ATOM 1121 CG2 VAL A 70 52.204 42.798 28.970 1.00 0.00 C ATOM 0 H VAL A 70 51.309 43.775 25.651 1.00 0.00 H new ATOM 0 HA VAL A 70 53.660 44.237 27.390 1.00 0.00 H new ATOM 0 HB VAL A 70 51.896 41.893 26.998 1.00 0.00 H new ATOM 0 HG11 VAL A 70 53.424 40.522 28.373 1.00 0.00 H new ATOM 0 HG12 VAL A 70 54.110 40.977 26.796 1.00 0.00 H new ATOM 0 HG13 VAL A 70 54.638 41.819 28.272 1.00 0.00 H new ATOM 0 HG21 VAL A 70 51.949 41.912 29.551 1.00 0.00 H new ATOM 0 HG22 VAL A 70 52.999 43.347 29.476 1.00 0.00 H new ATOM 0 HG23 VAL A 70 51.325 43.436 28.877 1.00 0.00 H new