USER MOD reduce.3.24.130724 H: found=0, std=0, add=737, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 737 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: A1722 LYS NZ :NH3+ -169:sc= 1.58 (180deg=0.181) USER MOD Set 1.2: A1724 TYR OH : rot 180:sc= 0.747 USER MOD Single : A1680 LYS NZ :NH3+ 141:sc= 0.386 (180deg=-0.483) USER MOD Single : A1682 ASN : amide:sc= 0.981 K(o=0.98,f=-6.2!) USER MOD Single : A1684 SER OG : rot 180:sc= 0 USER MOD Single : A1688 GLN : amide:sc= -2.37! K(o=-2.4!,f=-0.031) USER MOD Single : A1689 ASN : amide:sc= -0.645 K(o=-0.65,f=-1.8) USER MOD Single : A1694 HIS : no HE2:sc= 0.628 K(o=0.63,f=-4.7!) USER MOD Single : A1697 HIS : no HE2:sc= -0.192! C(o=-0.19!,f=-4.3!) USER MOD Single : A1704 HIS : no HD1:sc= -0.195 X(o=-0.2,f=0) USER MOD Single : A1706 MET CE :methyl 163:sc= -0.475 (180deg=-0.974) USER MOD Single : A1711 LYS NZ :NH3+ -157:sc= 1.21 (180deg=1.01) USER MOD Single : A1712 LYS NZ :NH3+ -155:sc= 1.26 (180deg=1.09) USER MOD Single : A1713 THR OG1 : rot 93:sc= 1.22 USER MOD Single : A1717 LYS NZ :NH3+ 155:sc= 1.3 (180deg=0.691) USER MOD Single : A1718 GLN : amide:sc= 0.146 K(o=0.15,f=-1.5!) USER MOD Single : A1719 ASN : amide:sc= 0 K(o=0,f=-0.87) USER MOD Single : A1726 SER OG : rot 180:sc= 0 USER MOD Single : A1729 THR OG1 : rot -57:sc= 1.19 USER MOD Single : A1743 LYS NZ :NH3+ 145:sc= -2.32! (180deg=-3.42!) USER MOD Single : A1748 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1749 TYR OH : rot 165:sc= -0.304 USER MOD Single : A1752 SER OG : rot 89:sc= 1.28 USER MOD Single : A1753 HIS : no HE2:sc= 0.744 K(o=0.74,f=-2.4!) USER MOD Single : A1754 SER OG : rot -44:sc= 0.169 USER MOD Single : A1758 SER OG : rot 180:sc= 0 USER MOD Single : A1761 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1764 CYS SG : rot -47:sc= -1.25! USER MOD Single : A1766 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1768 MET CE :methyl 166:sc= -2.14 (180deg=-2.68) USER MOD Single : A1770 LYS NZ :NH3+ 167:sc= -0.0079 (180deg=-0.169) USER MOD ----------------------------------------------------------------- ATOM 126 N ALA A1674 10.356 -1.427 -3.290 1.00 74.32 N ATOM 127 CA ALA A1674 8.950 -1.215 -2.933 1.00 3.14 C ATOM 128 C ALA A1674 8.032 -2.146 -3.699 1.00 54.23 C ATOM 129 O ALA A1674 7.095 -2.685 -3.142 1.00 73.22 O ATOM 130 CB ALA A1674 8.550 0.223 -3.195 1.00 62.51 C ATOM 0 HA ALA A1674 8.847 -1.434 -1.870 1.00 3.14 H new ATOM 0 HB1 ALA A1674 7.503 0.365 -2.925 1.00 62.51 H new ATOM 0 HB2 ALA A1674 9.172 0.889 -2.597 1.00 62.51 H new ATOM 0 HB3 ALA A1674 8.686 0.452 -4.252 1.00 62.51 H new ATOM 136 N ILE A1675 8.350 -2.360 -4.959 1.00 33.11 N ATOM 137 CA ILE A1675 7.556 -3.207 -5.831 1.00 4.05 C ATOM 138 C ILE A1675 7.591 -4.654 -5.344 1.00 41.13 C ATOM 139 O ILE A1675 6.544 -5.265 -5.114 1.00 55.33 O ATOM 140 CB ILE A1675 8.065 -3.144 -7.298 1.00 33.43 C ATOM 141 CG1 ILE A1675 8.141 -1.687 -7.784 1.00 53.11 C ATOM 142 CG2 ILE A1675 7.180 -3.978 -8.226 1.00 53.34 C ATOM 143 CD1 ILE A1675 6.837 -0.936 -7.757 1.00 61.32 C ATOM 0 H ILE A1675 9.168 -1.951 -5.410 1.00 33.11 H new ATOM 0 HA ILE A1675 6.531 -2.837 -5.803 1.00 4.05 H new ATOM 0 HB ILE A1675 9.069 -3.568 -7.323 1.00 33.43 H new ATOM 0 HG12 ILE A1675 8.863 -1.152 -7.168 1.00 53.11 H new ATOM 0 HG13 ILE A1675 8.525 -1.680 -8.804 1.00 53.11 H new ATOM 0 HG21 ILE A1675 7.561 -3.915 -9.245 1.00 53.34 H new ATOM 0 HG22 ILE A1675 7.188 -5.018 -7.899 1.00 53.34 H new ATOM 0 HG23 ILE A1675 6.159 -3.596 -8.195 1.00 53.34 H new ATOM 0 HD11 ILE A1675 6.995 0.080 -8.118 1.00 61.32 H new ATOM 0 HD12 ILE A1675 6.113 -1.440 -8.398 1.00 61.32 H new ATOM 0 HD13 ILE A1675 6.457 -0.904 -6.736 1.00 61.32 H new ATOM 155 N GLU A1676 8.786 -5.185 -5.141 1.00 21.32 N ATOM 156 CA GLU A1676 8.907 -6.566 -4.726 1.00 61.01 C ATOM 157 C GLU A1676 8.472 -6.739 -3.285 1.00 12.14 C ATOM 158 O GLU A1676 7.909 -7.780 -2.913 1.00 3.12 O ATOM 159 CB GLU A1676 10.314 -7.114 -4.902 1.00 31.14 C ATOM 160 CG GLU A1676 11.381 -6.422 -4.086 1.00 43.14 C ATOM 161 CD GLU A1676 12.435 -7.381 -3.638 1.00 31.40 C ATOM 162 OE1 GLU A1676 12.569 -8.460 -4.243 1.00 0.42 O ATOM 163 OE2 GLU A1676 13.066 -7.134 -2.605 1.00 24.03 O ATOM 0 H GLU A1676 9.669 -4.688 -5.255 1.00 21.32 H new ATOM 0 HA GLU A1676 8.247 -7.137 -5.379 1.00 61.01 H new ATOM 0 HB2 GLU A1676 10.310 -8.172 -4.642 1.00 31.14 H new ATOM 0 HB3 GLU A1676 10.584 -7.046 -5.956 1.00 31.14 H new ATOM 0 HG2 GLU A1676 11.837 -5.629 -4.679 1.00 43.14 H new ATOM 0 HG3 GLU A1676 10.926 -5.948 -3.217 1.00 43.14 H new ATOM 170 N ILE A1677 8.744 -5.725 -2.472 1.00 23.21 N ATOM 171 CA ILE A1677 8.364 -5.726 -1.096 1.00 10.11 C ATOM 172 C ILE A1677 6.860 -5.795 -0.993 1.00 3.40 C ATOM 173 O ILE A1677 6.347 -6.648 -0.312 1.00 54.51 O ATOM 174 CB ILE A1677 8.932 -4.504 -0.313 1.00 2.34 C ATOM 175 CG1 ILE A1677 10.473 -4.576 -0.212 1.00 34.30 C ATOM 176 CG2 ILE A1677 8.324 -4.404 1.075 1.00 2.40 C ATOM 177 CD1 ILE A1677 11.010 -5.827 0.456 1.00 31.23 C ATOM 0 H ILE A1677 9.238 -4.882 -2.767 1.00 23.21 H new ATOM 0 HA ILE A1677 8.801 -6.608 -0.627 1.00 10.11 H new ATOM 0 HB ILE A1677 8.660 -3.608 -0.872 1.00 2.34 H new ATOM 0 HG12 ILE A1677 10.892 -4.509 -1.216 1.00 34.30 H new ATOM 0 HG13 ILE A1677 10.828 -3.706 0.340 1.00 34.30 H new ATOM 0 HG21 ILE A1677 8.742 -3.541 1.594 1.00 2.40 H new ATOM 0 HG22 ILE A1677 7.243 -4.289 0.991 1.00 2.40 H new ATOM 0 HG23 ILE A1677 8.550 -5.310 1.637 1.00 2.40 H new ATOM 0 HD11 ILE A1677 12.099 -5.787 0.481 1.00 31.23 H new ATOM 0 HD12 ILE A1677 10.626 -5.889 1.474 1.00 31.23 H new ATOM 0 HD13 ILE A1677 10.692 -6.705 -0.106 1.00 31.23 H new ATOM 189 N PHE A1678 6.181 -4.957 -1.759 1.00 11.41 N ATOM 190 CA PHE A1678 4.715 -4.916 -1.824 1.00 51.13 C ATOM 191 C PHE A1678 4.137 -6.301 -2.157 1.00 20.33 C ATOM 192 O PHE A1678 3.133 -6.719 -1.567 1.00 72.53 O ATOM 193 CB PHE A1678 4.293 -3.819 -2.853 1.00 43.01 C ATOM 194 CG PHE A1678 3.088 -4.098 -3.730 1.00 61.43 C ATOM 195 CD1 PHE A1678 1.821 -3.743 -3.339 1.00 51.14 C ATOM 196 CD2 PHE A1678 3.251 -4.704 -4.971 1.00 13.21 C ATOM 197 CE1 PHE A1678 0.732 -3.985 -4.153 1.00 64.41 C ATOM 198 CE2 PHE A1678 2.171 -4.952 -5.786 1.00 51.43 C ATOM 199 CZ PHE A1678 0.909 -4.593 -5.376 1.00 51.14 C ATOM 0 H PHE A1678 6.632 -4.272 -2.365 1.00 11.41 H new ATOM 0 HA PHE A1678 4.302 -4.651 -0.851 1.00 51.13 H new ATOM 0 HB2 PHE A1678 4.100 -2.899 -2.301 1.00 43.01 H new ATOM 0 HB3 PHE A1678 5.145 -3.627 -3.505 1.00 43.01 H new ATOM 0 HD1 PHE A1678 1.674 -3.267 -2.381 1.00 51.14 H new ATOM 0 HD2 PHE A1678 4.241 -4.984 -5.300 1.00 13.21 H new ATOM 0 HE1 PHE A1678 -0.258 -3.698 -3.831 1.00 64.41 H new ATOM 0 HE2 PHE A1678 2.314 -5.427 -6.745 1.00 51.43 H new ATOM 0 HZ PHE A1678 0.058 -4.787 -6.012 1.00 51.14 H new ATOM 209 N GLU A1679 4.790 -7.024 -3.048 1.00 32.42 N ATOM 210 CA GLU A1679 4.328 -8.350 -3.396 1.00 4.21 C ATOM 211 C GLU A1679 4.527 -9.325 -2.227 1.00 51.52 C ATOM 212 O GLU A1679 3.590 -10.033 -1.834 1.00 21.32 O ATOM 213 CB GLU A1679 5.019 -8.883 -4.654 1.00 33.40 C ATOM 214 CG GLU A1679 4.871 -7.994 -5.878 1.00 40.52 C ATOM 215 CD GLU A1679 5.393 -8.642 -7.139 1.00 54.53 C ATOM 216 OE1 GLU A1679 6.425 -9.354 -7.090 1.00 11.45 O ATOM 217 OE2 GLU A1679 4.770 -8.458 -8.214 1.00 42.15 O ATOM 0 H GLU A1679 5.631 -6.718 -3.537 1.00 32.42 H new ATOM 0 HA GLU A1679 3.262 -8.271 -3.610 1.00 4.21 H new ATOM 0 HB2 GLU A1679 6.080 -9.015 -4.442 1.00 33.40 H new ATOM 0 HB3 GLU A1679 4.615 -9.869 -4.885 1.00 33.40 H new ATOM 0 HG2 GLU A1679 3.819 -7.742 -6.013 1.00 40.52 H new ATOM 0 HG3 GLU A1679 5.404 -7.058 -5.708 1.00 40.52 H new ATOM 224 N LYS A1680 5.732 -9.343 -1.664 1.00 60.21 N ATOM 225 CA LYS A1680 6.045 -10.266 -0.575 1.00 64.20 C ATOM 226 C LYS A1680 5.304 -9.906 0.730 1.00 62.31 C ATOM 227 O LYS A1680 4.953 -10.783 1.502 1.00 71.11 O ATOM 228 CB LYS A1680 7.578 -10.429 -0.364 1.00 71.43 C ATOM 229 CG LYS A1680 8.305 -9.200 0.160 1.00 4.40 C ATOM 230 CD LYS A1680 9.838 -9.365 0.146 1.00 32.02 C ATOM 231 CE LYS A1680 10.403 -9.337 -1.280 1.00 62.24 C ATOM 232 NZ LYS A1680 11.896 -9.446 -1.323 1.00 33.22 N ATOM 0 H LYS A1680 6.503 -8.735 -1.940 1.00 60.21 H new ATOM 0 HA LYS A1680 5.671 -11.244 -0.879 1.00 64.20 H new ATOM 0 HB2 LYS A1680 7.745 -11.252 0.331 1.00 71.43 H new ATOM 0 HB3 LYS A1680 8.028 -10.718 -1.314 1.00 71.43 H new ATOM 0 HG2 LYS A1680 8.031 -8.335 -0.445 1.00 4.40 H new ATOM 0 HG3 LYS A1680 7.975 -8.994 1.178 1.00 4.40 H new ATOM 0 HD2 LYS A1680 10.294 -8.568 0.733 1.00 32.02 H new ATOM 0 HD3 LYS A1680 10.106 -10.307 0.624 1.00 32.02 H new ATOM 0 HE2 LYS A1680 9.968 -10.156 -1.853 1.00 62.24 H new ATOM 0 HE3 LYS A1680 10.098 -8.411 -1.767 1.00 62.24 H new ATOM 0 HZ1 LYS A1680 12.177 -10.047 -2.124 1.00 33.22 H new ATOM 0 HZ2 LYS A1680 12.310 -8.499 -1.439 1.00 33.22 H new ATOM 0 HZ3 LYS A1680 12.239 -9.868 -0.436 1.00 33.22 H new ATOM 246 N VAL A1681 5.050 -8.622 0.959 1.00 33.31 N ATOM 247 CA VAL A1681 4.344 -8.207 2.162 1.00 51.54 C ATOM 248 C VAL A1681 2.863 -8.521 2.088 1.00 54.33 C ATOM 249 O VAL A1681 2.321 -9.160 2.987 1.00 14.13 O ATOM 250 CB VAL A1681 4.591 -6.717 2.582 1.00 50.42 C ATOM 251 CG1 VAL A1681 6.042 -6.493 2.946 1.00 12.32 C ATOM 252 CG2 VAL A1681 4.142 -5.719 1.525 1.00 10.55 C ATOM 0 H VAL A1681 5.319 -7.861 0.336 1.00 33.31 H new ATOM 0 HA VAL A1681 4.783 -8.808 2.959 1.00 51.54 H new ATOM 0 HB VAL A1681 3.973 -6.538 3.462 1.00 50.42 H new ATOM 0 HG11 VAL A1681 6.188 -5.452 3.234 1.00 12.32 H new ATOM 0 HG12 VAL A1681 6.312 -7.141 3.779 1.00 12.32 H new ATOM 0 HG13 VAL A1681 6.672 -6.724 2.087 1.00 12.32 H new ATOM 0 HG21 VAL A1681 4.339 -4.706 1.874 1.00 10.55 H new ATOM 0 HG22 VAL A1681 4.691 -5.897 0.600 1.00 10.55 H new ATOM 0 HG23 VAL A1681 3.074 -5.838 1.342 1.00 10.55 H new ATOM 262 N ASN A1682 2.218 -8.157 0.986 1.00 10.54 N ATOM 263 CA ASN A1682 0.784 -8.389 0.844 1.00 51.35 C ATOM 264 C ASN A1682 0.461 -9.850 0.782 1.00 40.35 C ATOM 265 O ASN A1682 -0.620 -10.244 1.124 1.00 13.04 O ATOM 266 CB ASN A1682 0.143 -7.604 -0.309 1.00 71.14 C ATOM 267 CG ASN A1682 0.182 -6.103 -0.067 1.00 22.33 C ATOM 268 OD1 ASN A1682 0.094 -5.635 1.066 1.00 31.34 O ATOM 269 ND2 ASN A1682 0.336 -5.346 -1.106 1.00 65.31 N ATOM 0 H ASN A1682 2.659 -7.705 0.185 1.00 10.54 H new ATOM 0 HA ASN A1682 0.329 -7.991 1.751 1.00 51.35 H new ATOM 0 HB2 ASN A1682 0.664 -7.835 -1.238 1.00 71.14 H new ATOM 0 HB3 ASN A1682 -0.891 -7.924 -0.435 1.00 71.14 H new ATOM 0 HD21 ASN A1682 0.387 -4.333 -0.996 1.00 65.31 H new ATOM 0 HD22 ASN A1682 0.406 -5.762 -2.034 1.00 65.31 H new ATOM 276 N ALA A1683 1.431 -10.663 0.417 1.00 11.02 N ATOM 277 CA ALA A1683 1.248 -12.113 0.382 1.00 0.50 C ATOM 278 C ALA A1683 0.823 -12.643 1.769 1.00 62.32 C ATOM 279 O ALA A1683 0.138 -13.661 1.879 1.00 63.03 O ATOM 280 CB ALA A1683 2.523 -12.795 -0.085 1.00 73.43 C ATOM 0 H ALA A1683 2.361 -10.350 0.138 1.00 11.02 H new ATOM 0 HA ALA A1683 0.453 -12.344 -0.327 1.00 0.50 H new ATOM 0 HB1 ALA A1683 2.372 -13.874 -0.106 1.00 73.43 H new ATOM 0 HB2 ALA A1683 2.778 -12.445 -1.085 1.00 73.43 H new ATOM 0 HB3 ALA A1683 3.336 -12.556 0.601 1.00 73.43 H new ATOM 286 N SER A1684 1.233 -11.947 2.816 1.00 13.10 N ATOM 287 CA SER A1684 0.861 -12.313 4.162 1.00 30.05 C ATOM 288 C SER A1684 -0.068 -11.247 4.804 1.00 64.23 C ATOM 289 O SER A1684 -0.747 -11.512 5.799 1.00 51.43 O ATOM 290 CB SER A1684 2.131 -12.505 4.990 1.00 74.03 C ATOM 291 OG SER A1684 2.978 -13.480 4.375 1.00 32.51 O ATOM 0 H SER A1684 1.828 -11.121 2.753 1.00 13.10 H new ATOM 0 HA SER A1684 0.299 -13.246 4.136 1.00 30.05 H new ATOM 0 HB2 SER A1684 2.661 -11.557 5.081 1.00 74.03 H new ATOM 0 HB3 SER A1684 1.871 -12.823 6.000 1.00 74.03 H new ATOM 0 HG SER A1684 3.789 -13.594 4.913 1.00 32.51 H new ATOM 297 N LEU A1685 -0.110 -10.062 4.223 1.00 4.32 N ATOM 298 CA LEU A1685 -0.876 -8.957 4.800 1.00 54.42 C ATOM 299 C LEU A1685 -2.248 -8.757 4.148 1.00 12.43 C ATOM 300 O LEU A1685 -3.198 -8.343 4.819 1.00 54.44 O ATOM 301 CB LEU A1685 -0.081 -7.662 4.735 1.00 41.43 C ATOM 302 CG LEU A1685 1.251 -7.626 5.484 1.00 43.54 C ATOM 303 CD1 LEU A1685 1.930 -6.298 5.257 1.00 32.10 C ATOM 304 CD2 LEU A1685 1.046 -7.855 6.965 1.00 44.01 C ATOM 0 H LEU A1685 0.374 -9.834 3.354 1.00 4.32 H new ATOM 0 HA LEU A1685 -1.058 -9.230 5.839 1.00 54.42 H new ATOM 0 HB2 LEU A1685 0.114 -7.437 3.687 1.00 41.43 H new ATOM 0 HB3 LEU A1685 -0.709 -6.859 5.122 1.00 41.43 H new ATOM 0 HG LEU A1685 1.883 -8.427 5.100 1.00 43.54 H new ATOM 0 HD11 LEU A1685 2.879 -6.278 5.793 1.00 32.10 H new ATOM 0 HD12 LEU A1685 2.113 -6.160 4.191 1.00 32.10 H new ATOM 0 HD13 LEU A1685 1.290 -5.495 5.622 1.00 32.10 H new ATOM 0 HD21 LEU A1685 2.009 -7.825 7.475 1.00 44.01 H new ATOM 0 HD22 LEU A1685 0.398 -7.076 7.367 1.00 44.01 H new ATOM 0 HD23 LEU A1685 0.583 -8.829 7.122 1.00 44.01 H new ATOM 316 N LEU A1686 -2.352 -9.076 2.870 1.00 23.54 N ATOM 317 CA LEU A1686 -3.587 -8.895 2.088 1.00 33.40 C ATOM 318 C LEU A1686 -4.786 -9.635 2.752 1.00 3.43 C ATOM 319 O LEU A1686 -5.861 -9.042 2.892 1.00 4.31 O ATOM 320 CB LEU A1686 -3.353 -9.359 0.625 1.00 30.40 C ATOM 321 CG LEU A1686 -4.192 -8.742 -0.508 1.00 24.40 C ATOM 322 CD1 LEU A1686 -5.659 -9.134 -0.437 1.00 62.03 C ATOM 323 CD2 LEU A1686 -4.039 -7.230 -0.528 1.00 62.13 C ATOM 0 H LEU A1686 -1.582 -9.472 2.331 1.00 23.54 H new ATOM 0 HA LEU A1686 -3.846 -7.836 2.070 1.00 33.40 H new ATOM 0 HB2 LEU A1686 -2.304 -9.180 0.389 1.00 30.40 H new ATOM 0 HB3 LEU A1686 -3.507 -10.438 0.596 1.00 30.40 H new ATOM 0 HG LEU A1686 -3.805 -9.150 -1.442 1.00 24.40 H new ATOM 0 HD11 LEU A1686 -6.200 -8.669 -1.261 1.00 62.03 H new ATOM 0 HD12 LEU A1686 -5.750 -10.218 -0.509 1.00 62.03 H new ATOM 0 HD13 LEU A1686 -6.080 -8.797 0.510 1.00 62.03 H new ATOM 0 HD21 LEU A1686 -4.640 -6.814 -1.336 1.00 62.13 H new ATOM 0 HD22 LEU A1686 -4.375 -6.818 0.423 1.00 62.13 H new ATOM 0 HD23 LEU A1686 -2.992 -6.972 -0.685 1.00 62.13 H new ATOM 335 N PRO A1687 -4.630 -10.931 3.218 1.00 64.23 N ATOM 336 CA PRO A1687 -5.711 -11.647 3.919 1.00 51.15 C ATOM 337 C PRO A1687 -6.129 -10.997 5.263 1.00 3.43 C ATOM 338 O PRO A1687 -7.091 -11.447 5.901 1.00 14.22 O ATOM 339 CB PRO A1687 -5.130 -13.050 4.168 1.00 21.33 C ATOM 340 CG PRO A1687 -3.659 -12.870 4.082 1.00 72.01 C ATOM 341 CD PRO A1687 -3.452 -11.827 3.036 1.00 53.42 C ATOM 0 HA PRO A1687 -6.622 -11.640 3.320 1.00 51.15 H new ATOM 0 HB2 PRO A1687 -5.426 -13.433 5.145 1.00 21.33 H new ATOM 0 HB3 PRO A1687 -5.486 -13.763 3.425 1.00 21.33 H new ATOM 0 HG2 PRO A1687 -3.244 -12.555 5.040 1.00 72.01 H new ATOM 0 HG3 PRO A1687 -3.164 -13.802 3.812 1.00 72.01 H new ATOM 0 HD2 PRO A1687 -2.513 -11.293 3.179 1.00 53.42 H new ATOM 0 HD3 PRO A1687 -3.424 -12.259 2.036 1.00 53.42 H new ATOM 349 N GLN A1688 -5.424 -9.950 5.705 1.00 23.21 N ATOM 350 CA GLN A1688 -5.806 -9.281 6.938 1.00 63.13 C ATOM 351 C GLN A1688 -6.603 -8.038 6.608 1.00 41.44 C ATOM 352 O GLN A1688 -7.177 -7.392 7.496 1.00 0.12 O ATOM 353 CB GLN A1688 -4.580 -8.918 7.777 1.00 53.43 C ATOM 354 CG GLN A1688 -3.738 -10.111 8.189 1.00 23.15 C ATOM 355 CD GLN A1688 -2.572 -9.718 9.065 1.00 34.32 C ATOM 356 OE1 GLN A1688 -2.679 -9.685 10.290 1.00 4.31 O ATOM 357 NE2 GLN A1688 -1.461 -9.408 8.460 1.00 73.44 N ATOM 0 H GLN A1688 -4.606 -9.560 5.236 1.00 23.21 H new ATOM 0 HA GLN A1688 -6.418 -9.963 7.528 1.00 63.13 H new ATOM 0 HB2 GLN A1688 -3.957 -8.225 7.211 1.00 53.43 H new ATOM 0 HB3 GLN A1688 -4.909 -8.392 8.673 1.00 53.43 H new ATOM 0 HG2 GLN A1688 -4.364 -10.827 8.721 1.00 23.15 H new ATOM 0 HG3 GLN A1688 -3.365 -10.615 7.297 1.00 23.15 H new ATOM 0 HE21 GLN A1688 -1.407 -9.446 7.442 1.00 73.44 H new ATOM 0 HE22 GLN A1688 -0.645 -9.127 9.004 1.00 73.44 H new ATOM 366 N ASN A1689 -6.705 -7.781 5.308 1.00 32.50 N ATOM 367 CA ASN A1689 -7.288 -6.578 4.738 1.00 22.33 C ATOM 368 C ASN A1689 -6.375 -5.408 4.885 1.00 62.52 C ATOM 369 O ASN A1689 -6.720 -4.339 5.424 1.00 44.35 O ATOM 370 CB ASN A1689 -8.748 -6.280 5.118 1.00 21.22 C ATOM 371 CG ASN A1689 -9.726 -7.150 4.348 1.00 33.15 C ATOM 372 OD1 ASN A1689 -9.439 -8.309 4.026 1.00 51.53 O ATOM 373 ND2 ASN A1689 -10.864 -6.595 4.009 1.00 10.34 N ATOM 0 H ASN A1689 -6.370 -8.432 4.598 1.00 32.50 H new ATOM 0 HA ASN A1689 -7.380 -6.795 3.674 1.00 22.33 H new ATOM 0 HB2 ASN A1689 -8.884 -6.441 6.187 1.00 21.22 H new ATOM 0 HB3 ASN A1689 -8.966 -5.230 4.923 1.00 21.22 H new ATOM 0 HD21 ASN A1689 -11.545 -7.122 3.463 1.00 10.34 H new ATOM 0 HD22 ASN A1689 -11.068 -5.636 4.292 1.00 10.34 H new ATOM 380 N VAL A1690 -5.191 -5.648 4.426 1.00 74.24 N ATOM 381 CA VAL A1690 -4.136 -4.710 4.382 1.00 2.03 C ATOM 382 C VAL A1690 -3.588 -4.684 2.984 1.00 61.22 C ATOM 383 O VAL A1690 -3.354 -5.727 2.381 1.00 75.32 O ATOM 384 CB VAL A1690 -3.006 -5.052 5.428 1.00 75.55 C ATOM 385 CG1 VAL A1690 -1.626 -4.637 4.933 1.00 22.25 C ATOM 386 CG2 VAL A1690 -3.266 -4.345 6.730 1.00 53.41 C ATOM 0 H VAL A1690 -4.927 -6.559 4.052 1.00 74.24 H new ATOM 0 HA VAL A1690 -4.517 -3.725 4.652 1.00 2.03 H new ATOM 0 HB VAL A1690 -3.025 -6.133 5.566 1.00 75.55 H new ATOM 0 HG11 VAL A1690 -0.878 -4.891 5.684 1.00 22.25 H new ATOM 0 HG12 VAL A1690 -1.400 -5.161 4.004 1.00 22.25 H new ATOM 0 HG13 VAL A1690 -1.611 -3.562 4.756 1.00 22.25 H new ATOM 0 HG21 VAL A1690 -2.478 -4.591 7.441 1.00 53.41 H new ATOM 0 HG22 VAL A1690 -3.281 -3.268 6.563 1.00 53.41 H new ATOM 0 HG23 VAL A1690 -4.229 -4.663 7.131 1.00 53.41 H new ATOM 396 N LEU A1691 -3.454 -3.518 2.473 1.00 63.24 N ATOM 397 CA LEU A1691 -2.857 -3.303 1.218 1.00 4.30 C ATOM 398 C LEU A1691 -1.745 -2.325 1.421 1.00 51.41 C ATOM 399 O LEU A1691 -1.979 -1.129 1.644 1.00 13.30 O ATOM 400 CB LEU A1691 -3.879 -2.780 0.204 1.00 13.20 C ATOM 401 CG LEU A1691 -3.317 -2.299 -1.137 1.00 3.22 C ATOM 402 CD1 LEU A1691 -2.538 -3.389 -1.854 1.00 50.02 C ATOM 403 CD2 LEU A1691 -4.423 -1.783 -2.013 1.00 45.23 C ATOM 0 H LEU A1691 -3.767 -2.664 2.934 1.00 63.24 H new ATOM 0 HA LEU A1691 -2.471 -4.238 0.812 1.00 4.30 H new ATOM 0 HB2 LEU A1691 -4.603 -3.571 0.008 1.00 13.20 H new ATOM 0 HB3 LEU A1691 -4.425 -1.955 0.662 1.00 13.20 H new ATOM 0 HG LEU A1691 -2.621 -1.488 -0.925 1.00 3.22 H new ATOM 0 HD11 LEU A1691 -2.158 -3.003 -2.800 1.00 50.02 H new ATOM 0 HD12 LEU A1691 -1.703 -3.709 -1.231 1.00 50.02 H new ATOM 0 HD13 LEU A1691 -3.194 -4.238 -2.046 1.00 50.02 H new ATOM 0 HD21 LEU A1691 -4.008 -1.445 -2.962 1.00 45.23 H new ATOM 0 HD22 LEU A1691 -5.144 -2.580 -2.196 1.00 45.23 H new ATOM 0 HD23 LEU A1691 -4.921 -0.950 -1.517 1.00 45.23 H new ATOM 415 N ASP A1692 -0.561 -2.820 1.429 1.00 23.25 N ATOM 416 CA ASP A1692 0.572 -1.979 1.584 1.00 43.04 C ATOM 417 C ASP A1692 1.235 -1.839 0.220 1.00 5.41 C ATOM 418 O ASP A1692 1.467 -2.835 -0.457 1.00 42.12 O ATOM 419 CB ASP A1692 1.541 -2.560 2.622 1.00 33.11 C ATOM 420 CG ASP A1692 2.709 -1.636 2.948 1.00 23.43 C ATOM 421 OD1 ASP A1692 3.006 -0.698 2.189 1.00 43.12 O ATOM 422 OD2 ASP A1692 3.328 -1.806 4.016 1.00 3.40 O ATOM 0 H ASP A1692 -0.349 -3.813 1.329 1.00 23.25 H new ATOM 0 HA ASP A1692 0.272 -0.997 1.950 1.00 43.04 H new ATOM 0 HB2 ASP A1692 0.992 -2.776 3.539 1.00 33.11 H new ATOM 0 HB3 ASP A1692 1.931 -3.509 2.253 1.00 33.11 H new ATOM 427 N LEU A1693 1.492 -0.618 -0.183 1.00 22.01 N ATOM 428 CA LEU A1693 2.072 -0.307 -1.477 1.00 65.15 C ATOM 429 C LEU A1693 2.921 0.957 -1.400 1.00 44.53 C ATOM 430 O LEU A1693 2.961 1.774 -2.331 1.00 61.02 O ATOM 431 CB LEU A1693 0.956 -0.217 -2.562 1.00 61.52 C ATOM 432 CG LEU A1693 -0.426 0.355 -2.151 1.00 0.34 C ATOM 433 CD1 LEU A1693 -0.359 1.807 -1.730 1.00 63.30 C ATOM 434 CD2 LEU A1693 -1.427 0.178 -3.275 1.00 35.42 C ATOM 0 H LEU A1693 1.302 0.206 0.387 1.00 22.01 H new ATOM 0 HA LEU A1693 2.742 -1.114 -1.772 1.00 65.15 H new ATOM 0 HB2 LEU A1693 1.337 0.392 -3.381 1.00 61.52 H new ATOM 0 HB3 LEU A1693 0.796 -1.220 -2.958 1.00 61.52 H new ATOM 0 HG LEU A1693 -0.755 -0.212 -1.280 1.00 0.34 H new ATOM 0 HD11 LEU A1693 -1.355 2.152 -1.454 1.00 63.30 H new ATOM 0 HD12 LEU A1693 0.310 1.907 -0.875 1.00 63.30 H new ATOM 0 HD13 LEU A1693 0.017 2.409 -2.557 1.00 63.30 H new ATOM 0 HD21 LEU A1693 -2.391 0.584 -2.971 1.00 35.42 H new ATOM 0 HD22 LEU A1693 -1.075 0.705 -4.162 1.00 35.42 H new ATOM 0 HD23 LEU A1693 -1.536 -0.883 -3.502 1.00 35.42 H new ATOM 446 N HIS A1694 3.650 1.093 -0.306 1.00 54.41 N ATOM 447 CA HIS A1694 4.465 2.264 -0.106 1.00 32.33 C ATOM 448 C HIS A1694 5.728 2.222 -0.945 1.00 1.32 C ATOM 449 O HIS A1694 6.456 1.240 -0.932 1.00 23.41 O ATOM 450 CB HIS A1694 4.794 2.508 1.382 1.00 72.23 C ATOM 451 CG HIS A1694 5.642 1.484 2.091 1.00 4.13 C ATOM 452 ND1 HIS A1694 5.126 0.528 2.909 1.00 4.42 N ATOM 453 CD2 HIS A1694 6.976 1.355 2.176 1.00 53.52 C ATOM 454 CE1 HIS A1694 6.083 -0.132 3.489 1.00 35.00 C ATOM 455 NE2 HIS A1694 7.229 0.343 3.060 1.00 73.33 N ATOM 0 H HIS A1694 3.690 0.408 0.449 1.00 54.41 H new ATOM 0 HA HIS A1694 3.869 3.112 -0.444 1.00 32.33 H new ATOM 0 HB2 HIS A1694 5.297 3.472 1.460 1.00 72.23 H new ATOM 0 HB3 HIS A1694 3.852 2.596 1.923 1.00 72.23 H new ATOM 0 HD1 HIS A1694 4.131 0.354 3.047 1.00 4.42 H new ATOM 0 HD2 HIS A1694 7.712 1.941 1.645 1.00 53.52 H new ATOM 0 HE1 HIS A1694 5.957 -0.934 4.202 1.00 35.00 H new ATOM 464 N GLY A1695 5.968 3.289 -1.665 1.00 13.54 N ATOM 465 CA GLY A1695 7.156 3.392 -2.476 1.00 1.54 C ATOM 466 C GLY A1695 6.854 3.279 -3.948 1.00 45.42 C ATOM 467 O GLY A1695 7.731 3.478 -4.780 1.00 64.21 O ATOM 0 H GLY A1695 5.354 4.102 -1.706 1.00 13.54 H new ATOM 0 HA2 GLY A1695 7.646 4.346 -2.280 1.00 1.54 H new ATOM 0 HA3 GLY A1695 7.858 2.609 -2.190 1.00 1.54 H new ATOM 471 N LEU A1696 5.624 2.936 -4.262 1.00 53.33 N ATOM 472 CA LEU A1696 5.175 2.829 -5.643 1.00 62.00 C ATOM 473 C LEU A1696 4.866 4.192 -6.246 1.00 21.22 C ATOM 474 O LEU A1696 4.879 5.219 -5.561 1.00 1.20 O ATOM 475 CB LEU A1696 3.927 1.931 -5.766 1.00 21.42 C ATOM 476 CG LEU A1696 4.135 0.409 -5.784 1.00 42.40 C ATOM 477 CD1 LEU A1696 4.779 -0.102 -4.527 1.00 14.23 C ATOM 478 CD2 LEU A1696 2.827 -0.294 -6.044 1.00 31.24 C ATOM 0 H LEU A1696 4.904 2.723 -3.572 1.00 53.33 H new ATOM 0 HA LEU A1696 5.998 2.377 -6.196 1.00 62.00 H new ATOM 0 HB2 LEU A1696 3.262 2.168 -4.936 1.00 21.42 H new ATOM 0 HB3 LEU A1696 3.405 2.208 -6.682 1.00 21.42 H new ATOM 0 HG LEU A1696 4.826 0.187 -6.597 1.00 42.40 H new ATOM 0 HD11 LEU A1696 4.902 -1.183 -4.595 1.00 14.23 H new ATOM 0 HD12 LEU A1696 5.755 0.367 -4.402 1.00 14.23 H new ATOM 0 HD13 LEU A1696 4.148 0.139 -3.671 1.00 14.23 H new ATOM 0 HD21 LEU A1696 2.989 -1.372 -6.054 1.00 31.24 H new ATOM 0 HD22 LEU A1696 2.116 -0.041 -5.258 1.00 31.24 H new ATOM 0 HD23 LEU A1696 2.429 0.022 -7.008 1.00 31.24 H new ATOM 490 N HIS A1697 4.631 4.195 -7.536 1.00 75.44 N ATOM 491 CA HIS A1697 4.191 5.401 -8.232 1.00 32.00 C ATOM 492 C HIS A1697 2.722 5.608 -7.965 1.00 71.01 C ATOM 493 O HIS A1697 2.027 4.677 -7.538 1.00 41.25 O ATOM 494 CB HIS A1697 4.391 5.322 -9.769 1.00 34.04 C ATOM 495 CG HIS A1697 5.802 5.442 -10.272 1.00 61.20 C ATOM 496 ND1 HIS A1697 6.471 4.442 -10.951 1.00 23.33 N ATOM 497 CD2 HIS A1697 6.648 6.499 -10.253 1.00 15.20 C ATOM 498 CE1 HIS A1697 7.664 4.914 -11.317 1.00 12.43 C ATOM 499 NE2 HIS A1697 7.824 6.159 -10.917 1.00 34.12 N ATOM 0 H HIS A1697 4.735 3.377 -8.136 1.00 75.44 H new ATOM 0 HA HIS A1697 4.798 6.225 -7.857 1.00 32.00 H new ATOM 0 HB2 HIS A1697 3.985 4.372 -10.117 1.00 34.04 H new ATOM 0 HB3 HIS A1697 3.797 6.111 -10.231 1.00 34.04 H new ATOM 0 HD1 HIS A1697 6.115 3.505 -11.140 1.00 23.33 H new ATOM 0 HD2 HIS A1697 6.443 7.455 -9.795 1.00 15.20 H new ATOM 0 HE1 HIS A1697 8.401 4.350 -11.869 1.00 12.43 H new ATOM 507 N VAL A1698 2.253 6.805 -8.254 1.00 72.10 N ATOM 508 CA VAL A1698 0.845 7.168 -8.121 1.00 63.14 C ATOM 509 C VAL A1698 -0.003 6.208 -8.959 1.00 33.00 C ATOM 510 O VAL A1698 -0.962 5.616 -8.479 1.00 21.45 O ATOM 511 CB VAL A1698 0.641 8.637 -8.616 1.00 64.30 C ATOM 512 CG1 VAL A1698 -0.801 9.041 -8.656 1.00 33.41 C ATOM 513 CG2 VAL A1698 1.421 9.601 -7.756 1.00 43.11 C ATOM 0 H VAL A1698 2.841 7.567 -8.592 1.00 72.10 H new ATOM 0 HA VAL A1698 0.539 7.098 -7.077 1.00 63.14 H new ATOM 0 HB VAL A1698 1.016 8.674 -9.639 1.00 64.30 H new ATOM 0 HG11 VAL A1698 -0.881 10.070 -9.007 1.00 33.41 H new ATOM 0 HG12 VAL A1698 -1.345 8.383 -9.334 1.00 33.41 H new ATOM 0 HG13 VAL A1698 -1.228 8.965 -7.656 1.00 33.41 H new ATOM 0 HG21 VAL A1698 1.266 10.618 -8.117 1.00 43.11 H new ATOM 0 HG22 VAL A1698 1.079 9.526 -6.724 1.00 43.11 H new ATOM 0 HG23 VAL A1698 2.482 9.356 -7.806 1.00 43.11 H new ATOM 523 N ASP A1699 0.428 6.036 -10.188 1.00 14.24 N ATOM 524 CA ASP A1699 -0.207 5.168 -11.180 1.00 22.32 C ATOM 525 C ASP A1699 -0.290 3.750 -10.663 1.00 62.22 C ATOM 526 O ASP A1699 -1.373 3.161 -10.600 1.00 61.11 O ATOM 527 CB ASP A1699 0.640 5.158 -12.456 1.00 11.33 C ATOM 528 CG ASP A1699 0.868 6.529 -13.032 1.00 34.33 C ATOM 529 OD1 ASP A1699 1.552 7.351 -12.375 1.00 53.21 O ATOM 530 OD2 ASP A1699 0.384 6.813 -14.139 1.00 33.22 O ATOM 0 H ASP A1699 1.258 6.508 -10.546 1.00 14.24 H new ATOM 0 HA ASP A1699 -1.209 5.546 -11.381 1.00 22.32 H new ATOM 0 HB2 ASP A1699 1.604 4.698 -12.240 1.00 11.33 H new ATOM 0 HB3 ASP A1699 0.150 4.535 -13.204 1.00 11.33 H new ATOM 535 N GLU A1700 0.866 3.244 -10.252 1.00 44.24 N ATOM 536 CA GLU A1700 1.039 1.877 -9.777 1.00 75.23 C ATOM 537 C GLU A1700 0.145 1.592 -8.590 1.00 42.51 C ATOM 538 O GLU A1700 -0.658 0.652 -8.621 1.00 65.24 O ATOM 539 CB GLU A1700 2.504 1.659 -9.400 1.00 44.54 C ATOM 540 CG GLU A1700 3.452 1.804 -10.575 1.00 31.34 C ATOM 541 CD GLU A1700 4.930 1.822 -10.201 1.00 61.13 C ATOM 542 OE1 GLU A1700 5.281 2.030 -9.021 1.00 24.54 O ATOM 543 OE2 GLU A1700 5.776 1.703 -11.118 1.00 51.14 O ATOM 0 H GLU A1700 1.730 3.786 -10.239 1.00 44.24 H new ATOM 0 HA GLU A1700 0.757 1.190 -10.575 1.00 75.23 H new ATOM 0 HB2 GLU A1700 2.783 2.374 -8.626 1.00 44.54 H new ATOM 0 HB3 GLU A1700 2.618 0.664 -8.971 1.00 44.54 H new ATOM 0 HG2 GLU A1700 3.277 0.982 -11.270 1.00 31.34 H new ATOM 0 HG3 GLU A1700 3.214 2.726 -11.105 1.00 31.34 H new ATOM 550 N ALA A1701 0.254 2.429 -7.569 1.00 23.12 N ATOM 551 CA ALA A1701 -0.546 2.293 -6.373 1.00 11.31 C ATOM 552 C ALA A1701 -2.043 2.266 -6.688 1.00 4.02 C ATOM 553 O ALA A1701 -2.758 1.423 -6.179 1.00 22.13 O ATOM 554 CB ALA A1701 -0.231 3.401 -5.399 1.00 61.12 C ATOM 0 H ALA A1701 0.900 3.218 -7.551 1.00 23.12 H new ATOM 0 HA ALA A1701 -0.291 1.337 -5.916 1.00 11.31 H new ATOM 0 HB1 ALA A1701 -0.842 3.283 -4.504 1.00 61.12 H new ATOM 0 HB2 ALA A1701 0.824 3.357 -5.127 1.00 61.12 H new ATOM 0 HB3 ALA A1701 -0.446 4.364 -5.862 1.00 61.12 H new ATOM 560 N LEU A1702 -2.493 3.154 -7.570 1.00 53.12 N ATOM 561 CA LEU A1702 -3.913 3.220 -7.934 1.00 65.32 C ATOM 562 C LEU A1702 -4.379 1.947 -8.641 1.00 14.40 C ATOM 563 O LEU A1702 -5.453 1.410 -8.324 1.00 61.23 O ATOM 564 CB LEU A1702 -4.225 4.455 -8.795 1.00 64.31 C ATOM 565 CG LEU A1702 -4.050 5.822 -8.124 1.00 2.53 C ATOM 566 CD1 LEU A1702 -4.351 6.942 -9.108 1.00 22.54 C ATOM 567 CD2 LEU A1702 -4.944 5.942 -6.898 1.00 2.24 C ATOM 0 H LEU A1702 -1.902 3.836 -8.046 1.00 53.12 H new ATOM 0 HA LEU A1702 -4.468 3.310 -7.000 1.00 65.32 H new ATOM 0 HB2 LEU A1702 -3.587 4.425 -9.678 1.00 64.31 H new ATOM 0 HB3 LEU A1702 -5.255 4.376 -9.143 1.00 64.31 H new ATOM 0 HG LEU A1702 -3.012 5.910 -7.802 1.00 2.53 H new ATOM 0 HD11 LEU A1702 -4.222 7.905 -8.614 1.00 22.54 H new ATOM 0 HD12 LEU A1702 -3.669 6.875 -9.956 1.00 22.54 H new ATOM 0 HD13 LEU A1702 -5.378 6.850 -9.461 1.00 22.54 H new ATOM 0 HD21 LEU A1702 -4.802 6.920 -6.439 1.00 2.24 H new ATOM 0 HD22 LEU A1702 -5.986 5.828 -7.195 1.00 2.24 H new ATOM 0 HD23 LEU A1702 -4.684 5.163 -6.181 1.00 2.24 H new ATOM 579 N GLU A1703 -3.562 1.448 -9.561 1.00 55.52 N ATOM 580 CA GLU A1703 -3.893 0.244 -10.324 1.00 63.31 C ATOM 581 C GLU A1703 -3.979 -0.975 -9.424 1.00 0.52 C ATOM 582 O GLU A1703 -4.917 -1.787 -9.526 1.00 71.31 O ATOM 583 CB GLU A1703 -2.864 -0.002 -11.415 1.00 3.33 C ATOM 584 CG GLU A1703 -2.824 1.076 -12.468 1.00 13.34 C ATOM 585 CD GLU A1703 -1.750 0.840 -13.483 1.00 13.44 C ATOM 586 OE1 GLU A1703 -1.948 0.016 -14.392 1.00 44.34 O ATOM 587 OE2 GLU A1703 -0.687 1.484 -13.402 1.00 53.10 O ATOM 0 H GLU A1703 -2.660 1.859 -9.800 1.00 55.52 H new ATOM 0 HA GLU A1703 -4.869 0.408 -10.781 1.00 63.31 H new ATOM 0 HB2 GLU A1703 -1.878 -0.088 -10.959 1.00 3.33 H new ATOM 0 HB3 GLU A1703 -3.078 -0.957 -11.894 1.00 3.33 H new ATOM 0 HG2 GLU A1703 -3.790 1.126 -12.970 1.00 13.34 H new ATOM 0 HG3 GLU A1703 -2.663 2.042 -11.990 1.00 13.34 H new ATOM 594 N HIS A1704 -3.029 -1.089 -8.527 1.00 75.25 N ATOM 595 CA HIS A1704 -2.975 -2.220 -7.634 1.00 54.54 C ATOM 596 C HIS A1704 -4.029 -2.096 -6.525 1.00 14.23 C ATOM 597 O HIS A1704 -4.486 -3.099 -5.984 1.00 12.13 O ATOM 598 CB HIS A1704 -1.557 -2.430 -7.064 1.00 23.03 C ATOM 599 CG HIS A1704 -0.484 -2.718 -8.112 1.00 43.11 C ATOM 600 ND1 HIS A1704 -0.553 -3.739 -9.039 1.00 62.23 N ATOM 601 CD2 HIS A1704 0.701 -2.087 -8.361 1.00 65.20 C ATOM 602 CE1 HIS A1704 0.555 -3.705 -9.785 1.00 2.15 C ATOM 603 NE2 HIS A1704 1.352 -2.722 -9.416 1.00 15.20 N ATOM 0 H HIS A1704 -2.280 -0.409 -8.396 1.00 75.25 H new ATOM 0 HA HIS A1704 -3.214 -3.112 -8.213 1.00 54.54 H new ATOM 0 HB2 HIS A1704 -1.270 -1.540 -6.505 1.00 23.03 H new ATOM 0 HB3 HIS A1704 -1.584 -3.257 -6.355 1.00 23.03 H new ATOM 0 HD2 HIS A1704 1.075 -1.229 -7.823 1.00 65.20 H new ATOM 0 HE1 HIS A1704 0.770 -4.395 -10.588 1.00 2.15 H new ATOM 0 HE2 HIS A1704 2.257 -2.477 -9.819 1.00 15.20 H new ATOM 611 N LEU A1705 -4.412 -0.862 -6.212 1.00 33.42 N ATOM 612 CA LEU A1705 -5.469 -0.580 -5.239 1.00 21.00 C ATOM 613 C LEU A1705 -6.819 -1.016 -5.748 1.00 72.33 C ATOM 614 O LEU A1705 -7.503 -1.809 -5.101 1.00 64.51 O ATOM 615 CB LEU A1705 -5.519 0.925 -4.901 1.00 44.33 C ATOM 616 CG LEU A1705 -6.763 1.434 -4.139 1.00 11.31 C ATOM 617 CD1 LEU A1705 -6.881 0.832 -2.747 1.00 74.22 C ATOM 618 CD2 LEU A1705 -6.767 2.947 -4.079 1.00 71.45 C ATOM 0 H LEU A1705 -3.999 -0.026 -6.625 1.00 33.42 H new ATOM 0 HA LEU A1705 -5.232 -1.147 -4.339 1.00 21.00 H new ATOM 0 HB2 LEU A1705 -4.637 1.168 -4.309 1.00 44.33 H new ATOM 0 HB3 LEU A1705 -5.441 1.484 -5.834 1.00 44.33 H new ATOM 0 HG LEU A1705 -7.639 1.103 -4.697 1.00 11.31 H new ATOM 0 HD11 LEU A1705 -7.772 1.223 -2.256 1.00 74.22 H new ATOM 0 HD12 LEU A1705 -6.956 -0.253 -2.825 1.00 74.22 H new ATOM 0 HD13 LEU A1705 -5.999 1.093 -2.162 1.00 74.22 H new ATOM 0 HD21 LEU A1705 -7.650 3.287 -3.539 1.00 71.45 H new ATOM 0 HD22 LEU A1705 -5.871 3.293 -3.564 1.00 71.45 H new ATOM 0 HD23 LEU A1705 -6.783 3.351 -5.091 1.00 71.45 H new ATOM 630 N MET A1706 -7.172 -0.528 -6.926 1.00 41.10 N ATOM 631 CA MET A1706 -8.505 -0.722 -7.492 1.00 2.33 C ATOM 632 C MET A1706 -8.893 -2.182 -7.579 1.00 14.01 C ATOM 633 O MET A1706 -10.003 -2.540 -7.206 1.00 13.51 O ATOM 634 CB MET A1706 -8.667 -0.018 -8.858 1.00 45.44 C ATOM 635 CG MET A1706 -7.808 -0.564 -9.982 1.00 33.25 C ATOM 636 SD MET A1706 -8.002 0.340 -11.534 1.00 3.12 S ATOM 637 CE MET A1706 -7.418 1.973 -11.066 1.00 52.33 C ATOM 0 H MET A1706 -6.545 0.015 -7.520 1.00 41.10 H new ATOM 0 HA MET A1706 -9.197 -0.249 -6.796 1.00 2.33 H new ATOM 0 HB2 MET A1706 -9.713 -0.084 -9.159 1.00 45.44 H new ATOM 0 HB3 MET A1706 -8.438 1.040 -8.731 1.00 45.44 H new ATOM 0 HG2 MET A1706 -6.762 -0.531 -9.679 1.00 33.25 H new ATOM 0 HG3 MET A1706 -8.060 -1.612 -10.146 1.00 33.25 H new ATOM 0 HE1 MET A1706 -7.192 2.550 -11.963 1.00 52.33 H new ATOM 0 HE2 MET A1706 -8.190 2.484 -10.491 1.00 52.33 H new ATOM 0 HE3 MET A1706 -6.517 1.877 -10.460 1.00 52.33 H new ATOM 647 N ARG A1707 -7.945 -3.025 -7.983 1.00 51.13 N ATOM 648 CA ARG A1707 -8.212 -4.451 -8.150 1.00 50.01 C ATOM 649 C ARG A1707 -8.507 -5.115 -6.795 1.00 73.32 C ATOM 650 O ARG A1707 -9.399 -5.953 -6.680 1.00 10.54 O ATOM 651 CB ARG A1707 -7.034 -5.170 -8.849 1.00 41.32 C ATOM 652 CG ARG A1707 -5.755 -5.186 -8.035 1.00 33.51 C ATOM 653 CD ARG A1707 -4.649 -5.969 -8.689 1.00 63.41 C ATOM 654 NE ARG A1707 -3.501 -6.100 -7.779 1.00 52.03 N ATOM 655 CZ ARG A1707 -2.353 -6.725 -8.064 1.00 23.15 C ATOM 656 NH1 ARG A1707 -2.119 -7.186 -9.279 1.00 12.10 N ATOM 657 NH2 ARG A1707 -1.432 -6.871 -7.123 1.00 52.43 N ATOM 0 H ARG A1707 -6.988 -2.746 -8.200 1.00 51.13 H new ATOM 0 HA ARG A1707 -9.092 -4.544 -8.786 1.00 50.01 H new ATOM 0 HB2 ARG A1707 -7.326 -6.197 -9.068 1.00 41.32 H new ATOM 0 HB3 ARG A1707 -6.839 -4.683 -9.804 1.00 41.32 H new ATOM 0 HG2 ARG A1707 -5.421 -4.161 -7.875 1.00 33.51 H new ATOM 0 HG3 ARG A1707 -5.962 -5.611 -7.053 1.00 33.51 H new ATOM 0 HD2 ARG A1707 -5.012 -6.958 -8.970 1.00 63.41 H new ATOM 0 HD3 ARG A1707 -4.337 -5.471 -9.607 1.00 63.41 H new ATOM 0 HE ARG A1707 -3.587 -5.679 -6.854 1.00 52.03 H new ATOM 0 HH11 ARG A1707 -2.817 -7.067 -10.013 1.00 12.10 H new ATOM 0 HH12 ARG A1707 -1.240 -7.661 -9.484 1.00 12.10 H new ATOM 0 HH21 ARG A1707 -1.599 -6.507 -6.185 1.00 52.43 H new ATOM 0 HH22 ARG A1707 -0.556 -7.347 -7.337 1.00 52.43 H new ATOM 671 N VAL A1708 -7.769 -4.714 -5.774 1.00 42.00 N ATOM 672 CA VAL A1708 -7.920 -5.302 -4.455 1.00 2.32 C ATOM 673 C VAL A1708 -9.185 -4.794 -3.796 1.00 24.52 C ATOM 674 O VAL A1708 -9.954 -5.562 -3.227 1.00 22.32 O ATOM 675 CB VAL A1708 -6.689 -5.023 -3.540 1.00 10.23 C ATOM 676 CG1 VAL A1708 -6.913 -5.568 -2.132 1.00 53.54 C ATOM 677 CG2 VAL A1708 -5.429 -5.632 -4.135 1.00 51.43 C ATOM 0 H VAL A1708 -7.059 -3.984 -5.834 1.00 42.00 H new ATOM 0 HA VAL A1708 -7.988 -6.382 -4.589 1.00 2.32 H new ATOM 0 HB VAL A1708 -6.565 -3.942 -3.476 1.00 10.23 H new ATOM 0 HG11 VAL A1708 -6.038 -5.358 -1.517 1.00 53.54 H new ATOM 0 HG12 VAL A1708 -7.788 -5.090 -1.692 1.00 53.54 H new ATOM 0 HG13 VAL A1708 -7.073 -6.645 -2.180 1.00 53.54 H new ATOM 0 HG21 VAL A1708 -4.582 -5.426 -3.481 1.00 51.43 H new ATOM 0 HG22 VAL A1708 -5.557 -6.710 -4.234 1.00 51.43 H new ATOM 0 HG23 VAL A1708 -5.244 -5.197 -5.117 1.00 51.43 H new ATOM 687 N LEU A1709 -9.407 -3.511 -3.915 1.00 24.45 N ATOM 688 CA LEU A1709 -10.504 -2.862 -3.327 1.00 24.23 C ATOM 689 C LEU A1709 -11.820 -3.403 -3.881 1.00 23.24 C ATOM 690 O LEU A1709 -12.736 -3.701 -3.110 1.00 34.40 O ATOM 691 CB LEU A1709 -10.345 -1.388 -3.577 1.00 42.01 C ATOM 692 CG LEU A1709 -11.414 -0.516 -3.032 1.00 42.02 C ATOM 693 CD1 LEU A1709 -11.493 -0.596 -1.516 1.00 14.11 C ATOM 694 CD2 LEU A1709 -11.215 0.877 -3.483 1.00 61.10 C ATOM 0 H LEU A1709 -8.798 -2.887 -4.445 1.00 24.45 H new ATOM 0 HA LEU A1709 -10.533 -3.047 -2.253 1.00 24.23 H new ATOM 0 HB2 LEU A1709 -9.393 -1.069 -3.154 1.00 42.01 H new ATOM 0 HB3 LEU A1709 -10.286 -1.227 -4.653 1.00 42.01 H new ATOM 0 HG LEU A1709 -12.368 -0.875 -3.418 1.00 42.02 H new ATOM 0 HD11 LEU A1709 -12.289 0.058 -1.158 1.00 14.11 H new ATOM 0 HD12 LEU A1709 -11.704 -1.622 -1.216 1.00 14.11 H new ATOM 0 HD13 LEU A1709 -10.543 -0.281 -1.085 1.00 14.11 H new ATOM 0 HD21 LEU A1709 -12.006 1.508 -3.077 1.00 61.10 H new ATOM 0 HD22 LEU A1709 -10.248 1.238 -3.134 1.00 61.10 H new ATOM 0 HD23 LEU A1709 -11.245 0.915 -4.572 1.00 61.10 H new ATOM 706 N GLU A1710 -11.896 -3.589 -5.197 1.00 1.20 N ATOM 707 CA GLU A1710 -13.109 -4.116 -5.806 1.00 21.31 C ATOM 708 C GLU A1710 -13.364 -5.568 -5.371 1.00 5.14 C ATOM 709 O GLU A1710 -14.490 -5.923 -4.997 1.00 15.43 O ATOM 710 CB GLU A1710 -13.096 -3.980 -7.348 1.00 51.11 C ATOM 711 CG GLU A1710 -11.980 -4.734 -8.058 1.00 34.31 C ATOM 712 CD GLU A1710 -11.993 -4.537 -9.552 1.00 3.34 C ATOM 713 OE1 GLU A1710 -12.777 -5.221 -10.242 1.00 33.13 O ATOM 714 OE2 GLU A1710 -11.215 -3.704 -10.078 1.00 21.43 O ATOM 0 H GLU A1710 -11.141 -3.385 -5.852 1.00 1.20 H new ATOM 0 HA GLU A1710 -13.938 -3.508 -5.444 1.00 21.31 H new ATOM 0 HB2 GLU A1710 -14.053 -4.331 -7.735 1.00 51.11 H new ATOM 0 HB3 GLU A1710 -13.017 -2.923 -7.602 1.00 51.11 H new ATOM 0 HG2 GLU A1710 -11.019 -4.406 -7.662 1.00 34.31 H new ATOM 0 HG3 GLU A1710 -12.070 -5.798 -7.837 1.00 34.31 H new ATOM 721 N LYS A1711 -12.306 -6.382 -5.351 1.00 21.23 N ATOM 722 CA LYS A1711 -12.448 -7.783 -4.998 1.00 33.51 C ATOM 723 C LYS A1711 -12.778 -7.940 -3.515 1.00 73.13 C ATOM 724 O LYS A1711 -13.609 -8.763 -3.145 1.00 62.21 O ATOM 725 CB LYS A1711 -11.208 -8.622 -5.402 1.00 54.15 C ATOM 726 CG LYS A1711 -9.961 -8.460 -4.539 1.00 55.13 C ATOM 727 CD LYS A1711 -8.795 -9.277 -5.093 1.00 52.15 C ATOM 728 CE LYS A1711 -9.079 -10.784 -5.084 1.00 31.21 C ATOM 729 NZ LYS A1711 -9.146 -11.341 -3.719 1.00 61.10 N ATOM 0 H LYS A1711 -11.354 -6.092 -5.574 1.00 21.23 H new ATOM 0 HA LYS A1711 -13.286 -8.178 -5.573 1.00 33.51 H new ATOM 0 HB2 LYS A1711 -11.492 -9.674 -5.395 1.00 54.15 H new ATOM 0 HB3 LYS A1711 -10.946 -8.369 -6.429 1.00 54.15 H new ATOM 0 HG2 LYS A1711 -9.682 -7.407 -4.493 1.00 55.13 H new ATOM 0 HG3 LYS A1711 -10.178 -8.777 -3.519 1.00 55.13 H new ATOM 0 HD2 LYS A1711 -8.583 -8.956 -6.113 1.00 52.15 H new ATOM 0 HD3 LYS A1711 -7.901 -9.075 -4.503 1.00 52.15 H new ATOM 0 HE2 LYS A1711 -10.021 -10.975 -5.597 1.00 31.21 H new ATOM 0 HE3 LYS A1711 -8.300 -11.300 -5.645 1.00 31.21 H new ATOM 0 HZ1 LYS A1711 -8.949 -12.362 -3.751 1.00 61.10 H new ATOM 0 HZ2 LYS A1711 -8.440 -10.871 -3.117 1.00 61.10 H new ATOM 0 HZ3 LYS A1711 -10.096 -11.183 -3.326 1.00 61.10 H new ATOM 743 N LYS A1712 -12.171 -7.109 -2.677 1.00 15.53 N ATOM 744 CA LYS A1712 -12.431 -7.157 -1.254 1.00 32.31 C ATOM 745 C LYS A1712 -13.797 -6.643 -0.905 1.00 73.41 C ATOM 746 O LYS A1712 -14.388 -7.114 0.043 1.00 22.03 O ATOM 747 CB LYS A1712 -11.339 -6.489 -0.420 1.00 23.22 C ATOM 748 CG LYS A1712 -10.082 -7.339 -0.240 1.00 3.22 C ATOM 749 CD LYS A1712 -10.398 -8.607 0.551 1.00 32.11 C ATOM 750 CE LYS A1712 -9.180 -9.487 0.749 1.00 1.42 C ATOM 751 NZ LYS A1712 -9.551 -10.775 1.384 1.00 22.03 N ATOM 0 H LYS A1712 -11.498 -6.398 -2.962 1.00 15.53 H new ATOM 0 HA LYS A1712 -12.410 -8.214 -0.988 1.00 32.31 H new ATOM 0 HB2 LYS A1712 -11.062 -5.546 -0.892 1.00 23.22 H new ATOM 0 HB3 LYS A1712 -11.744 -6.247 0.562 1.00 23.22 H new ATOM 0 HG2 LYS A1712 -9.674 -7.605 -1.215 1.00 3.22 H new ATOM 0 HG3 LYS A1712 -9.317 -6.761 0.279 1.00 3.22 H new ATOM 0 HD2 LYS A1712 -10.806 -8.332 1.524 1.00 32.11 H new ATOM 0 HD3 LYS A1712 -11.170 -9.173 0.030 1.00 32.11 H new ATOM 0 HE2 LYS A1712 -8.703 -9.676 -0.213 1.00 1.42 H new ATOM 0 HE3 LYS A1712 -8.450 -8.968 1.370 1.00 1.42 H new ATOM 0 HZ1 LYS A1712 -8.727 -11.165 1.885 1.00 22.03 H new ATOM 0 HZ2 LYS A1712 -10.325 -10.618 2.060 1.00 22.03 H new ATOM 0 HZ3 LYS A1712 -9.861 -11.446 0.652 1.00 22.03 H new ATOM 765 N THR A1713 -14.315 -5.699 -1.683 1.00 54.41 N ATOM 766 CA THR A1713 -15.676 -5.228 -1.468 1.00 34.11 C ATOM 767 C THR A1713 -16.641 -6.400 -1.728 1.00 14.24 C ATOM 768 O THR A1713 -17.612 -6.604 -0.996 1.00 4.13 O ATOM 769 CB THR A1713 -16.028 -4.025 -2.395 1.00 22.54 C ATOM 770 OG1 THR A1713 -15.080 -2.960 -2.197 1.00 12.45 O ATOM 771 CG2 THR A1713 -17.427 -3.495 -2.097 1.00 51.32 C ATOM 0 H THR A1713 -13.822 -5.252 -2.456 1.00 54.41 H new ATOM 0 HA THR A1713 -15.769 -4.875 -0.441 1.00 34.11 H new ATOM 0 HB THR A1713 -15.992 -4.376 -3.426 1.00 22.54 H new ATOM 0 HG1 THR A1713 -14.355 -3.042 -2.851 1.00 12.45 H new ATOM 0 HG21 THR A1713 -17.647 -2.656 -2.758 1.00 51.32 H new ATOM 0 HG22 THR A1713 -18.158 -4.287 -2.260 1.00 51.32 H new ATOM 0 HG23 THR A1713 -17.477 -3.163 -1.060 1.00 51.32 H new ATOM 779 N GLU A1714 -16.311 -7.195 -2.738 1.00 34.23 N ATOM 780 CA GLU A1714 -17.067 -8.356 -3.102 1.00 44.13 C ATOM 781 C GLU A1714 -16.970 -9.417 -1.976 1.00 52.54 C ATOM 782 O GLU A1714 -17.982 -9.873 -1.462 1.00 72.44 O ATOM 783 CB GLU A1714 -16.502 -8.899 -4.411 1.00 21.43 C ATOM 784 CG GLU A1714 -17.326 -9.977 -5.045 1.00 5.22 C ATOM 785 CD GLU A1714 -18.678 -9.474 -5.483 1.00 1.24 C ATOM 786 OE1 GLU A1714 -18.779 -8.891 -6.570 1.00 71.24 O ATOM 787 OE2 GLU A1714 -19.673 -9.655 -4.744 1.00 62.30 O ATOM 0 H GLU A1714 -15.495 -7.037 -3.328 1.00 34.23 H new ATOM 0 HA GLU A1714 -18.119 -8.104 -3.236 1.00 44.13 H new ATOM 0 HB2 GLU A1714 -16.400 -8.075 -5.117 1.00 21.43 H new ATOM 0 HB3 GLU A1714 -15.500 -9.287 -4.226 1.00 21.43 H new ATOM 0 HG2 GLU A1714 -16.793 -10.381 -5.906 1.00 5.22 H new ATOM 0 HG3 GLU A1714 -17.456 -10.796 -4.338 1.00 5.22 H new ATOM 794 N GLU A1715 -15.740 -9.750 -1.579 1.00 63.14 N ATOM 795 CA GLU A1715 -15.456 -10.719 -0.502 1.00 75.42 C ATOM 796 C GLU A1715 -16.134 -10.316 0.803 1.00 72.31 C ATOM 797 O GLU A1715 -16.670 -11.156 1.519 1.00 3.23 O ATOM 798 CB GLU A1715 -13.952 -10.835 -0.281 1.00 33.35 C ATOM 799 CG GLU A1715 -13.201 -11.412 -1.458 1.00 25.50 C ATOM 800 CD GLU A1715 -11.714 -11.355 -1.270 1.00 12.04 C ATOM 801 OE1 GLU A1715 -11.186 -12.005 -0.338 1.00 63.12 O ATOM 802 OE2 GLU A1715 -11.034 -10.667 -2.039 1.00 42.04 O ATOM 0 H GLU A1715 -14.899 -9.353 -1.997 1.00 63.14 H new ATOM 0 HA GLU A1715 -15.856 -11.685 -0.812 1.00 75.42 H new ATOM 0 HB2 GLU A1715 -13.551 -9.847 -0.056 1.00 33.35 H new ATOM 0 HB3 GLU A1715 -13.771 -11.459 0.594 1.00 33.35 H new ATOM 0 HG2 GLU A1715 -13.506 -12.448 -1.608 1.00 25.50 H new ATOM 0 HG3 GLU A1715 -13.472 -10.866 -2.362 1.00 25.50 H new ATOM 809 N PHE A1716 -16.105 -9.041 1.092 1.00 51.33 N ATOM 810 CA PHE A1716 -16.753 -8.455 2.258 1.00 63.04 C ATOM 811 C PHE A1716 -18.251 -8.782 2.305 1.00 31.23 C ATOM 812 O PHE A1716 -18.759 -9.251 3.330 1.00 24.53 O ATOM 813 CB PHE A1716 -16.469 -6.937 2.260 1.00 71.20 C ATOM 814 CG PHE A1716 -17.477 -6.041 2.919 1.00 53.44 C ATOM 815 CD1 PHE A1716 -17.712 -6.075 4.281 1.00 22.23 C ATOM 816 CD2 PHE A1716 -18.171 -5.128 2.148 1.00 34.53 C ATOM 817 CE1 PHE A1716 -18.630 -5.213 4.853 1.00 41.52 C ATOM 818 CE2 PHE A1716 -19.080 -4.277 2.710 1.00 43.03 C ATOM 819 CZ PHE A1716 -19.314 -4.313 4.061 1.00 63.02 C ATOM 0 H PHE A1716 -15.620 -8.355 0.513 1.00 51.33 H new ATOM 0 HA PHE A1716 -16.341 -8.890 3.168 1.00 63.04 H new ATOM 0 HB2 PHE A1716 -15.507 -6.776 2.747 1.00 71.20 H new ATOM 0 HB3 PHE A1716 -16.359 -6.615 1.225 1.00 71.20 H new ATOM 0 HD1 PHE A1716 -17.176 -6.778 4.901 1.00 22.23 H new ATOM 0 HD2 PHE A1716 -17.992 -5.087 1.084 1.00 34.53 H new ATOM 0 HE1 PHE A1716 -18.811 -5.244 5.917 1.00 41.52 H new ATOM 0 HE2 PHE A1716 -19.616 -3.574 2.089 1.00 43.03 H new ATOM 0 HZ PHE A1716 -20.032 -3.639 4.504 1.00 63.02 H new ATOM 829 N LYS A1717 -18.932 -8.598 1.197 1.00 23.10 N ATOM 830 CA LYS A1717 -20.365 -8.836 1.152 1.00 13.14 C ATOM 831 C LYS A1717 -20.723 -10.287 0.823 1.00 21.53 C ATOM 832 O LYS A1717 -21.865 -10.709 1.011 1.00 43.43 O ATOM 833 CB LYS A1717 -21.064 -7.828 0.226 1.00 74.11 C ATOM 834 CG LYS A1717 -20.541 -7.764 -1.203 1.00 63.51 C ATOM 835 CD LYS A1717 -21.089 -6.530 -1.900 1.00 63.25 C ATOM 836 CE LYS A1717 -20.522 -6.333 -3.301 1.00 74.21 C ATOM 837 NZ LYS A1717 -20.956 -7.377 -4.252 1.00 73.25 N ATOM 0 H LYS A1717 -18.523 -8.286 0.316 1.00 23.10 H new ATOM 0 HA LYS A1717 -20.746 -8.671 2.160 1.00 13.14 H new ATOM 0 HB2 LYS A1717 -22.126 -8.070 0.193 1.00 74.11 H new ATOM 0 HB3 LYS A1717 -20.977 -6.836 0.669 1.00 74.11 H new ATOM 0 HG2 LYS A1717 -19.451 -7.737 -1.200 1.00 63.51 H new ATOM 0 HG3 LYS A1717 -20.836 -8.661 -1.748 1.00 63.51 H new ATOM 0 HD2 LYS A1717 -22.175 -6.607 -1.961 1.00 63.25 H new ATOM 0 HD3 LYS A1717 -20.865 -5.650 -1.297 1.00 63.25 H new ATOM 0 HE2 LYS A1717 -20.829 -5.357 -3.677 1.00 74.21 H new ATOM 0 HE3 LYS A1717 -19.433 -6.327 -3.249 1.00 74.21 H new ATOM 0 HZ1 LYS A1717 -20.918 -7.001 -5.221 1.00 73.25 H new ATOM 0 HZ2 LYS A1717 -20.326 -8.201 -4.175 1.00 73.25 H new ATOM 0 HZ3 LYS A1717 -21.930 -7.665 -4.031 1.00 73.25 H new ATOM 851 N GLN A1718 -19.760 -11.046 0.347 1.00 63.33 N ATOM 852 CA GLN A1718 -19.986 -12.456 0.036 1.00 5.43 C ATOM 853 C GLN A1718 -19.549 -13.393 1.154 1.00 43.21 C ATOM 854 O GLN A1718 -20.340 -14.192 1.650 1.00 55.23 O ATOM 855 CB GLN A1718 -19.308 -12.881 -1.263 1.00 1.32 C ATOM 856 CG GLN A1718 -19.968 -12.368 -2.521 1.00 51.45 C ATOM 857 CD GLN A1718 -19.459 -13.092 -3.751 1.00 63.11 C ATOM 858 OE1 GLN A1718 -19.072 -14.256 -3.685 1.00 24.02 O ATOM 859 NE2 GLN A1718 -19.454 -12.438 -4.860 1.00 35.10 N ATOM 0 H GLN A1718 -18.811 -10.719 0.164 1.00 63.33 H new ATOM 0 HA GLN A1718 -21.066 -12.542 -0.081 1.00 5.43 H new ATOM 0 HB2 GLN A1718 -18.274 -12.537 -1.246 1.00 1.32 H new ATOM 0 HB3 GLN A1718 -19.281 -13.970 -1.302 1.00 1.32 H new ATOM 0 HG2 GLN A1718 -21.048 -12.495 -2.444 1.00 51.45 H new ATOM 0 HG3 GLN A1718 -19.779 -11.299 -2.622 1.00 51.45 H new ATOM 0 HE21 GLN A1718 -19.781 -11.472 -4.884 1.00 35.10 H new ATOM 0 HE22 GLN A1718 -19.123 -12.886 -5.715 1.00 35.10 H new ATOM 868 N ASN A1719 -18.299 -13.307 1.542 1.00 11.44 N ATOM 869 CA ASN A1719 -17.736 -14.237 2.523 1.00 71.23 C ATOM 870 C ASN A1719 -17.758 -13.662 3.902 1.00 21.35 C ATOM 871 O ASN A1719 -17.419 -14.346 4.876 1.00 34.13 O ATOM 872 CB ASN A1719 -16.301 -14.632 2.164 1.00 52.13 C ATOM 873 CG ASN A1719 -16.211 -15.429 0.888 1.00 15.12 C ATOM 874 OD1 ASN A1719 -17.132 -16.142 0.514 1.00 73.20 O ATOM 875 ND2 ASN A1719 -15.104 -15.334 0.226 1.00 23.53 N ATOM 0 H ASN A1719 -17.642 -12.606 1.200 1.00 11.44 H new ATOM 0 HA ASN A1719 -18.365 -15.127 2.501 1.00 71.23 H new ATOM 0 HB2 ASN A1719 -15.696 -13.731 2.066 1.00 52.13 H new ATOM 0 HB3 ASN A1719 -15.875 -15.215 2.981 1.00 52.13 H new ATOM 0 HD21 ASN A1719 -14.979 -15.863 -0.637 1.00 23.53 H new ATOM 0 HD22 ASN A1719 -14.356 -14.730 0.567 1.00 23.53 H new ATOM 882 N GLY A1720 -18.135 -12.411 3.990 1.00 42.04 N ATOM 883 CA GLY A1720 -18.179 -11.745 5.253 1.00 23.03 C ATOM 884 C GLY A1720 -16.794 -11.440 5.742 1.00 64.01 C ATOM 885 O GLY A1720 -16.421 -11.821 6.851 1.00 43.12 O ATOM 0 H GLY A1720 -18.416 -11.837 3.195 1.00 42.04 H new ATOM 0 HA2 GLY A1720 -18.749 -10.821 5.162 1.00 23.03 H new ATOM 0 HA3 GLY A1720 -18.697 -12.369 5.981 1.00 23.03 H new ATOM 889 N GLY A1721 -16.016 -10.801 4.899 1.00 74.32 N ATOM 890 CA GLY A1721 -14.675 -10.429 5.270 1.00 35.33 C ATOM 891 C GLY A1721 -14.667 -9.151 6.076 1.00 0.43 C ATOM 892 O GLY A1721 -15.687 -8.778 6.674 1.00 41.44 O ATOM 0 H GLY A1721 -16.290 -10.530 3.955 1.00 74.32 H new ATOM 0 HA2 GLY A1721 -14.219 -11.231 5.850 1.00 35.33 H new ATOM 0 HA3 GLY A1721 -14.069 -10.301 4.373 1.00 35.33 H new ATOM 896 N LYS A1722 -13.552 -8.472 6.101 1.00 2.45 N ATOM 897 CA LYS A1722 -13.480 -7.232 6.821 1.00 2.41 C ATOM 898 C LYS A1722 -14.209 -6.131 6.104 1.00 42.02 C ATOM 899 O LYS A1722 -14.116 -5.998 4.887 1.00 62.20 O ATOM 900 CB LYS A1722 -12.061 -6.752 7.126 1.00 30.20 C ATOM 901 CG LYS A1722 -11.375 -7.392 8.311 1.00 55.12 C ATOM 902 CD LYS A1722 -10.799 -8.731 8.013 1.00 31.23 C ATOM 903 CE LYS A1722 -9.980 -9.215 9.201 1.00 23.32 C ATOM 904 NZ LYS A1722 -8.913 -8.236 9.592 1.00 5.24 N ATOM 0 H LYS A1722 -12.689 -8.754 5.636 1.00 2.45 H new ATOM 0 HA LYS A1722 -13.960 -7.456 7.774 1.00 2.41 H new ATOM 0 HB2 LYS A1722 -11.446 -6.922 6.242 1.00 30.20 H new ATOM 0 HB3 LYS A1722 -12.093 -5.675 7.290 1.00 30.20 H new ATOM 0 HG2 LYS A1722 -10.580 -6.733 8.660 1.00 55.12 H new ATOM 0 HG3 LYS A1722 -12.091 -7.487 9.127 1.00 55.12 H new ATOM 0 HD2 LYS A1722 -11.597 -9.441 7.797 1.00 31.23 H new ATOM 0 HD3 LYS A1722 -10.171 -8.677 7.124 1.00 31.23 H new ATOM 0 HE2 LYS A1722 -10.642 -9.387 10.050 1.00 23.32 H new ATOM 0 HE3 LYS A1722 -9.520 -10.172 8.957 1.00 23.32 H new ATOM 0 HZ1 LYS A1722 -8.267 -8.681 10.275 1.00 5.24 H new ATOM 0 HZ2 LYS A1722 -8.379 -7.948 8.747 1.00 5.24 H new ATOM 0 HZ3 LYS A1722 -9.352 -7.399 10.026 1.00 5.24 H new ATOM 918 N PRO A1723 -14.910 -5.300 6.868 1.00 11.14 N ATOM 919 CA PRO A1723 -15.627 -4.135 6.350 1.00 4.54 C ATOM 920 C PRO A1723 -14.685 -2.945 6.125 1.00 43.11 C ATOM 921 O PRO A1723 -15.130 -1.786 6.034 1.00 14.21 O ATOM 922 CB PRO A1723 -16.597 -3.817 7.494 1.00 4.50 C ATOM 923 CG PRO A1723 -15.858 -4.224 8.720 1.00 55.01 C ATOM 924 CD PRO A1723 -15.098 -5.457 8.331 1.00 10.11 C ATOM 0 HA PRO A1723 -16.103 -4.323 5.388 1.00 4.54 H new ATOM 0 HB2 PRO A1723 -16.854 -2.758 7.516 1.00 4.50 H new ATOM 0 HB3 PRO A1723 -17.531 -4.369 7.390 1.00 4.50 H new ATOM 0 HG2 PRO A1723 -15.184 -3.435 9.053 1.00 55.01 H new ATOM 0 HG3 PRO A1723 -16.543 -4.427 9.543 1.00 55.01 H new ATOM 0 HD2 PRO A1723 -14.144 -5.522 8.854 1.00 10.11 H new ATOM 0 HD3 PRO A1723 -15.654 -6.363 8.569 1.00 10.11 H new ATOM 932 N TYR A1724 -13.402 -3.228 6.019 1.00 4.44 N ATOM 933 CA TYR A1724 -12.402 -2.213 5.874 1.00 10.24 C ATOM 934 C TYR A1724 -11.204 -2.746 5.105 1.00 44.23 C ATOM 935 O TYR A1724 -11.049 -3.960 4.941 1.00 30.12 O ATOM 936 CB TYR A1724 -11.936 -1.690 7.265 1.00 63.22 C ATOM 937 CG TYR A1724 -11.248 -2.721 8.154 1.00 10.31 C ATOM 938 CD1 TYR A1724 -9.884 -2.982 8.028 1.00 20.44 C ATOM 939 CD2 TYR A1724 -11.960 -3.431 9.108 1.00 1.41 C ATOM 940 CE1 TYR A1724 -9.260 -3.920 8.819 1.00 63.10 C ATOM 941 CE2 TYR A1724 -11.341 -4.376 9.903 1.00 40.31 C ATOM 942 CZ TYR A1724 -9.990 -4.616 9.753 1.00 21.21 C ATOM 943 OH TYR A1724 -9.374 -5.578 10.527 1.00 4.44 O ATOM 0 H TYR A1724 -13.031 -4.178 6.032 1.00 4.44 H new ATOM 0 HA TYR A1724 -12.846 -1.388 5.317 1.00 10.24 H new ATOM 0 HB2 TYR A1724 -11.253 -0.855 7.110 1.00 63.22 H new ATOM 0 HB3 TYR A1724 -12.803 -1.298 7.796 1.00 63.22 H new ATOM 0 HD1 TYR A1724 -9.306 -2.438 7.296 1.00 20.44 H new ATOM 0 HD2 TYR A1724 -13.016 -3.242 9.232 1.00 1.41 H new ATOM 0 HE1 TYR A1724 -8.202 -4.108 8.706 1.00 63.10 H new ATOM 0 HE2 TYR A1724 -11.911 -4.924 10.638 1.00 40.31 H new ATOM 0 HH TYR A1724 -10.029 -5.975 11.138 1.00 4.44 H new ATOM 953 N LEU A1725 -10.389 -1.835 4.648 1.00 61.04 N ATOM 954 CA LEU A1725 -9.114 -2.106 4.020 1.00 44.53 C ATOM 955 C LEU A1725 -8.106 -1.092 4.495 1.00 75.21 C ATOM 956 O LEU A1725 -8.349 0.107 4.431 1.00 72.40 O ATOM 957 CB LEU A1725 -9.201 -2.083 2.490 1.00 63.01 C ATOM 958 CG LEU A1725 -9.526 -3.411 1.814 1.00 70.31 C ATOM 959 CD1 LEU A1725 -9.756 -3.199 0.340 1.00 24.45 C ATOM 960 CD2 LEU A1725 -8.372 -4.384 2.003 1.00 22.44 C ATOM 0 H LEU A1725 -10.600 -0.839 4.703 1.00 61.04 H new ATOM 0 HA LEU A1725 -8.805 -3.111 4.306 1.00 44.53 H new ATOM 0 HB2 LEU A1725 -9.960 -1.357 2.201 1.00 63.01 H new ATOM 0 HB3 LEU A1725 -8.250 -1.723 2.098 1.00 63.01 H new ATOM 0 HG LEU A1725 -10.429 -3.821 2.267 1.00 70.31 H new ATOM 0 HD11 LEU A1725 -9.987 -4.153 -0.133 1.00 24.45 H new ATOM 0 HD12 LEU A1725 -10.590 -2.512 0.197 1.00 24.45 H new ATOM 0 HD13 LEU A1725 -8.858 -2.778 -0.112 1.00 24.45 H new ATOM 0 HD21 LEU A1725 -8.611 -5.330 1.518 1.00 22.44 H new ATOM 0 HD22 LEU A1725 -7.468 -3.967 1.559 1.00 22.44 H new ATOM 0 HD23 LEU A1725 -8.209 -4.553 3.067 1.00 22.44 H new ATOM 972 N SER A1726 -7.014 -1.558 5.000 1.00 20.15 N ATOM 973 CA SER A1726 -5.981 -0.683 5.476 1.00 1.34 C ATOM 974 C SER A1726 -4.982 -0.454 4.345 1.00 4.01 C ATOM 975 O SER A1726 -4.275 -1.377 3.951 1.00 32.11 O ATOM 976 CB SER A1726 -5.288 -1.336 6.667 1.00 52.41 C ATOM 977 OG SER A1726 -6.242 -1.839 7.602 1.00 54.41 O ATOM 0 H SER A1726 -6.807 -2.552 5.097 1.00 20.15 H new ATOM 0 HA SER A1726 -6.400 0.273 5.790 1.00 1.34 H new ATOM 0 HB2 SER A1726 -4.650 -2.149 6.320 1.00 52.41 H new ATOM 0 HB3 SER A1726 -4.640 -0.610 7.158 1.00 52.41 H new ATOM 0 HG SER A1726 -5.774 -2.255 8.356 1.00 54.41 H new ATOM 983 N VAL A1727 -4.961 0.734 3.796 1.00 15.13 N ATOM 984 CA VAL A1727 -4.065 1.048 2.704 1.00 64.54 C ATOM 985 C VAL A1727 -2.857 1.814 3.230 1.00 53.24 C ATOM 986 O VAL A1727 -2.981 2.939 3.724 1.00 33.44 O ATOM 987 CB VAL A1727 -4.771 1.875 1.593 1.00 53.13 C ATOM 988 CG1 VAL A1727 -3.827 2.144 0.422 1.00 4.43 C ATOM 989 CG2 VAL A1727 -6.026 1.162 1.107 1.00 31.25 C ATOM 0 H VAL A1727 -5.558 1.508 4.088 1.00 15.13 H new ATOM 0 HA VAL A1727 -3.742 0.106 2.260 1.00 64.54 H new ATOM 0 HB VAL A1727 -5.059 2.834 2.024 1.00 53.13 H new ATOM 0 HG11 VAL A1727 -4.348 2.724 -0.340 1.00 4.43 H new ATOM 0 HG12 VAL A1727 -2.960 2.703 0.774 1.00 4.43 H new ATOM 0 HG13 VAL A1727 -3.498 1.197 -0.005 1.00 4.43 H new ATOM 0 HG21 VAL A1727 -6.505 1.758 0.330 1.00 31.25 H new ATOM 0 HG22 VAL A1727 -5.757 0.186 0.702 1.00 31.25 H new ATOM 0 HG23 VAL A1727 -6.716 1.031 1.941 1.00 31.25 H new ATOM 999 N ILE A1728 -1.710 1.202 3.152 1.00 31.01 N ATOM 1000 CA ILE A1728 -0.493 1.817 3.616 1.00 3.11 C ATOM 1001 C ILE A1728 0.207 2.469 2.441 1.00 3.32 C ATOM 1002 O ILE A1728 0.758 1.785 1.570 1.00 32.14 O ATOM 1003 CB ILE A1728 0.499 0.812 4.346 1.00 73.43 C ATOM 1004 CG1 ILE A1728 -0.088 0.245 5.665 1.00 25.23 C ATOM 1005 CG2 ILE A1728 1.860 1.466 4.631 1.00 13.52 C ATOM 1006 CD1 ILE A1728 -1.219 -0.752 5.507 1.00 14.43 C ATOM 0 H ILE A1728 -1.589 0.265 2.767 1.00 31.01 H new ATOM 0 HA ILE A1728 -0.776 2.556 4.366 1.00 3.11 H new ATOM 0 HB ILE A1728 0.639 -0.019 3.654 1.00 73.43 H new ATOM 0 HG12 ILE A1728 0.717 -0.232 6.224 1.00 25.23 H new ATOM 0 HG13 ILE A1728 -0.445 1.078 6.270 1.00 25.23 H new ATOM 0 HG21 ILE A1728 2.511 0.748 5.131 1.00 13.52 H new ATOM 0 HG22 ILE A1728 2.317 1.779 3.692 1.00 13.52 H new ATOM 0 HG23 ILE A1728 1.719 2.336 5.273 1.00 13.52 H new ATOM 0 HD11 ILE A1728 -1.553 -1.083 6.491 1.00 14.43 H new ATOM 0 HD12 ILE A1728 -2.049 -0.280 4.982 1.00 14.43 H new ATOM 0 HD13 ILE A1728 -0.869 -1.611 4.935 1.00 14.43 H new ATOM 1018 N THR A1729 0.136 3.782 2.382 1.00 52.12 N ATOM 1019 CA THR A1729 0.835 4.512 1.358 1.00 1.42 C ATOM 1020 C THR A1729 2.247 4.804 1.866 1.00 14.30 C ATOM 1021 O THR A1729 3.137 5.232 1.122 1.00 1.44 O ATOM 1022 CB THR A1729 0.099 5.826 0.959 1.00 23.03 C ATOM 1023 OG1 THR A1729 0.065 6.733 2.057 1.00 75.22 O ATOM 1024 CG2 THR A1729 -1.334 5.523 0.537 1.00 1.31 C ATOM 0 H THR A1729 -0.398 4.360 3.031 1.00 52.12 H new ATOM 0 HA THR A1729 0.875 3.906 0.453 1.00 1.42 H new ATOM 0 HB THR A1729 0.643 6.275 0.128 1.00 23.03 H new ATOM 0 HG1 THR A1729 -0.368 6.303 2.824 1.00 75.22 H new ATOM 0 HG21 THR A1729 -1.836 6.450 0.261 1.00 1.31 H new ATOM 0 HG22 THR A1729 -1.326 4.846 -0.318 1.00 1.31 H new ATOM 0 HG23 THR A1729 -1.866 5.055 1.365 1.00 1.31 H new ATOM 1169 N ARG A1741 3.211 11.016 -3.092 1.00 73.03 N ATOM 1170 CA ARG A1741 2.080 11.374 -3.953 1.00 45.41 C ATOM 1171 C ARG A1741 1.054 10.278 -4.052 1.00 63.53 C ATOM 1172 O ARG A1741 0.005 10.450 -4.671 1.00 21.30 O ATOM 1173 CB ARG A1741 2.544 11.812 -5.331 1.00 61.01 C ATOM 1174 CG ARG A1741 3.176 13.185 -5.360 1.00 40.11 C ATOM 1175 CD ARG A1741 2.160 14.270 -5.054 1.00 4.50 C ATOM 1176 NE ARG A1741 1.071 14.314 -6.033 1.00 20.45 N ATOM 1177 CZ ARG A1741 0.787 15.361 -6.811 1.00 22.22 C ATOM 1178 NH1 ARG A1741 1.516 16.464 -6.741 1.00 33.45 N ATOM 1179 NH2 ARG A1741 -0.233 15.301 -7.648 1.00 0.01 N ATOM 0 HA ARG A1741 1.590 12.222 -3.475 1.00 45.41 H new ATOM 0 HB2 ARG A1741 3.262 11.085 -5.709 1.00 61.01 H new ATOM 0 HB3 ARG A1741 1.692 11.801 -6.010 1.00 61.01 H new ATOM 0 HG2 ARG A1741 3.987 13.229 -4.633 1.00 40.11 H new ATOM 0 HG3 ARG A1741 3.617 13.364 -6.341 1.00 40.11 H new ATOM 0 HD2 ARG A1741 1.744 14.103 -4.060 1.00 4.50 H new ATOM 0 HD3 ARG A1741 2.662 15.237 -5.031 1.00 4.50 H new ATOM 0 HE ARG A1741 0.487 13.483 -6.127 1.00 20.45 H new ATOM 0 HH11 ARG A1741 2.300 16.517 -6.090 1.00 33.45 H new ATOM 0 HH12 ARG A1741 1.294 17.261 -7.338 1.00 33.45 H new ATOM 0 HH21 ARG A1741 -0.802 14.456 -7.699 1.00 0.01 H new ATOM 0 HH22 ARG A1741 -0.452 16.100 -8.243 1.00 0.01 H new ATOM 1193 N ILE A1742 1.350 9.179 -3.428 1.00 0.31 N ATOM 1194 CA ILE A1742 0.462 8.051 -3.377 1.00 72.32 C ATOM 1195 C ILE A1742 -0.756 8.415 -2.538 1.00 2.23 C ATOM 1196 O ILE A1742 -1.885 8.191 -2.948 1.00 1.55 O ATOM 1197 CB ILE A1742 1.165 6.836 -2.735 1.00 2.34 C ATOM 1198 CG1 ILE A1742 2.472 6.523 -3.464 1.00 71.24 C ATOM 1199 CG2 ILE A1742 0.248 5.621 -2.740 1.00 73.12 C ATOM 1200 CD1 ILE A1742 3.290 5.438 -2.803 1.00 64.51 C ATOM 0 H ILE A1742 2.229 9.035 -2.931 1.00 0.31 H new ATOM 0 HA ILE A1742 0.163 7.792 -4.393 1.00 72.32 H new ATOM 0 HB ILE A1742 1.399 7.085 -1.700 1.00 2.34 H new ATOM 0 HG12 ILE A1742 2.245 6.222 -4.487 1.00 71.24 H new ATOM 0 HG13 ILE A1742 3.071 7.432 -3.524 1.00 71.24 H new ATOM 0 HG21 ILE A1742 0.762 4.775 -2.283 1.00 73.12 H new ATOM 0 HG22 ILE A1742 -0.656 5.845 -2.174 1.00 73.12 H new ATOM 0 HG23 ILE A1742 -0.020 5.371 -3.767 1.00 73.12 H new ATOM 0 HD11 ILE A1742 4.202 5.270 -3.376 1.00 64.51 H new ATOM 0 HD12 ILE A1742 3.549 5.744 -1.789 1.00 64.51 H new ATOM 0 HD13 ILE A1742 2.710 4.516 -2.767 1.00 64.51 H new ATOM 1212 N LYS A1743 -0.503 9.051 -1.406 1.00 54.23 N ATOM 1213 CA LYS A1743 -1.541 9.403 -0.466 1.00 71.15 C ATOM 1214 C LYS A1743 -2.615 10.322 -1.096 1.00 72.23 C ATOM 1215 O LYS A1743 -3.775 9.936 -1.126 1.00 74.21 O ATOM 1216 CB LYS A1743 -0.928 9.989 0.822 1.00 64.24 C ATOM 1217 CG LYS A1743 -1.931 10.611 1.773 1.00 43.11 C ATOM 1218 CD LYS A1743 -1.236 11.224 2.968 1.00 33.13 C ATOM 1219 CE LYS A1743 -2.182 12.102 3.768 1.00 62.11 C ATOM 1220 NZ LYS A1743 -3.301 11.349 4.338 1.00 75.40 N ATOM 0 H LYS A1743 0.433 9.336 -1.117 1.00 54.23 H new ATOM 0 HA LYS A1743 -2.069 8.491 -0.188 1.00 71.15 H new ATOM 0 HB2 LYS A1743 -0.393 9.197 1.346 1.00 64.24 H new ATOM 0 HB3 LYS A1743 -0.191 10.744 0.547 1.00 64.24 H new ATOM 0 HG2 LYS A1743 -2.507 11.375 1.251 1.00 43.11 H new ATOM 0 HG3 LYS A1743 -2.638 9.853 2.109 1.00 43.11 H new ATOM 0 HD2 LYS A1743 -0.843 10.434 3.607 1.00 33.13 H new ATOM 0 HD3 LYS A1743 -0.385 11.816 2.632 1.00 33.13 H new ATOM 0 HE2 LYS A1743 -1.629 12.588 4.572 1.00 62.11 H new ATOM 0 HE3 LYS A1743 -2.570 12.892 3.125 1.00 62.11 H new ATOM 0 HZ1 LYS A1743 -3.551 11.747 5.266 1.00 75.40 H new ATOM 0 HZ2 LYS A1743 -4.121 11.412 3.702 1.00 75.40 H new ATOM 0 HZ3 LYS A1743 -3.027 10.352 4.452 1.00 75.40 H new ATOM 1234 N PRO A1744 -2.255 11.529 -1.650 1.00 71.24 N ATOM 1235 CA PRO A1744 -3.240 12.414 -2.287 1.00 32.23 C ATOM 1236 C PRO A1744 -3.975 11.740 -3.461 1.00 12.42 C ATOM 1237 O PRO A1744 -5.166 11.987 -3.686 1.00 75.50 O ATOM 1238 CB PRO A1744 -2.412 13.618 -2.778 1.00 65.24 C ATOM 1239 CG PRO A1744 -0.995 13.153 -2.750 1.00 51.13 C ATOM 1240 CD PRO A1744 -0.917 12.152 -1.640 1.00 52.35 C ATOM 0 HA PRO A1744 -4.029 12.693 -1.588 1.00 32.23 H new ATOM 0 HB2 PRO A1744 -2.709 13.917 -3.783 1.00 65.24 H new ATOM 0 HB3 PRO A1744 -2.555 14.484 -2.132 1.00 65.24 H new ATOM 0 HG2 PRO A1744 -0.712 12.704 -3.702 1.00 51.13 H new ATOM 0 HG3 PRO A1744 -0.314 13.985 -2.575 1.00 51.13 H new ATOM 0 HD2 PRO A1744 -0.130 11.418 -1.815 1.00 52.35 H new ATOM 0 HD3 PRO A1744 -0.702 12.628 -0.683 1.00 52.35 H new ATOM 1248 N ALA A1745 -3.274 10.849 -4.165 1.00 55.50 N ATOM 1249 CA ALA A1745 -3.847 10.166 -5.302 1.00 32.32 C ATOM 1250 C ALA A1745 -4.905 9.191 -4.844 1.00 15.41 C ATOM 1251 O ALA A1745 -6.031 9.182 -5.353 1.00 0.35 O ATOM 1252 CB ALA A1745 -2.771 9.435 -6.055 1.00 71.55 C ATOM 0 H ALA A1745 -2.309 10.591 -3.959 1.00 55.50 H new ATOM 0 HA ALA A1745 -4.307 10.903 -5.960 1.00 32.32 H new ATOM 0 HB1 ALA A1745 -3.210 8.922 -6.911 1.00 71.55 H new ATOM 0 HB2 ALA A1745 -2.023 10.147 -6.403 1.00 71.55 H new ATOM 0 HB3 ALA A1745 -2.299 8.705 -5.398 1.00 71.55 H new ATOM 1258 N VAL A1746 -4.539 8.391 -3.866 1.00 3.25 N ATOM 1259 CA VAL A1746 -5.419 7.405 -3.305 1.00 24.33 C ATOM 1260 C VAL A1746 -6.632 8.071 -2.650 1.00 70.34 C ATOM 1261 O VAL A1746 -7.755 7.660 -2.893 1.00 63.33 O ATOM 1262 CB VAL A1746 -4.653 6.449 -2.325 1.00 23.33 C ATOM 1263 CG1 VAL A1746 -5.586 5.513 -1.595 1.00 53.21 C ATOM 1264 CG2 VAL A1746 -3.652 5.620 -3.102 1.00 12.43 C ATOM 0 H VAL A1746 -3.613 8.412 -3.439 1.00 3.25 H new ATOM 0 HA VAL A1746 -5.796 6.779 -4.114 1.00 24.33 H new ATOM 0 HB VAL A1746 -4.152 7.077 -1.588 1.00 23.33 H new ATOM 0 HG11 VAL A1746 -5.010 4.871 -0.929 1.00 53.21 H new ATOM 0 HG12 VAL A1746 -6.301 6.093 -1.011 1.00 53.21 H new ATOM 0 HG13 VAL A1746 -6.122 4.898 -2.317 1.00 53.21 H new ATOM 0 HG21 VAL A1746 -3.121 4.957 -2.419 1.00 12.43 H new ATOM 0 HG22 VAL A1746 -4.175 5.026 -3.851 1.00 12.43 H new ATOM 0 HG23 VAL A1746 -2.938 6.280 -3.595 1.00 12.43 H new ATOM 1274 N ILE A1747 -6.407 9.149 -1.901 1.00 15.15 N ATOM 1275 CA ILE A1747 -7.503 9.879 -1.246 1.00 61.13 C ATOM 1276 C ILE A1747 -8.576 10.309 -2.263 1.00 72.24 C ATOM 1277 O ILE A1747 -9.783 10.090 -2.040 1.00 40.13 O ATOM 1278 CB ILE A1747 -6.993 11.126 -0.461 1.00 52.14 C ATOM 1279 CG1 ILE A1747 -6.090 10.695 0.694 1.00 63.11 C ATOM 1280 CG2 ILE A1747 -8.165 11.927 0.079 1.00 2.12 C ATOM 1281 CD1 ILE A1747 -5.464 11.848 1.447 1.00 22.43 C ATOM 0 H ILE A1747 -5.480 9.539 -1.730 1.00 15.15 H new ATOM 0 HA ILE A1747 -7.949 9.187 -0.531 1.00 61.13 H new ATOM 0 HB ILE A1747 -6.421 11.751 -1.146 1.00 52.14 H new ATOM 0 HG12 ILE A1747 -6.672 10.092 1.391 1.00 63.11 H new ATOM 0 HG13 ILE A1747 -5.298 10.056 0.304 1.00 63.11 H new ATOM 0 HG21 ILE A1747 -7.793 12.794 0.624 1.00 2.12 H new ATOM 0 HG22 ILE A1747 -8.790 12.260 -0.749 1.00 2.12 H new ATOM 0 HG23 ILE A1747 -8.754 11.302 0.750 1.00 2.12 H new ATOM 0 HD11 ILE A1747 -4.838 11.461 2.251 1.00 22.43 H new ATOM 0 HD12 ILE A1747 -4.854 12.440 0.765 1.00 22.43 H new ATOM 0 HD13 ILE A1747 -6.249 12.476 1.869 1.00 22.43 H new ATOM 1293 N LYS A1748 -8.134 10.850 -3.400 1.00 53.42 N ATOM 1294 CA LYS A1748 -9.003 11.300 -4.426 1.00 14.44 C ATOM 1295 C LYS A1748 -9.774 10.119 -5.046 1.00 51.42 C ATOM 1296 O LYS A1748 -10.947 10.252 -5.418 1.00 50.51 O ATOM 1297 CB LYS A1748 -8.159 12.067 -5.451 1.00 13.12 C ATOM 1298 CG LYS A1748 -8.378 11.643 -6.873 1.00 22.51 C ATOM 1299 CD LYS A1748 -7.557 12.445 -7.851 1.00 4.34 C ATOM 1300 CE LYS A1748 -7.673 11.856 -9.239 1.00 50.34 C ATOM 1301 NZ LYS A1748 -6.987 12.675 -10.255 1.00 44.23 N ATOM 0 H LYS A1748 -7.145 10.978 -3.612 1.00 53.42 H new ATOM 0 HA LYS A1748 -9.764 11.970 -4.027 1.00 14.44 H new ATOM 0 HB2 LYS A1748 -8.380 13.131 -5.363 1.00 13.12 H new ATOM 0 HB3 LYS A1748 -7.105 11.939 -5.204 1.00 13.12 H new ATOM 0 HG2 LYS A1748 -8.129 10.587 -6.976 1.00 22.51 H new ATOM 0 HG3 LYS A1748 -9.434 11.747 -7.120 1.00 22.51 H new ATOM 0 HD2 LYS A1748 -7.897 13.481 -7.858 1.00 4.34 H new ATOM 0 HD3 LYS A1748 -6.513 12.454 -7.538 1.00 4.34 H new ATOM 0 HE2 LYS A1748 -7.251 10.851 -9.241 1.00 50.34 H new ATOM 0 HE3 LYS A1748 -8.726 11.760 -9.504 1.00 50.34 H new ATOM 0 HZ1 LYS A1748 -7.094 12.231 -11.189 1.00 44.23 H new ATOM 0 HZ2 LYS A1748 -7.405 13.627 -10.274 1.00 44.23 H new ATOM 0 HZ3 LYS A1748 -5.976 12.746 -10.019 1.00 44.23 H new ATOM 1315 N TYR A1749 -9.128 8.970 -5.103 1.00 23.51 N ATOM 1316 CA TYR A1749 -9.726 7.772 -5.651 1.00 24.20 C ATOM 1317 C TYR A1749 -10.913 7.329 -4.783 1.00 2.24 C ATOM 1318 O TYR A1749 -12.009 7.024 -5.289 1.00 11.21 O ATOM 1319 CB TYR A1749 -8.659 6.643 -5.757 1.00 24.25 C ATOM 1320 CG TYR A1749 -9.203 5.270 -6.129 1.00 41.52 C ATOM 1321 CD1 TYR A1749 -9.866 4.509 -5.184 1.00 64.32 C ATOM 1322 CD2 TYR A1749 -9.059 4.742 -7.405 1.00 64.42 C ATOM 1323 CE1 TYR A1749 -10.374 3.296 -5.468 1.00 53.22 C ATOM 1324 CE2 TYR A1749 -9.573 3.489 -7.708 1.00 73.55 C ATOM 1325 CZ TYR A1749 -10.235 2.771 -6.726 1.00 12.10 C ATOM 1326 OH TYR A1749 -10.769 1.533 -7.013 1.00 24.12 O ATOM 0 H TYR A1749 -8.172 8.843 -4.770 1.00 23.51 H new ATOM 0 HA TYR A1749 -10.099 7.984 -6.653 1.00 24.20 H new ATOM 0 HB2 TYR A1749 -7.916 6.935 -6.499 1.00 24.25 H new ATOM 0 HB3 TYR A1749 -8.141 6.564 -4.801 1.00 24.25 H new ATOM 0 HD1 TYR A1749 -9.980 4.901 -4.184 1.00 64.32 H new ATOM 0 HD2 TYR A1749 -8.544 5.310 -8.166 1.00 64.42 H new ATOM 0 HE1 TYR A1749 -10.892 2.736 -4.704 1.00 53.22 H new ATOM 0 HE2 TYR A1749 -9.458 3.078 -8.700 1.00 73.55 H new ATOM 0 HH TYR A1749 -10.800 1.407 -7.984 1.00 24.12 H new ATOM 1336 N LEU A1750 -10.686 7.274 -3.485 1.00 51.35 N ATOM 1337 CA LEU A1750 -11.699 6.829 -2.543 1.00 22.11 C ATOM 1338 C LEU A1750 -12.915 7.733 -2.533 1.00 41.03 C ATOM 1339 O LEU A1750 -14.041 7.253 -2.685 1.00 22.14 O ATOM 1340 CB LEU A1750 -11.142 6.655 -1.123 1.00 12.33 C ATOM 1341 CG LEU A1750 -10.298 5.400 -0.808 1.00 75.44 C ATOM 1342 CD1 LEU A1750 -10.982 4.121 -1.208 1.00 23.21 C ATOM 1343 CD2 LEU A1750 -8.942 5.447 -1.396 1.00 34.14 C ATOM 0 H LEU A1750 -9.799 7.535 -3.054 1.00 51.35 H new ATOM 0 HA LEU A1750 -12.019 5.848 -2.895 1.00 22.11 H new ATOM 0 HB2 LEU A1750 -10.532 7.529 -0.898 1.00 12.33 H new ATOM 0 HB3 LEU A1750 -11.985 6.668 -0.433 1.00 12.33 H new ATOM 0 HG LEU A1750 -10.193 5.407 0.277 1.00 75.44 H new ATOM 0 HD11 LEU A1750 -10.342 3.274 -0.962 1.00 23.21 H new ATOM 0 HD12 LEU A1750 -11.926 4.030 -0.671 1.00 23.21 H new ATOM 0 HD13 LEU A1750 -11.174 4.131 -2.281 1.00 23.21 H new ATOM 0 HD21 LEU A1750 -8.402 4.536 -1.138 1.00 34.14 H new ATOM 0 HD22 LEU A1750 -9.018 5.528 -2.480 1.00 34.14 H new ATOM 0 HD23 LEU A1750 -8.405 6.311 -1.004 1.00 34.14 H new ATOM 1355 N ILE A1751 -12.696 9.033 -2.404 1.00 45.32 N ATOM 1356 CA ILE A1751 -13.802 10.002 -2.353 1.00 72.04 C ATOM 1357 C ILE A1751 -14.623 10.007 -3.630 1.00 50.21 C ATOM 1358 O ILE A1751 -15.841 10.173 -3.593 1.00 33.21 O ATOM 1359 CB ILE A1751 -13.325 11.432 -2.016 1.00 5.13 C ATOM 1360 CG1 ILE A1751 -12.238 11.911 -2.990 1.00 31.43 C ATOM 1361 CG2 ILE A1751 -12.865 11.518 -0.584 1.00 34.43 C ATOM 1362 CD1 ILE A1751 -12.726 12.859 -4.063 1.00 15.44 C ATOM 0 H ILE A1751 -11.768 9.449 -2.332 1.00 45.32 H new ATOM 0 HA ILE A1751 -14.445 9.667 -1.539 1.00 72.04 H new ATOM 0 HB ILE A1751 -14.175 12.104 -2.135 1.00 5.13 H new ATOM 0 HG12 ILE A1751 -11.450 12.403 -2.420 1.00 31.43 H new ATOM 0 HG13 ILE A1751 -11.789 11.041 -3.469 1.00 31.43 H new ATOM 0 HG21 ILE A1751 -12.533 12.534 -0.369 1.00 34.43 H new ATOM 0 HG22 ILE A1751 -13.690 11.257 0.079 1.00 34.43 H new ATOM 0 HG23 ILE A1751 -12.039 10.825 -0.425 1.00 34.43 H new ATOM 0 HD11 ILE A1751 -11.891 13.144 -4.704 1.00 15.44 H new ATOM 0 HD12 ILE A1751 -13.492 12.367 -4.662 1.00 15.44 H new ATOM 0 HD13 ILE A1751 -13.147 13.750 -3.597 1.00 15.44 H new ATOM 1374 N SER A1752 -13.960 9.786 -4.746 1.00 31.22 N ATOM 1375 CA SER A1752 -14.616 9.737 -6.028 1.00 45.05 C ATOM 1376 C SER A1752 -15.569 8.547 -6.110 1.00 53.25 C ATOM 1377 O SER A1752 -16.603 8.608 -6.762 1.00 74.03 O ATOM 1378 CB SER A1752 -13.565 9.667 -7.115 1.00 64.21 C ATOM 1379 OG SER A1752 -12.831 10.885 -7.197 1.00 43.51 O ATOM 0 H SER A1752 -12.952 9.636 -4.786 1.00 31.22 H new ATOM 0 HA SER A1752 -15.214 10.638 -6.162 1.00 45.05 H new ATOM 0 HB2 SER A1752 -12.883 8.841 -6.913 1.00 64.21 H new ATOM 0 HB3 SER A1752 -14.042 9.461 -8.073 1.00 64.21 H new ATOM 0 HG SER A1752 -12.065 10.847 -6.587 1.00 43.51 H new ATOM 1385 N HIS A1753 -15.242 7.495 -5.394 1.00 4.21 N ATOM 1386 CA HIS A1753 -16.042 6.291 -5.392 1.00 15.04 C ATOM 1387 C HIS A1753 -16.927 6.213 -4.159 1.00 1.31 C ATOM 1388 O HIS A1753 -17.483 5.155 -3.859 1.00 61.43 O ATOM 1389 CB HIS A1753 -15.162 5.061 -5.469 1.00 3.44 C ATOM 1390 CG HIS A1753 -14.470 4.874 -6.780 1.00 25.32 C ATOM 1391 ND1 HIS A1753 -13.128 5.080 -6.961 1.00 72.30 N ATOM 1392 CD2 HIS A1753 -14.935 4.423 -7.958 1.00 61.22 C ATOM 1393 CE1 HIS A1753 -12.803 4.743 -8.191 1.00 32.42 C ATOM 1394 NE2 HIS A1753 -13.876 4.344 -8.811 1.00 41.02 N ATOM 0 H HIS A1753 -14.416 7.450 -4.798 1.00 4.21 H new ATOM 0 HA HIS A1753 -16.683 6.327 -6.273 1.00 15.04 H new ATOM 0 HB2 HIS A1753 -14.411 5.118 -4.681 1.00 3.44 H new ATOM 0 HB3 HIS A1753 -15.772 4.181 -5.266 1.00 3.44 H new ATOM 0 HD1 HIS A1753 -12.484 5.437 -6.256 1.00 72.30 H new ATOM 0 HD2 HIS A1753 -15.960 4.170 -8.186 1.00 61.22 H new ATOM 0 HE1 HIS A1753 -11.811 4.790 -8.615 1.00 32.42 H new ATOM 1403 N SER A1754 -17.024 7.333 -3.441 1.00 64.42 N ATOM 1404 CA SER A1754 -17.881 7.476 -2.268 1.00 13.01 C ATOM 1405 C SER A1754 -17.408 6.559 -1.105 1.00 42.14 C ATOM 1406 O SER A1754 -18.192 6.181 -0.206 1.00 72.14 O ATOM 1407 CB SER A1754 -19.354 7.196 -2.666 1.00 1.30 C ATOM 1408 OG SER A1754 -20.277 7.604 -1.664 1.00 41.45 O ATOM 0 H SER A1754 -16.500 8.179 -3.664 1.00 64.42 H new ATOM 0 HA SER A1754 -17.812 8.500 -1.900 1.00 13.01 H new ATOM 0 HB2 SER A1754 -19.580 7.716 -3.597 1.00 1.30 H new ATOM 0 HB3 SER A1754 -19.479 6.130 -2.858 1.00 1.30 H new ATOM 0 HG SER A1754 -19.947 7.327 -0.784 1.00 41.45 H new ATOM 1414 N PHE A1755 -16.118 6.250 -1.081 1.00 61.11 N ATOM 1415 CA PHE A1755 -15.583 5.474 -0.007 1.00 4.54 C ATOM 1416 C PHE A1755 -15.378 6.340 1.180 1.00 21.45 C ATOM 1417 O PHE A1755 -15.269 7.559 1.064 1.00 53.31 O ATOM 1418 CB PHE A1755 -14.285 4.789 -0.351 1.00 64.52 C ATOM 1419 CG PHE A1755 -14.429 3.541 -1.142 1.00 74.12 C ATOM 1420 CD1 PHE A1755 -14.824 2.375 -0.521 1.00 33.11 C ATOM 1421 CD2 PHE A1755 -14.152 3.521 -2.486 1.00 51.20 C ATOM 1422 CE1 PHE A1755 -14.942 1.208 -1.227 1.00 50.21 C ATOM 1423 CE2 PHE A1755 -14.266 2.356 -3.206 1.00 44.23 C ATOM 1424 CZ PHE A1755 -14.663 1.195 -2.573 1.00 70.24 C ATOM 0 H PHE A1755 -15.442 6.528 -1.792 1.00 61.11 H new ATOM 0 HA PHE A1755 -16.311 4.690 0.202 1.00 4.54 H new ATOM 0 HB2 PHE A1755 -13.660 5.486 -0.909 1.00 64.52 H new ATOM 0 HB3 PHE A1755 -13.757 4.557 0.574 1.00 64.52 H new ATOM 0 HD1 PHE A1755 -15.043 2.382 0.536 1.00 33.11 H new ATOM 0 HD2 PHE A1755 -13.842 4.429 -2.982 1.00 51.20 H new ATOM 0 HE1 PHE A1755 -15.253 0.302 -0.729 1.00 50.21 H new ATOM 0 HE2 PHE A1755 -14.046 2.349 -4.263 1.00 44.23 H new ATOM 0 HZ PHE A1755 -14.754 0.277 -3.135 1.00 70.24 H new ATOM 1434 N ARG A1756 -15.316 5.730 2.302 1.00 52.24 N ATOM 1435 CA ARG A1756 -15.165 6.434 3.523 1.00 23.53 C ATOM 1436 C ARG A1756 -13.998 5.886 4.258 1.00 20.52 C ATOM 1437 O ARG A1756 -13.978 4.749 4.619 1.00 24.22 O ATOM 1438 CB ARG A1756 -16.471 6.465 4.368 1.00 0.30 C ATOM 1439 CG ARG A1756 -17.307 5.172 4.463 1.00 51.24 C ATOM 1440 CD ARG A1756 -17.963 4.800 3.137 1.00 71.11 C ATOM 1441 NE ARG A1756 -18.948 3.730 3.240 1.00 74.44 N ATOM 1442 CZ ARG A1756 -19.969 3.563 2.391 1.00 52.32 C ATOM 1443 NH1 ARG A1756 -20.131 4.402 1.357 1.00 12.23 N ATOM 1444 NH2 ARG A1756 -20.800 2.546 2.550 1.00 0.03 N ATOM 0 H ARG A1756 -15.369 4.716 2.403 1.00 52.24 H new ATOM 0 HA ARG A1756 -14.967 7.483 3.303 1.00 23.53 H new ATOM 0 HB2 ARG A1756 -16.205 6.765 5.382 1.00 0.30 H new ATOM 0 HB3 ARG A1756 -17.112 7.247 3.962 1.00 0.30 H new ATOM 0 HG2 ARG A1756 -16.667 4.353 4.790 1.00 51.24 H new ATOM 0 HG3 ARG A1756 -18.078 5.297 5.223 1.00 51.24 H new ATOM 0 HD2 ARG A1756 -18.446 5.685 2.722 1.00 71.11 H new ATOM 0 HD3 ARG A1756 -17.188 4.499 2.432 1.00 71.11 H new ATOM 0 HE ARG A1756 -18.853 3.066 4.008 1.00 74.44 H new ATOM 0 HH11 ARG A1756 -19.475 5.170 1.216 1.00 12.23 H new ATOM 0 HH12 ARG A1756 -20.910 4.272 0.712 1.00 12.23 H new ATOM 0 HH21 ARG A1756 -20.662 1.890 3.319 1.00 0.03 H new ATOM 0 HH22 ARG A1756 -21.579 2.418 1.904 1.00 0.03 H new ATOM 1458 N PHE A1757 -13.019 6.695 4.442 1.00 1.03 N ATOM 1459 CA PHE A1757 -11.766 6.269 5.007 1.00 44.44 C ATOM 1460 C PHE A1757 -11.309 7.215 6.089 1.00 5.13 C ATOM 1461 O PHE A1757 -11.787 8.346 6.186 1.00 31.11 O ATOM 1462 CB PHE A1757 -10.713 6.203 3.887 1.00 25.30 C ATOM 1463 CG PHE A1757 -10.587 7.495 3.133 1.00 31.30 C ATOM 1464 CD1 PHE A1757 -11.444 7.774 2.080 1.00 52.14 C ATOM 1465 CD2 PHE A1757 -9.647 8.441 3.499 1.00 61.34 C ATOM 1466 CE1 PHE A1757 -11.372 8.961 1.413 1.00 63.41 C ATOM 1467 CE2 PHE A1757 -9.565 9.637 2.821 1.00 12.42 C ATOM 1468 CZ PHE A1757 -10.439 9.894 1.774 1.00 1.41 C ATOM 0 H PHE A1757 -13.054 7.687 4.205 1.00 1.03 H new ATOM 0 HA PHE A1757 -11.896 5.285 5.457 1.00 44.44 H new ATOM 0 HB2 PHE A1757 -9.746 5.943 4.318 1.00 25.30 H new ATOM 0 HB3 PHE A1757 -10.977 5.406 3.192 1.00 25.30 H new ATOM 0 HD1 PHE A1757 -12.179 7.041 1.784 1.00 52.14 H new ATOM 0 HD2 PHE A1757 -8.974 8.241 4.320 1.00 61.34 H new ATOM 0 HE1 PHE A1757 -12.052 9.165 0.599 1.00 63.41 H new ATOM 0 HE2 PHE A1757 -8.824 10.371 3.103 1.00 12.42 H new ATOM 0 HZ PHE A1757 -10.382 10.833 1.243 1.00 1.41 H new ATOM 1478 N SER A1758 -10.388 6.763 6.871 1.00 44.00 N ATOM 1479 CA SER A1758 -9.827 7.535 7.917 1.00 34.21 C ATOM 1480 C SER A1758 -8.357 7.162 8.056 1.00 44.21 C ATOM 1481 O SER A1758 -8.017 5.991 8.268 1.00 71.34 O ATOM 1482 CB SER A1758 -10.589 7.236 9.216 1.00 44.42 C ATOM 1483 OG SER A1758 -10.112 7.998 10.318 1.00 4.54 O ATOM 0 H SER A1758 -9.998 5.824 6.795 1.00 44.00 H new ATOM 0 HA SER A1758 -9.906 8.601 7.702 1.00 34.21 H new ATOM 0 HB2 SER A1758 -11.649 7.443 9.067 1.00 44.42 H new ATOM 0 HB3 SER A1758 -10.502 6.175 9.448 1.00 44.42 H new ATOM 0 HG SER A1758 -10.629 7.773 11.119 1.00 4.54 H new ATOM 1489 N GLU A1759 -7.498 8.122 7.862 1.00 5.12 N ATOM 1490 CA GLU A1759 -6.090 7.914 8.065 1.00 74.21 C ATOM 1491 C GLU A1759 -5.792 7.999 9.533 1.00 13.41 C ATOM 1492 O GLU A1759 -6.376 8.832 10.243 1.00 14.11 O ATOM 1493 CB GLU A1759 -5.257 8.963 7.331 1.00 4.10 C ATOM 1494 CG GLU A1759 -3.756 8.856 7.593 1.00 61.00 C ATOM 1495 CD GLU A1759 -2.976 9.918 6.911 1.00 72.03 C ATOM 1496 OE1 GLU A1759 -3.144 11.109 7.245 1.00 4.21 O ATOM 1497 OE2 GLU A1759 -2.204 9.606 5.992 1.00 53.12 O ATOM 0 H GLU A1759 -7.749 9.064 7.561 1.00 5.12 H new ATOM 0 HA GLU A1759 -5.830 6.932 7.671 1.00 74.21 H new ATOM 0 HB2 GLU A1759 -5.436 8.871 6.260 1.00 4.10 H new ATOM 0 HB3 GLU A1759 -5.598 9.955 7.627 1.00 4.10 H new ATOM 0 HG2 GLU A1759 -3.574 8.911 8.666 1.00 61.00 H new ATOM 0 HG3 GLU A1759 -3.402 7.881 7.259 1.00 61.00 H new ATOM 1504 N ILE A1760 -4.931 7.147 9.992 1.00 43.23 N ATOM 1505 CA ILE A1760 -4.466 7.221 11.340 1.00 32.23 C ATOM 1506 C ILE A1760 -3.418 8.326 11.397 1.00 74.52 C ATOM 1507 O ILE A1760 -3.701 9.437 11.843 1.00 55.40 O ATOM 1508 CB ILE A1760 -3.841 5.866 11.801 1.00 63.23 C ATOM 1509 CG1 ILE A1760 -4.882 4.728 11.768 1.00 51.22 C ATOM 1510 CG2 ILE A1760 -3.181 5.978 13.178 1.00 51.23 C ATOM 1511 CD1 ILE A1760 -6.090 4.949 12.659 1.00 64.40 C ATOM 0 H ILE A1760 -4.532 6.384 9.446 1.00 43.23 H new ATOM 0 HA ILE A1760 -5.300 7.434 12.009 1.00 32.23 H new ATOM 0 HB ILE A1760 -3.054 5.618 11.089 1.00 63.23 H new ATOM 0 HG12 ILE A1760 -5.224 4.596 10.741 1.00 51.22 H new ATOM 0 HG13 ILE A1760 -4.394 3.799 12.064 1.00 51.22 H new ATOM 0 HG21 ILE A1760 -2.760 5.013 13.459 1.00 51.23 H new ATOM 0 HG22 ILE A1760 -2.387 6.724 13.141 1.00 51.23 H new ATOM 0 HG23 ILE A1760 -3.926 6.277 13.915 1.00 51.23 H new ATOM 0 HD11 ILE A1760 -6.767 4.099 12.571 1.00 64.40 H new ATOM 0 HD12 ILE A1760 -5.765 5.049 13.695 1.00 64.40 H new ATOM 0 HD13 ILE A1760 -6.607 5.858 12.352 1.00 64.40 H new ATOM 1523 N LYS A1761 -2.265 8.011 10.834 1.00 71.24 N ATOM 1524 CA LYS A1761 -1.075 8.820 10.753 1.00 41.02 C ATOM 1525 C LYS A1761 -0.210 8.129 9.618 1.00 1.11 C ATOM 1526 O LYS A1761 -0.854 7.536 8.758 1.00 72.10 O ATOM 1527 CB LYS A1761 -0.387 9.017 12.156 1.00 14.32 C ATOM 1528 CG LYS A1761 -1.088 9.962 13.134 1.00 15.31 C ATOM 1529 CD LYS A1761 -0.245 10.183 14.378 1.00 64.24 C ATOM 1530 CE LYS A1761 -0.873 11.189 15.324 1.00 14.15 C ATOM 1531 NZ LYS A1761 0.010 11.475 16.478 1.00 31.35 N ATOM 0 H LYS A1761 -2.133 7.104 10.386 1.00 71.24 H new ATOM 0 HA LYS A1761 -1.262 9.858 10.478 1.00 41.02 H new ATOM 0 HB2 LYS A1761 -0.296 8.040 12.631 1.00 14.32 H new ATOM 0 HB3 LYS A1761 0.625 9.387 11.991 1.00 14.32 H new ATOM 0 HG2 LYS A1761 -1.281 10.918 12.647 1.00 15.31 H new ATOM 0 HG3 LYS A1761 -2.056 9.547 13.415 1.00 15.31 H new ATOM 0 HD2 LYS A1761 -0.110 9.234 14.897 1.00 64.24 H new ATOM 0 HD3 LYS A1761 0.746 10.531 14.086 1.00 64.24 H new ATOM 0 HE2 LYS A1761 -1.082 12.114 14.787 1.00 14.15 H new ATOM 0 HE3 LYS A1761 -1.829 10.806 15.682 1.00 14.15 H new ATOM 0 HZ1 LYS A1761 -0.450 12.166 17.104 1.00 31.35 H new ATOM 0 HZ2 LYS A1761 0.189 10.596 17.004 1.00 31.35 H new ATOM 0 HZ3 LYS A1761 0.912 11.864 16.137 1.00 31.35 H new ATOM 1545 N PRO A1762 1.199 8.082 9.612 1.00 13.01 N ATOM 1546 CA PRO A1762 2.071 7.744 8.432 1.00 25.43 C ATOM 1547 C PRO A1762 1.439 7.161 7.159 1.00 32.30 C ATOM 1548 O PRO A1762 1.664 5.993 6.831 1.00 24.14 O ATOM 1549 CB PRO A1762 3.056 6.736 9.030 1.00 71.34 C ATOM 1550 CG PRO A1762 2.774 6.748 10.488 1.00 63.21 C ATOM 1551 CD PRO A1762 2.088 8.040 10.756 1.00 4.11 C ATOM 0 HA PRO A1762 2.470 8.678 8.035 1.00 25.43 H new ATOM 0 HB2 PRO A1762 2.910 5.742 8.607 1.00 71.34 H new ATOM 0 HB3 PRO A1762 4.088 7.022 8.824 1.00 71.34 H new ATOM 0 HG2 PRO A1762 2.145 5.905 10.772 1.00 63.21 H new ATOM 0 HG3 PRO A1762 3.695 6.667 11.065 1.00 63.21 H new ATOM 0 HD2 PRO A1762 1.550 8.040 11.704 1.00 4.11 H new ATOM 0 HD3 PRO A1762 2.778 8.883 10.781 1.00 4.11 H new ATOM 1559 N GLY A1763 0.637 7.968 6.466 1.00 63.50 N ATOM 1560 CA GLY A1763 0.090 7.576 5.177 1.00 2.44 C ATOM 1561 C GLY A1763 -0.773 6.318 5.229 1.00 22.02 C ATOM 1562 O GLY A1763 -0.923 5.618 4.219 1.00 23.53 O ATOM 0 H GLY A1763 0.354 8.897 6.779 1.00 63.50 H new ATOM 0 HA2 GLY A1763 -0.506 8.398 4.781 1.00 2.44 H new ATOM 0 HA3 GLY A1763 0.911 7.413 4.479 1.00 2.44 H new ATOM 1566 N CYS A1764 -1.313 6.003 6.366 1.00 75.31 N ATOM 1567 CA CYS A1764 -2.111 4.809 6.459 1.00 70.01 C ATOM 1568 C CYS A1764 -3.584 5.140 6.443 1.00 40.45 C ATOM 1569 O CYS A1764 -4.154 5.632 7.427 1.00 1.11 O ATOM 1570 CB CYS A1764 -1.698 3.932 7.651 1.00 41.45 C ATOM 1571 SG CYS A1764 -1.685 4.771 9.251 1.00 11.15 S ATOM 0 H CYS A1764 -1.222 6.540 7.229 1.00 75.31 H new ATOM 0 HA CYS A1764 -1.918 4.204 5.573 1.00 70.01 H new ATOM 0 HB2 CYS A1764 -2.378 3.082 7.709 1.00 41.45 H new ATOM 0 HB3 CYS A1764 -0.702 3.532 7.460 1.00 41.45 H new ATOM 0 HG CYS A1764 -1.066 5.908 9.140 1.00 11.15 H new ATOM 1577 N LEU A1765 -4.188 4.873 5.318 1.00 55.01 N ATOM 1578 CA LEU A1765 -5.561 5.192 5.080 1.00 60.30 C ATOM 1579 C LEU A1765 -6.390 3.967 5.356 1.00 54.11 C ATOM 1580 O LEU A1765 -6.332 2.991 4.607 1.00 74.42 O ATOM 1581 CB LEU A1765 -5.762 5.618 3.610 1.00 40.02 C ATOM 1582 CG LEU A1765 -4.840 6.725 3.075 1.00 53.23 C ATOM 1583 CD1 LEU A1765 -5.133 7.017 1.619 1.00 21.33 C ATOM 1584 CD2 LEU A1765 -4.962 7.986 3.894 1.00 12.43 C ATOM 0 H LEU A1765 -3.728 4.419 4.529 1.00 55.01 H new ATOM 0 HA LEU A1765 -5.862 6.013 5.730 1.00 60.30 H new ATOM 0 HB2 LEU A1765 -5.635 4.737 2.981 1.00 40.02 H new ATOM 0 HB3 LEU A1765 -6.794 5.949 3.491 1.00 40.02 H new ATOM 0 HG LEU A1765 -3.815 6.363 3.158 1.00 53.23 H new ATOM 0 HD11 LEU A1765 -4.467 7.804 1.265 1.00 21.33 H new ATOM 0 HD12 LEU A1765 -4.975 6.115 1.028 1.00 21.33 H new ATOM 0 HD13 LEU A1765 -6.168 7.343 1.514 1.00 21.33 H new ATOM 0 HD21 LEU A1765 -4.297 8.749 3.489 1.00 12.43 H new ATOM 0 HD22 LEU A1765 -5.990 8.345 3.858 1.00 12.43 H new ATOM 0 HD23 LEU A1765 -4.687 7.777 4.928 1.00 12.43 H new ATOM 1596 N LYS A1766 -7.106 3.973 6.435 1.00 24.11 N ATOM 1597 CA LYS A1766 -7.954 2.864 6.734 1.00 54.55 C ATOM 1598 C LYS A1766 -9.301 3.151 6.107 1.00 23.21 C ATOM 1599 O LYS A1766 -10.031 4.036 6.553 1.00 35.43 O ATOM 1600 CB LYS A1766 -8.077 2.672 8.244 1.00 5.31 C ATOM 1601 CG LYS A1766 -8.783 1.393 8.652 1.00 24.11 C ATOM 1602 CD LYS A1766 -8.902 1.295 10.159 1.00 45.14 C ATOM 1603 CE LYS A1766 -9.545 -0.013 10.579 1.00 71.41 C ATOM 1604 NZ LYS A1766 -9.701 -0.101 12.040 1.00 33.00 N ATOM 0 H LYS A1766 -7.121 4.729 7.120 1.00 24.11 H new ATOM 0 HA LYS A1766 -7.540 1.939 6.332 1.00 54.55 H new ATOM 0 HB2 LYS A1766 -7.079 2.679 8.682 1.00 5.31 H new ATOM 0 HB3 LYS A1766 -8.616 3.521 8.664 1.00 5.31 H new ATOM 0 HG2 LYS A1766 -9.776 1.362 8.203 1.00 24.11 H new ATOM 0 HG3 LYS A1766 -8.233 0.533 8.270 1.00 24.11 H new ATOM 0 HD2 LYS A1766 -7.913 1.377 10.610 1.00 45.14 H new ATOM 0 HD3 LYS A1766 -9.494 2.130 10.534 1.00 45.14 H new ATOM 0 HE2 LYS A1766 -10.521 -0.108 10.103 1.00 71.41 H new ATOM 0 HE3 LYS A1766 -8.937 -0.846 10.228 1.00 71.41 H new ATOM 0 HZ1 LYS A1766 -10.144 -1.009 12.288 1.00 33.00 H new ATOM 0 HZ2 LYS A1766 -8.767 -0.036 12.493 1.00 33.00 H new ATOM 0 HZ3 LYS A1766 -10.302 0.680 12.373 1.00 33.00 H new ATOM 1618 N VAL A1767 -9.604 2.443 5.071 1.00 63.53 N ATOM 1619 CA VAL A1767 -10.800 2.663 4.311 1.00 70.03 C ATOM 1620 C VAL A1767 -11.900 1.762 4.811 1.00 21.40 C ATOM 1621 O VAL A1767 -11.673 0.582 5.035 1.00 65.10 O ATOM 1622 CB VAL A1767 -10.561 2.359 2.805 1.00 54.44 C ATOM 1623 CG1 VAL A1767 -11.794 2.681 1.970 1.00 31.13 C ATOM 1624 CG2 VAL A1767 -9.335 3.096 2.277 1.00 42.54 C ATOM 0 H VAL A1767 -9.022 1.683 4.719 1.00 63.53 H new ATOM 0 HA VAL A1767 -11.085 3.708 4.429 1.00 70.03 H new ATOM 0 HB VAL A1767 -10.370 1.290 2.716 1.00 54.44 H new ATOM 0 HG11 VAL A1767 -11.593 2.457 0.922 1.00 31.13 H new ATOM 0 HG12 VAL A1767 -12.634 2.079 2.315 1.00 31.13 H new ATOM 0 HG13 VAL A1767 -12.038 3.738 2.074 1.00 31.13 H new ATOM 0 HG21 VAL A1767 -9.196 2.862 1.222 1.00 42.54 H new ATOM 0 HG22 VAL A1767 -9.478 4.170 2.395 1.00 42.54 H new ATOM 0 HG23 VAL A1767 -8.454 2.784 2.837 1.00 42.54 H new ATOM 1634 N MET A1768 -13.063 2.317 5.015 1.00 71.25 N ATOM 1635 CA MET A1768 -14.221 1.551 5.362 1.00 24.34 C ATOM 1636 C MET A1768 -14.892 1.235 4.045 1.00 20.43 C ATOM 1637 O MET A1768 -15.016 2.122 3.173 1.00 32.11 O ATOM 1638 CB MET A1768 -15.214 2.347 6.236 1.00 31.04 C ATOM 1639 CG MET A1768 -14.719 2.943 7.568 1.00 71.04 C ATOM 1640 SD MET A1768 -14.135 1.739 8.793 1.00 63.22 S ATOM 1641 CE MET A1768 -12.426 1.560 8.312 1.00 42.40 C ATOM 0 H MET A1768 -13.232 3.320 4.944 1.00 71.25 H new ATOM 0 HA MET A1768 -13.930 0.670 5.935 1.00 24.34 H new ATOM 0 HB2 MET A1768 -15.602 3.167 5.631 1.00 31.04 H new ATOM 0 HB3 MET A1768 -16.055 1.691 6.460 1.00 31.04 H new ATOM 0 HG2 MET A1768 -13.909 3.641 7.355 1.00 71.04 H new ATOM 0 HG3 MET A1768 -15.530 3.522 8.011 1.00 71.04 H new ATOM 0 HE1 MET A1768 -11.876 1.055 9.106 1.00 42.40 H new ATOM 0 HE2 MET A1768 -12.365 0.971 7.397 1.00 42.40 H new ATOM 0 HE3 MET A1768 -11.992 2.545 8.139 1.00 42.40 H new ATOM 1651 N LEU A1769 -15.303 0.022 3.885 1.00 14.12 N ATOM 1652 CA LEU A1769 -15.896 -0.424 2.649 1.00 62.44 C ATOM 1653 C LEU A1769 -17.360 -0.004 2.567 1.00 14.44 C ATOM 1654 O LEU A1769 -17.850 0.724 3.434 1.00 64.23 O ATOM 1655 CB LEU A1769 -15.726 -1.943 2.487 1.00 63.01 C ATOM 1656 CG LEU A1769 -14.273 -2.449 2.419 1.00 55.44 C ATOM 1657 CD1 LEU A1769 -14.235 -3.953 2.278 1.00 63.35 C ATOM 1658 CD2 LEU A1769 -13.523 -1.797 1.269 1.00 31.40 C ATOM 0 H LEU A1769 -15.241 -0.698 4.605 1.00 14.12 H new ATOM 0 HA LEU A1769 -15.376 0.055 1.820 1.00 62.44 H new ATOM 0 HB2 LEU A1769 -16.225 -2.437 3.321 1.00 63.01 H new ATOM 0 HB3 LEU A1769 -16.242 -2.253 1.578 1.00 63.01 H new ATOM 0 HG LEU A1769 -13.781 -2.174 3.352 1.00 55.44 H new ATOM 0 HD11 LEU A1769 -13.199 -4.288 2.232 1.00 63.35 H new ATOM 0 HD12 LEU A1769 -14.727 -4.411 3.136 1.00 63.35 H new ATOM 0 HD13 LEU A1769 -14.752 -4.246 1.364 1.00 63.35 H new ATOM 0 HD21 LEU A1769 -12.500 -2.171 1.243 1.00 31.40 H new ATOM 0 HD22 LEU A1769 -14.020 -2.035 0.329 1.00 31.40 H new ATOM 0 HD23 LEU A1769 -13.510 -0.716 1.409 1.00 31.40 H new ATOM 1670 N LYS A1770 -18.039 -0.443 1.535 1.00 44.30 N ATOM 1671 CA LYS A1770 -19.416 -0.066 1.294 1.00 4.13 C ATOM 1672 C LYS A1770 -20.358 -0.754 2.266 1.00 35.53 C ATOM 1673 O LYS A1770 -20.845 -1.841 1.965 1.00 3.54 O ATOM 1674 CB LYS A1770 -19.813 -0.364 -0.156 1.00 34.24 C ATOM 1675 CG LYS A1770 -19.024 0.407 -1.211 1.00 1.42 C ATOM 1676 CD LYS A1770 -19.243 1.908 -1.094 1.00 41.41 C ATOM 1677 CE LYS A1770 -18.573 2.672 -2.233 1.00 3.34 C ATOM 1678 NZ LYS A1770 -19.171 2.360 -3.558 1.00 72.34 N ATOM 0 H LYS A1770 -17.653 -1.075 0.834 1.00 44.30 H new ATOM 0 HA LYS A1770 -19.501 1.008 1.459 1.00 4.13 H new ATOM 0 HB2 LYS A1770 -19.689 -1.431 -0.339 1.00 34.24 H new ATOM 0 HB3 LYS A1770 -20.872 -0.140 -0.280 1.00 34.24 H new ATOM 0 HG2 LYS A1770 -17.962 0.185 -1.105 1.00 1.42 H new ATOM 0 HG3 LYS A1770 -19.322 0.072 -2.205 1.00 1.42 H new ATOM 0 HD2 LYS A1770 -20.312 2.120 -1.094 1.00 41.41 H new ATOM 0 HD3 LYS A1770 -18.849 2.259 -0.140 1.00 41.41 H new ATOM 0 HE2 LYS A1770 -18.654 3.743 -2.045 1.00 3.34 H new ATOM 0 HE3 LYS A1770 -17.510 2.431 -2.252 1.00 3.34 H new ATOM 0 HZ1 LYS A1770 -18.841 3.053 -4.260 1.00 72.34 H new ATOM 0 HZ2 LYS A1770 -18.883 1.405 -3.853 1.00 72.34 H new ATOM 0 HZ3 LYS A1770 -20.208 2.403 -3.490 1.00 72.34 H new