USER MOD reduce.3.24.130724 H: found=0, std=0, add=737, rem=0, adj=18 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: A1689 ASN : amide:sc= -1.57! K(o=0.74!,f=-5.9) USER MOD Set 1.2: A1712 LYS NZ :NH3+ 177:sc= 2.32 (180deg=1.18) USER MOD Single : A1680 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1682 ASN : amide:sc= 0.581 K(o=0.58,f=-1) USER MOD Single : A1684 SER OG : rot 180:sc= 0 USER MOD Single : A1688 GLN : amide:sc=-0.00507 K(o=-0.0051,f=-1.1) USER MOD Single : A1694 HIS : no HE2:sc= 0.0647 K(o=0.065,f=-4.8!) USER MOD Single : A1697 HIS : no HD1:sc= -0.619 K(o=-0.62,f=-4.6!) USER MOD Single : A1704 HIS : no HD1:sc= -0.0305 K(o=-0.031,f=-1.3) USER MOD Single : A1706 MET CE :methyl 171:sc= -0.89 (180deg=-0.937) USER MOD Single : A1711 LYS NZ :NH3+ -159:sc= 1.06 (180deg=0.755) USER MOD Single : A1713 THR OG1 : rot 83:sc= 1.23 USER MOD Single : A1717 LYS NZ :NH3+ 154:sc= 0 (180deg=-0.483) USER MOD Single : A1718 GLN : amide:sc= -1.05 K(o=-1.1,f=-0.26) USER MOD Single : A1719 ASN : amide:sc= -0.236 X(o=-0.24,f=-0.59) USER MOD Single : A1722 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1724 TYR OH : rot 180:sc= 0 USER MOD Single : A1726 SER OG : rot 180:sc= 0 USER MOD Single : A1729 THR OG1 : rot -6:sc= 0.275 USER MOD Single : A1743 LYS NZ :NH3+ 180:sc= 0.968 (180deg=0.968) USER MOD Single : A1748 LYS NZ :NH3+ 170:sc=-0.00312 (180deg=-0.112) USER MOD Single : A1749 TYR OH : rot 180:sc= 0 USER MOD Single : A1752 SER OG : rot 87:sc= 1.23 USER MOD Single : A1753 HIS : no HE2:sc= -0.0315 K(o=-0.031,f=-2.1!) USER MOD Single : A1754 SER OG : rot 180:sc= 0 USER MOD Single : A1758 SER OG : rot 180:sc= 0 USER MOD Single : A1761 LYS NZ :NH3+ -155:sc= 1.15 (180deg=0.568) USER MOD Single : A1764 CYS SG : rot -24:sc= -0.184 USER MOD Single : A1766 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1768 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A1770 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 126 N ALA A1674 10.803 -0.429 -4.874 1.00 71.12 N ATOM 127 CA ALA A1674 9.707 -0.605 -3.934 1.00 45.22 C ATOM 128 C ALA A1674 8.709 -1.645 -4.420 1.00 61.14 C ATOM 129 O ALA A1674 8.050 -2.298 -3.619 1.00 22.12 O ATOM 130 CB ALA A1674 9.020 0.710 -3.656 1.00 34.11 C ATOM 0 HA ALA A1674 10.134 -0.973 -3.001 1.00 45.22 H new ATOM 0 HB1 ALA A1674 8.204 0.552 -2.951 1.00 34.11 H new ATOM 0 HB2 ALA A1674 9.737 1.412 -3.231 1.00 34.11 H new ATOM 0 HB3 ALA A1674 8.622 1.116 -4.586 1.00 34.11 H new ATOM 136 N ILE A1675 8.633 -1.825 -5.731 1.00 5.13 N ATOM 137 CA ILE A1675 7.689 -2.781 -6.335 1.00 14.44 C ATOM 138 C ILE A1675 8.005 -4.215 -5.873 1.00 50.52 C ATOM 139 O ILE A1675 7.118 -4.959 -5.450 1.00 41.10 O ATOM 140 CB ILE A1675 7.645 -2.705 -7.917 1.00 74.42 C ATOM 141 CG1 ILE A1675 7.049 -1.365 -8.438 1.00 33.21 C ATOM 142 CG2 ILE A1675 6.857 -3.875 -8.511 1.00 43.42 C ATOM 143 CD1 ILE A1675 7.898 -0.126 -8.210 1.00 0.23 C ATOM 0 H ILE A1675 9.211 -1.325 -6.406 1.00 5.13 H new ATOM 0 HA ILE A1675 6.697 -2.497 -5.985 1.00 14.44 H new ATOM 0 HB ILE A1675 8.683 -2.763 -8.246 1.00 74.42 H new ATOM 0 HG12 ILE A1675 6.865 -1.464 -9.508 1.00 33.21 H new ATOM 0 HG13 ILE A1675 6.081 -1.211 -7.961 1.00 33.21 H new ATOM 0 HG21 ILE A1675 6.846 -3.792 -9.598 1.00 43.42 H new ATOM 0 HG22 ILE A1675 7.329 -4.815 -8.223 1.00 43.42 H new ATOM 0 HG23 ILE A1675 5.834 -3.853 -8.136 1.00 43.42 H new ATOM 0 HD11 ILE A1675 7.384 0.747 -8.613 1.00 0.23 H new ATOM 0 HD12 ILE A1675 8.062 0.011 -7.141 1.00 0.23 H new ATOM 0 HD13 ILE A1675 8.858 -0.245 -8.712 1.00 0.23 H new ATOM 155 N GLU A1676 9.276 -4.564 -5.907 1.00 1.11 N ATOM 156 CA GLU A1676 9.745 -5.880 -5.472 1.00 0.11 C ATOM 157 C GLU A1676 9.518 -6.079 -3.970 1.00 62.52 C ATOM 158 O GLU A1676 9.295 -7.204 -3.502 1.00 43.05 O ATOM 159 CB GLU A1676 11.221 -6.048 -5.840 1.00 51.52 C ATOM 160 CG GLU A1676 12.116 -4.974 -5.264 1.00 64.42 C ATOM 161 CD GLU A1676 13.479 -4.940 -5.892 1.00 3.30 C ATOM 162 OE1 GLU A1676 13.612 -4.364 -6.999 1.00 54.44 O ATOM 163 OE2 GLU A1676 14.441 -5.469 -5.309 1.00 15.04 O ATOM 0 H GLU A1676 10.019 -3.948 -6.236 1.00 1.11 H new ATOM 0 HA GLU A1676 9.168 -6.648 -5.987 1.00 0.11 H new ATOM 0 HB2 GLU A1676 11.565 -7.021 -5.491 1.00 51.52 H new ATOM 0 HB3 GLU A1676 11.318 -6.046 -6.926 1.00 51.52 H new ATOM 0 HG2 GLU A1676 11.638 -4.003 -5.395 1.00 64.42 H new ATOM 0 HG3 GLU A1676 12.221 -5.135 -4.191 1.00 64.42 H new ATOM 170 N ILE A1677 9.534 -4.981 -3.229 1.00 3.54 N ATOM 171 CA ILE A1677 9.320 -5.020 -1.799 1.00 74.13 C ATOM 172 C ILE A1677 7.834 -5.232 -1.535 1.00 20.02 C ATOM 173 O ILE A1677 7.447 -6.035 -0.683 1.00 3.13 O ATOM 174 CB ILE A1677 9.797 -3.712 -1.101 1.00 64.03 C ATOM 175 CG1 ILE A1677 11.264 -3.394 -1.447 1.00 73.43 C ATOM 176 CG2 ILE A1677 9.624 -3.803 0.405 1.00 63.04 C ATOM 177 CD1 ILE A1677 12.264 -4.487 -1.119 1.00 75.31 C ATOM 0 H ILE A1677 9.695 -4.046 -3.604 1.00 3.54 H new ATOM 0 HA ILE A1677 9.907 -5.840 -1.385 1.00 74.13 H new ATOM 0 HB ILE A1677 9.174 -2.900 -1.475 1.00 64.03 H new ATOM 0 HG12 ILE A1677 11.328 -3.175 -2.513 1.00 73.43 H new ATOM 0 HG13 ILE A1677 11.556 -2.487 -0.917 1.00 73.43 H new ATOM 0 HG21 ILE A1677 9.965 -2.876 0.867 1.00 63.04 H new ATOM 0 HG22 ILE A1677 8.572 -3.961 0.641 1.00 63.04 H new ATOM 0 HG23 ILE A1677 10.211 -4.637 0.789 1.00 63.04 H new ATOM 0 HD11 ILE A1677 13.265 -4.161 -1.402 1.00 75.31 H new ATOM 0 HD12 ILE A1677 12.239 -4.694 -0.049 1.00 75.31 H new ATOM 0 HD13 ILE A1677 12.008 -5.392 -1.670 1.00 75.31 H new ATOM 189 N PHE A1678 7.019 -4.540 -2.318 1.00 75.53 N ATOM 190 CA PHE A1678 5.569 -4.634 -2.264 1.00 75.41 C ATOM 191 C PHE A1678 5.088 -6.066 -2.405 1.00 33.23 C ATOM 192 O PHE A1678 4.200 -6.505 -1.668 1.00 13.11 O ATOM 193 CB PHE A1678 4.952 -3.730 -3.352 1.00 51.11 C ATOM 194 CG PHE A1678 3.549 -4.084 -3.792 1.00 25.32 C ATOM 195 CD1 PHE A1678 2.464 -3.856 -2.976 1.00 13.02 C ATOM 196 CD2 PHE A1678 3.336 -4.658 -5.038 1.00 52.21 C ATOM 197 CE1 PHE A1678 1.185 -4.190 -3.389 1.00 51.41 C ATOM 198 CE2 PHE A1678 2.066 -4.994 -5.457 1.00 12.40 C ATOM 199 CZ PHE A1678 0.987 -4.758 -4.631 1.00 62.24 C ATOM 0 H PHE A1678 7.355 -3.884 -3.023 1.00 75.53 H new ATOM 0 HA PHE A1678 5.240 -4.290 -1.284 1.00 75.41 H new ATOM 0 HB2 PHE A1678 4.948 -2.704 -2.984 1.00 51.11 H new ATOM 0 HB3 PHE A1678 5.602 -3.753 -4.227 1.00 51.11 H new ATOM 0 HD1 PHE A1678 2.612 -3.412 -2.003 1.00 13.02 H new ATOM 0 HD2 PHE A1678 4.178 -4.844 -5.689 1.00 52.21 H new ATOM 0 HE1 PHE A1678 0.342 -4.006 -2.739 1.00 51.41 H new ATOM 0 HE2 PHE A1678 1.917 -5.441 -6.429 1.00 12.40 H new ATOM 0 HZ PHE A1678 -0.010 -5.017 -4.955 1.00 62.24 H new ATOM 209 N GLU A1679 5.686 -6.801 -3.315 1.00 51.13 N ATOM 210 CA GLU A1679 5.279 -8.167 -3.565 1.00 35.24 C ATOM 211 C GLU A1679 5.472 -9.059 -2.333 1.00 21.04 C ATOM 212 O GLU A1679 4.558 -9.796 -1.948 1.00 64.11 O ATOM 213 CB GLU A1679 6.015 -8.756 -4.759 1.00 34.22 C ATOM 214 CG GLU A1679 5.879 -7.952 -6.038 1.00 72.11 C ATOM 215 CD GLU A1679 6.437 -8.682 -7.227 1.00 61.43 C ATOM 216 OE1 GLU A1679 7.654 -8.944 -7.272 1.00 41.32 O ATOM 217 OE2 GLU A1679 5.662 -9.034 -8.141 1.00 1.43 O ATOM 0 H GLU A1679 6.458 -6.475 -3.896 1.00 51.13 H new ATOM 0 HA GLU A1679 4.214 -8.137 -3.794 1.00 35.24 H new ATOM 0 HB2 GLU A1679 7.073 -8.845 -4.511 1.00 34.22 H new ATOM 0 HB3 GLU A1679 5.644 -9.765 -4.937 1.00 34.22 H new ATOM 0 HG2 GLU A1679 4.827 -7.726 -6.213 1.00 72.11 H new ATOM 0 HG3 GLU A1679 6.395 -6.999 -5.923 1.00 72.11 H new ATOM 224 N LYS A1680 6.636 -8.956 -1.692 1.00 4.24 N ATOM 225 CA LYS A1680 6.960 -9.822 -0.564 1.00 25.31 C ATOM 226 C LYS A1680 6.131 -9.477 0.654 1.00 11.54 C ATOM 227 O LYS A1680 5.826 -10.335 1.488 1.00 14.12 O ATOM 228 CB LYS A1680 8.482 -9.846 -0.245 1.00 53.35 C ATOM 229 CG LYS A1680 9.096 -8.519 0.197 1.00 63.34 C ATOM 230 CD LYS A1680 10.604 -8.653 0.392 1.00 0.10 C ATOM 231 CE LYS A1680 11.258 -7.336 0.805 1.00 34.40 C ATOM 232 NZ LYS A1680 10.873 -6.894 2.161 1.00 21.24 N ATOM 0 H LYS A1680 7.365 -8.285 -1.934 1.00 4.24 H new ATOM 0 HA LYS A1680 6.697 -10.837 -0.862 1.00 25.31 H new ATOM 0 HB2 LYS A1680 8.657 -10.583 0.539 1.00 53.35 H new ATOM 0 HB3 LYS A1680 9.013 -10.192 -1.132 1.00 53.35 H new ATOM 0 HG2 LYS A1680 8.889 -7.752 -0.549 1.00 63.34 H new ATOM 0 HG3 LYS A1680 8.633 -8.192 1.128 1.00 63.34 H new ATOM 0 HD2 LYS A1680 10.803 -9.408 1.152 1.00 0.10 H new ATOM 0 HD3 LYS A1680 11.057 -9.006 -0.534 1.00 0.10 H new ATOM 0 HE2 LYS A1680 12.341 -7.446 0.760 1.00 34.40 H new ATOM 0 HE3 LYS A1680 10.986 -6.562 0.087 1.00 34.40 H new ATOM 0 HZ1 LYS A1680 11.349 -5.996 2.382 1.00 21.24 H new ATOM 0 HZ2 LYS A1680 9.843 -6.759 2.203 1.00 21.24 H new ATOM 0 HZ3 LYS A1680 11.156 -7.615 2.855 1.00 21.24 H new ATOM 246 N VAL A1681 5.759 -8.221 0.744 1.00 0.50 N ATOM 247 CA VAL A1681 5.067 -7.741 1.893 1.00 45.24 C ATOM 248 C VAL A1681 3.541 -7.999 1.815 1.00 12.54 C ATOM 249 O VAL A1681 2.966 -8.575 2.733 1.00 2.44 O ATOM 250 CB VAL A1681 5.410 -6.235 2.178 1.00 64.30 C ATOM 251 CG1 VAL A1681 4.821 -5.265 1.176 1.00 73.42 C ATOM 252 CG2 VAL A1681 5.052 -5.855 3.569 1.00 54.25 C ATOM 0 H VAL A1681 5.930 -7.518 0.025 1.00 0.50 H new ATOM 0 HA VAL A1681 5.422 -8.317 2.747 1.00 45.24 H new ATOM 0 HB VAL A1681 6.491 -6.156 2.060 1.00 64.30 H new ATOM 0 HG11 VAL A1681 5.105 -4.247 1.445 1.00 73.42 H new ATOM 0 HG12 VAL A1681 5.199 -5.496 0.180 1.00 73.42 H new ATOM 0 HG13 VAL A1681 3.734 -5.352 1.181 1.00 73.42 H new ATOM 0 HG21 VAL A1681 5.301 -4.807 3.736 1.00 54.25 H new ATOM 0 HG22 VAL A1681 3.983 -6.002 3.723 1.00 54.25 H new ATOM 0 HG23 VAL A1681 5.609 -6.476 4.271 1.00 54.25 H new ATOM 262 N ASN A1682 2.908 -7.669 0.683 1.00 41.02 N ATOM 263 CA ASN A1682 1.433 -7.758 0.575 1.00 63.33 C ATOM 264 C ASN A1682 0.946 -9.208 0.618 1.00 13.02 C ATOM 265 O ASN A1682 -0.194 -9.468 1.007 1.00 43.34 O ATOM 266 CB ASN A1682 0.875 -7.046 -0.688 1.00 32.44 C ATOM 267 CG ASN A1682 0.964 -7.868 -1.980 1.00 0.25 C ATOM 268 OD1 ASN A1682 0.047 -8.598 -2.324 1.00 60.22 O ATOM 269 ND2 ASN A1682 2.039 -7.752 -2.693 1.00 40.23 N ATOM 0 H ASN A1682 3.377 -7.343 -0.162 1.00 41.02 H new ATOM 0 HA ASN A1682 1.043 -7.232 1.447 1.00 63.33 H new ATOM 0 HB2 ASN A1682 -0.168 -6.786 -0.510 1.00 32.44 H new ATOM 0 HB3 ASN A1682 1.417 -6.111 -0.830 1.00 32.44 H new ATOM 0 HD21 ASN A1682 2.133 -8.277 -3.563 1.00 40.23 H new ATOM 0 HD22 ASN A1682 2.791 -7.136 -2.385 1.00 40.23 H new ATOM 276 N ALA A1683 1.839 -10.137 0.280 1.00 62.54 N ATOM 277 CA ALA A1683 1.540 -11.574 0.209 1.00 63.11 C ATOM 278 C ALA A1683 0.900 -12.113 1.494 1.00 30.15 C ATOM 279 O ALA A1683 -0.005 -12.951 1.447 1.00 14.31 O ATOM 280 CB ALA A1683 2.811 -12.354 -0.100 1.00 42.12 C ATOM 0 H ALA A1683 2.806 -9.913 0.044 1.00 62.54 H new ATOM 0 HA ALA A1683 0.813 -11.708 -0.592 1.00 63.11 H new ATOM 0 HB1 ALA A1683 2.581 -13.418 -0.151 1.00 42.12 H new ATOM 0 HB2 ALA A1683 3.217 -12.024 -1.056 1.00 42.12 H new ATOM 0 HB3 ALA A1683 3.546 -12.179 0.686 1.00 42.12 H new ATOM 286 N SER A1684 1.349 -11.634 2.620 1.00 55.20 N ATOM 287 CA SER A1684 0.838 -12.101 3.888 1.00 35.12 C ATOM 288 C SER A1684 0.006 -11.010 4.577 1.00 63.31 C ATOM 289 O SER A1684 -0.493 -11.193 5.702 1.00 55.14 O ATOM 290 CB SER A1684 2.016 -12.515 4.754 1.00 43.11 C ATOM 291 OG SER A1684 2.858 -13.405 4.033 1.00 43.32 O ATOM 0 H SER A1684 2.071 -10.917 2.691 1.00 55.20 H new ATOM 0 HA SER A1684 0.179 -12.955 3.730 1.00 35.12 H new ATOM 0 HB2 SER A1684 2.581 -11.634 5.060 1.00 43.11 H new ATOM 0 HB3 SER A1684 1.658 -12.996 5.664 1.00 43.11 H new ATOM 0 HG SER A1684 3.616 -13.667 4.596 1.00 43.32 H new ATOM 297 N LEU A1685 -0.166 -9.904 3.878 1.00 51.13 N ATOM 298 CA LEU A1685 -0.867 -8.735 4.399 1.00 70.55 C ATOM 299 C LEU A1685 -2.263 -8.584 3.823 1.00 72.21 C ATOM 300 O LEU A1685 -3.172 -8.145 4.516 1.00 13.10 O ATOM 301 CB LEU A1685 -0.050 -7.468 4.178 1.00 70.04 C ATOM 302 CG LEU A1685 0.932 -7.061 5.289 1.00 51.15 C ATOM 303 CD1 LEU A1685 1.923 -8.161 5.641 1.00 71.54 C ATOM 304 CD2 LEU A1685 1.656 -5.788 4.902 1.00 52.15 C ATOM 0 H LEU A1685 0.178 -9.786 2.925 1.00 51.13 H new ATOM 0 HA LEU A1685 -0.985 -8.893 5.471 1.00 70.55 H new ATOM 0 HB2 LEU A1685 0.516 -7.588 3.254 1.00 70.04 H new ATOM 0 HB3 LEU A1685 -0.744 -6.642 4.021 1.00 70.04 H new ATOM 0 HG LEU A1685 0.342 -6.884 6.188 1.00 51.15 H new ATOM 0 HD11 LEU A1685 2.588 -7.812 6.431 1.00 71.54 H new ATOM 0 HD12 LEU A1685 1.381 -9.042 5.985 1.00 71.54 H new ATOM 0 HD13 LEU A1685 2.510 -8.418 4.759 1.00 71.54 H new ATOM 0 HD21 LEU A1685 2.349 -5.508 5.695 1.00 52.15 H new ATOM 0 HD22 LEU A1685 2.210 -5.951 3.977 1.00 52.15 H new ATOM 0 HD23 LEU A1685 0.931 -4.988 4.755 1.00 52.15 H new ATOM 316 N LEU A1686 -2.444 -8.949 2.565 1.00 13.43 N ATOM 317 CA LEU A1686 -3.769 -8.906 1.952 1.00 75.20 C ATOM 318 C LEU A1686 -4.838 -9.716 2.719 1.00 2.22 C ATOM 319 O LEU A1686 -5.986 -9.265 2.816 1.00 40.34 O ATOM 320 CB LEU A1686 -3.738 -9.286 0.502 1.00 51.33 C ATOM 321 CG LEU A1686 -3.016 -8.308 -0.410 1.00 24.33 C ATOM 322 CD1 LEU A1686 -3.241 -8.719 -1.794 1.00 25.12 C ATOM 323 CD2 LEU A1686 -3.517 -6.886 -0.226 1.00 21.01 C ATOM 0 H LEU A1686 -1.700 -9.276 1.949 1.00 13.43 H new ATOM 0 HA LEU A1686 -4.074 -7.862 2.018 1.00 75.20 H new ATOM 0 HB2 LEU A1686 -3.263 -10.263 0.409 1.00 51.33 H new ATOM 0 HB3 LEU A1686 -4.764 -9.396 0.150 1.00 51.33 H new ATOM 0 HG LEU A1686 -1.955 -8.321 -0.160 1.00 24.33 H new ATOM 0 HD11 LEU A1686 -2.730 -8.029 -2.466 1.00 25.12 H new ATOM 0 HD12 LEU A1686 -2.851 -9.726 -1.943 1.00 25.12 H new ATOM 0 HD13 LEU A1686 -4.310 -8.709 -2.007 1.00 25.12 H new ATOM 0 HD21 LEU A1686 -2.975 -6.219 -0.897 1.00 21.01 H new ATOM 0 HD22 LEU A1686 -4.582 -6.843 -0.455 1.00 21.01 H new ATOM 0 HD23 LEU A1686 -3.355 -6.574 0.806 1.00 21.01 H new ATOM 335 N PRO A1687 -4.511 -10.936 3.258 1.00 60.12 N ATOM 336 CA PRO A1687 -5.421 -11.664 4.159 1.00 60.21 C ATOM 337 C PRO A1687 -5.803 -10.871 5.439 1.00 43.20 C ATOM 338 O PRO A1687 -6.805 -11.181 6.081 1.00 1.45 O ATOM 339 CB PRO A1687 -4.644 -12.941 4.530 1.00 3.23 C ATOM 340 CG PRO A1687 -3.248 -12.713 4.072 1.00 44.54 C ATOM 341 CD PRO A1687 -3.334 -11.767 2.926 1.00 72.14 C ATOM 0 HA PRO A1687 -6.374 -11.855 3.666 1.00 60.21 H new ATOM 0 HB2 PRO A1687 -4.679 -13.121 5.604 1.00 3.23 H new ATOM 0 HB3 PRO A1687 -5.076 -13.816 4.046 1.00 3.23 H new ATOM 0 HG2 PRO A1687 -2.638 -12.297 4.874 1.00 44.54 H new ATOM 0 HG3 PRO A1687 -2.780 -13.650 3.769 1.00 44.54 H new ATOM 0 HD2 PRO A1687 -2.430 -11.165 2.833 1.00 72.14 H new ATOM 0 HD3 PRO A1687 -3.466 -12.292 1.980 1.00 72.14 H new ATOM 349 N GLN A1688 -5.034 -9.824 5.785 1.00 5.35 N ATOM 350 CA GLN A1688 -5.336 -9.017 6.970 1.00 23.01 C ATOM 351 C GLN A1688 -6.191 -7.845 6.534 1.00 63.01 C ATOM 352 O GLN A1688 -6.567 -6.994 7.343 1.00 63.41 O ATOM 353 CB GLN A1688 -4.045 -8.441 7.562 1.00 25.32 C ATOM 354 CG GLN A1688 -2.970 -9.453 7.895 1.00 25.02 C ATOM 355 CD GLN A1688 -1.690 -8.787 8.367 1.00 64.45 C ATOM 356 OE1 GLN A1688 -1.361 -7.669 7.962 1.00 53.35 O ATOM 357 NE2 GLN A1688 -0.960 -9.455 9.211 1.00 4.31 N ATOM 0 H GLN A1688 -4.210 -9.523 5.265 1.00 5.35 H new ATOM 0 HA GLN A1688 -5.840 -9.640 7.709 1.00 23.01 H new ATOM 0 HB2 GLN A1688 -3.633 -7.719 6.857 1.00 25.32 H new ATOM 0 HB3 GLN A1688 -4.296 -7.892 8.470 1.00 25.32 H new ATOM 0 HG2 GLN A1688 -3.335 -10.128 8.669 1.00 25.02 H new ATOM 0 HG3 GLN A1688 -2.759 -10.061 7.015 1.00 25.02 H new ATOM 0 HE21 GLN A1688 -1.260 -10.377 9.526 1.00 4.31 H new ATOM 0 HE22 GLN A1688 -0.087 -9.057 9.557 1.00 4.31 H new ATOM 366 N ASN A1689 -6.497 -7.827 5.234 1.00 12.52 N ATOM 367 CA ASN A1689 -7.125 -6.698 4.583 1.00 32.21 C ATOM 368 C ASN A1689 -6.266 -5.495 4.716 1.00 54.53 C ATOM 369 O ASN A1689 -6.693 -4.404 5.112 1.00 22.25 O ATOM 370 CB ASN A1689 -8.582 -6.453 4.980 1.00 43.53 C ATOM 371 CG ASN A1689 -9.541 -7.307 4.174 1.00 71.35 C ATOM 372 OD1 ASN A1689 -9.208 -8.420 3.745 1.00 11.21 O ATOM 373 ND2 ASN A1689 -10.722 -6.797 3.930 1.00 32.42 N ATOM 0 H ASN A1689 -6.310 -8.609 4.606 1.00 12.52 H new ATOM 0 HA ASN A1689 -7.205 -6.950 3.526 1.00 32.21 H new ATOM 0 HB2 ASN A1689 -8.710 -6.667 6.041 1.00 43.53 H new ATOM 0 HB3 ASN A1689 -8.825 -5.400 4.836 1.00 43.53 H new ATOM 0 HD21 ASN A1689 -11.398 -7.319 3.372 1.00 32.42 H new ATOM 0 HD22 ASN A1689 -10.966 -5.877 4.298 1.00 32.42 H new ATOM 380 N VAL A1690 -5.038 -5.712 4.374 1.00 32.33 N ATOM 381 CA VAL A1690 -4.042 -4.727 4.382 1.00 43.23 C ATOM 382 C VAL A1690 -3.473 -4.638 3.006 1.00 74.53 C ATOM 383 O VAL A1690 -2.847 -5.570 2.510 1.00 2.52 O ATOM 384 CB VAL A1690 -2.943 -5.020 5.454 1.00 0.32 C ATOM 385 CG1 VAL A1690 -1.638 -4.361 5.102 1.00 53.33 C ATOM 386 CG2 VAL A1690 -3.373 -4.466 6.777 1.00 74.13 C ATOM 0 H VAL A1690 -4.701 -6.626 4.070 1.00 32.33 H new ATOM 0 HA VAL A1690 -4.474 -3.766 4.662 1.00 43.23 H new ATOM 0 HB VAL A1690 -2.810 -6.101 5.494 1.00 0.32 H new ATOM 0 HG11 VAL A1690 -0.898 -4.587 5.870 1.00 53.33 H new ATOM 0 HG12 VAL A1690 -1.289 -4.736 4.140 1.00 53.33 H new ATOM 0 HG13 VAL A1690 -1.780 -3.282 5.041 1.00 53.33 H new ATOM 0 HG21 VAL A1690 -2.606 -4.671 7.524 1.00 74.13 H new ATOM 0 HG22 VAL A1690 -3.517 -3.389 6.691 1.00 74.13 H new ATOM 0 HG23 VAL A1690 -4.309 -4.934 7.081 1.00 74.13 H new ATOM 396 N LEU A1691 -3.767 -3.569 2.376 1.00 35.31 N ATOM 397 CA LEU A1691 -3.270 -3.296 1.100 1.00 23.31 C ATOM 398 C LEU A1691 -2.166 -2.300 1.323 1.00 73.14 C ATOM 399 O LEU A1691 -2.403 -1.131 1.621 1.00 15.42 O ATOM 400 CB LEU A1691 -4.444 -2.786 0.202 1.00 73.31 C ATOM 401 CG LEU A1691 -4.181 -2.377 -1.269 1.00 5.55 C ATOM 402 CD1 LEU A1691 -3.605 -0.989 -1.360 1.00 1.04 C ATOM 403 CD2 LEU A1691 -3.275 -3.374 -1.973 1.00 61.41 C ATOM 0 H LEU A1691 -4.378 -2.843 2.750 1.00 35.31 H new ATOM 0 HA LEU A1691 -2.865 -4.158 0.570 1.00 23.31 H new ATOM 0 HB2 LEU A1691 -5.204 -3.568 0.189 1.00 73.31 H new ATOM 0 HB3 LEU A1691 -4.883 -1.923 0.703 1.00 73.31 H new ATOM 0 HG LEU A1691 -5.145 -2.379 -1.777 1.00 5.55 H new ATOM 0 HD11 LEU A1691 -3.433 -0.734 -2.406 1.00 1.04 H new ATOM 0 HD12 LEU A1691 -4.304 -0.276 -0.923 1.00 1.04 H new ATOM 0 HD13 LEU A1691 -2.661 -0.951 -0.817 1.00 1.04 H new ATOM 0 HD21 LEU A1691 -3.113 -3.054 -3.002 1.00 61.41 H new ATOM 0 HD22 LEU A1691 -2.318 -3.426 -1.454 1.00 61.41 H new ATOM 0 HD23 LEU A1691 -3.744 -4.358 -1.968 1.00 61.41 H new ATOM 415 N ASP A1692 -0.975 -2.785 1.272 1.00 55.10 N ATOM 416 CA ASP A1692 0.165 -1.967 1.504 1.00 63.52 C ATOM 417 C ASP A1692 0.906 -1.865 0.199 1.00 23.35 C ATOM 418 O ASP A1692 1.188 -2.888 -0.412 1.00 2.32 O ATOM 419 CB ASP A1692 1.094 -2.595 2.562 1.00 20.42 C ATOM 420 CG ASP A1692 2.230 -1.659 2.988 1.00 42.41 C ATOM 421 OD1 ASP A1692 2.807 -0.959 2.140 1.00 51.53 O ATOM 422 OD2 ASP A1692 2.531 -1.575 4.196 1.00 40.41 O ATOM 0 H ASP A1692 -0.763 -3.762 1.068 1.00 55.10 H new ATOM 0 HA ASP A1692 -0.149 -0.990 1.872 1.00 63.52 H new ATOM 0 HB2 ASP A1692 0.506 -2.867 3.439 1.00 20.42 H new ATOM 0 HB3 ASP A1692 1.519 -3.517 2.164 1.00 20.42 H new ATOM 427 N LEU A1693 1.182 -0.667 -0.235 1.00 14.32 N ATOM 428 CA LEU A1693 1.910 -0.422 -1.464 1.00 31.35 C ATOM 429 C LEU A1693 2.703 0.852 -1.350 1.00 63.23 C ATOM 430 O LEU A1693 2.794 1.657 -2.290 1.00 55.21 O ATOM 431 CB LEU A1693 0.966 -0.450 -2.692 1.00 4.21 C ATOM 432 CG LEU A1693 -0.428 0.188 -2.560 1.00 62.42 C ATOM 433 CD1 LEU A1693 -0.388 1.694 -2.342 1.00 24.54 C ATOM 434 CD2 LEU A1693 -1.266 -0.172 -3.765 1.00 3.51 C ATOM 0 H LEU A1693 0.907 0.183 0.257 1.00 14.32 H new ATOM 0 HA LEU A1693 2.625 -1.229 -1.624 1.00 31.35 H new ATOM 0 HB2 LEU A1693 1.480 0.044 -3.517 1.00 4.21 H new ATOM 0 HB3 LEU A1693 0.828 -1.492 -2.981 1.00 4.21 H new ATOM 0 HG LEU A1693 -0.887 -0.221 -1.660 1.00 62.42 H new ATOM 0 HD11 LEU A1693 -1.405 2.077 -2.258 1.00 24.54 H new ATOM 0 HD12 LEU A1693 0.160 1.915 -1.426 1.00 24.54 H new ATOM 0 HD13 LEU A1693 0.110 2.171 -3.186 1.00 24.54 H new ATOM 0 HD21 LEU A1693 -2.253 0.281 -3.670 1.00 3.51 H new ATOM 0 HD22 LEU A1693 -0.782 0.199 -4.669 1.00 3.51 H new ATOM 0 HD23 LEU A1693 -1.368 -1.255 -3.827 1.00 3.51 H new ATOM 446 N HIS A1694 3.331 1.010 -0.209 1.00 44.14 N ATOM 447 CA HIS A1694 4.077 2.194 0.048 1.00 32.25 C ATOM 448 C HIS A1694 5.351 2.230 -0.756 1.00 61.12 C ATOM 449 O HIS A1694 6.132 1.273 -0.762 1.00 32.02 O ATOM 450 CB HIS A1694 4.348 2.399 1.547 1.00 3.31 C ATOM 451 CG HIS A1694 5.243 1.406 2.242 1.00 44.43 C ATOM 452 ND1 HIS A1694 4.774 0.389 3.013 1.00 2.30 N ATOM 453 CD2 HIS A1694 6.576 1.359 2.350 1.00 71.14 C ATOM 454 CE1 HIS A1694 5.756 -0.229 3.586 1.00 41.12 C ATOM 455 NE2 HIS A1694 6.879 0.331 3.202 1.00 60.31 N ATOM 0 H HIS A1694 3.333 0.327 0.549 1.00 44.14 H new ATOM 0 HA HIS A1694 3.460 3.032 -0.276 1.00 32.25 H new ATOM 0 HB2 HIS A1694 4.784 3.390 1.676 1.00 3.31 H new ATOM 0 HB3 HIS A1694 3.388 2.403 2.063 1.00 3.31 H new ATOM 0 HD1 HIS A1694 3.789 0.148 3.124 1.00 2.30 H new ATOM 0 HD2 HIS A1694 7.282 2.011 1.857 1.00 71.14 H new ATOM 0 HE1 HIS A1694 5.667 -1.064 4.265 1.00 41.12 H new ATOM 464 N GLY A1695 5.530 3.303 -1.462 1.00 11.55 N ATOM 465 CA GLY A1695 6.746 3.479 -2.207 1.00 32.42 C ATOM 466 C GLY A1695 6.592 3.274 -3.696 1.00 62.45 C ATOM 467 O GLY A1695 7.519 3.554 -4.440 1.00 10.53 O ATOM 0 H GLY A1695 4.858 4.067 -1.541 1.00 11.55 H new ATOM 0 HA2 GLY A1695 7.128 4.484 -2.027 1.00 32.42 H new ATOM 0 HA3 GLY A1695 7.494 2.782 -1.830 1.00 32.42 H new ATOM 471 N LEU A1696 5.447 2.773 -4.140 1.00 51.53 N ATOM 472 CA LEU A1696 5.195 2.592 -5.584 1.00 15.22 C ATOM 473 C LEU A1696 4.942 3.924 -6.277 1.00 24.01 C ATOM 474 O LEU A1696 5.041 5.004 -5.668 1.00 50.10 O ATOM 475 CB LEU A1696 4.003 1.641 -5.864 1.00 71.04 C ATOM 476 CG LEU A1696 4.235 0.130 -5.696 1.00 54.53 C ATOM 477 CD1 LEU A1696 4.501 -0.240 -4.275 1.00 64.41 C ATOM 478 CD2 LEU A1696 3.057 -0.655 -6.233 1.00 71.24 C ATOM 0 H LEU A1696 4.677 2.484 -3.536 1.00 51.53 H new ATOM 0 HA LEU A1696 6.099 2.138 -5.989 1.00 15.22 H new ATOM 0 HB2 LEU A1696 3.183 1.929 -5.206 1.00 71.04 H new ATOM 0 HB3 LEU A1696 3.668 1.817 -6.886 1.00 71.04 H new ATOM 0 HG LEU A1696 5.123 -0.126 -6.274 1.00 54.53 H new ATOM 0 HD11 LEU A1696 4.659 -1.316 -4.203 1.00 64.41 H new ATOM 0 HD12 LEU A1696 5.391 0.282 -3.924 1.00 64.41 H new ATOM 0 HD13 LEU A1696 3.647 0.044 -3.659 1.00 64.41 H new ATOM 0 HD21 LEU A1696 3.242 -1.722 -6.104 1.00 71.24 H new ATOM 0 HD22 LEU A1696 2.155 -0.375 -5.689 1.00 71.24 H new ATOM 0 HD23 LEU A1696 2.925 -0.435 -7.292 1.00 71.24 H new ATOM 490 N HIS A1697 4.695 3.880 -7.552 1.00 42.32 N ATOM 491 CA HIS A1697 4.295 5.071 -8.267 1.00 74.33 C ATOM 492 C HIS A1697 2.840 5.199 -8.070 1.00 15.53 C ATOM 493 O HIS A1697 2.159 4.207 -7.810 1.00 65.54 O ATOM 494 CB HIS A1697 4.658 4.998 -9.748 1.00 40.50 C ATOM 495 CG HIS A1697 6.126 4.841 -10.022 1.00 53.41 C ATOM 496 ND1 HIS A1697 6.746 3.625 -10.159 1.00 33.45 N ATOM 497 CD2 HIS A1697 7.090 5.773 -10.195 1.00 23.45 C ATOM 498 CE1 HIS A1697 8.031 3.830 -10.402 1.00 42.30 C ATOM 499 NE2 HIS A1697 8.303 5.129 -10.437 1.00 4.14 N ATOM 0 H HIS A1697 4.761 3.038 -8.124 1.00 42.32 H new ATOM 0 HA HIS A1697 4.822 5.946 -7.886 1.00 74.33 H new ATOM 0 HB2 HIS A1697 4.125 4.161 -10.199 1.00 40.50 H new ATOM 0 HB3 HIS A1697 4.304 5.903 -10.241 1.00 40.50 H new ATOM 0 HD2 HIS A1697 6.944 6.842 -10.153 1.00 23.45 H new ATOM 0 HE1 HIS A1697 8.759 3.047 -10.552 1.00 42.30 H new ATOM 0 HE2 HIS A1697 9.210 5.565 -10.606 1.00 4.14 H new ATOM 507 N VAL A1698 2.342 6.388 -8.179 1.00 4.22 N ATOM 508 CA VAL A1698 0.978 6.622 -7.831 1.00 1.03 C ATOM 509 C VAL A1698 0.011 5.931 -8.799 1.00 24.33 C ATOM 510 O VAL A1698 -1.087 5.564 -8.425 1.00 20.43 O ATOM 511 CB VAL A1698 0.653 8.121 -7.636 1.00 71.52 C ATOM 512 CG1 VAL A1698 1.683 8.802 -6.748 1.00 12.22 C ATOM 513 CG2 VAL A1698 0.435 8.882 -8.929 1.00 51.32 C ATOM 0 H VAL A1698 2.855 7.208 -8.504 1.00 4.22 H new ATOM 0 HA VAL A1698 0.828 6.160 -6.855 1.00 1.03 H new ATOM 0 HB VAL A1698 -0.309 8.147 -7.125 1.00 71.52 H new ATOM 0 HG11 VAL A1698 1.424 9.854 -6.632 1.00 12.22 H new ATOM 0 HG12 VAL A1698 1.695 8.321 -5.770 1.00 12.22 H new ATOM 0 HG13 VAL A1698 2.669 8.719 -7.205 1.00 12.22 H new ATOM 0 HG21 VAL A1698 0.212 9.925 -8.704 1.00 51.32 H new ATOM 0 HG22 VAL A1698 1.336 8.827 -9.540 1.00 51.32 H new ATOM 0 HG23 VAL A1698 -0.400 8.442 -9.474 1.00 51.32 H new ATOM 523 N ASP A1699 0.463 5.715 -10.022 1.00 75.20 N ATOM 524 CA ASP A1699 -0.312 4.991 -11.023 1.00 11.13 C ATOM 525 C ASP A1699 -0.422 3.524 -10.642 1.00 31.33 C ATOM 526 O ASP A1699 -1.509 2.932 -10.688 1.00 3.03 O ATOM 527 CB ASP A1699 0.313 5.136 -12.421 1.00 72.13 C ATOM 528 CG ASP A1699 1.756 4.652 -12.532 1.00 30.34 C ATOM 529 OD1 ASP A1699 2.658 5.350 -12.049 1.00 34.00 O ATOM 530 OD2 ASP A1699 2.001 3.579 -13.113 1.00 54.21 O ATOM 0 H ASP A1699 1.374 6.034 -10.352 1.00 75.20 H new ATOM 0 HA ASP A1699 -1.312 5.424 -11.056 1.00 11.13 H new ATOM 0 HB2 ASP A1699 -0.297 4.582 -13.135 1.00 72.13 H new ATOM 0 HB3 ASP A1699 0.273 6.185 -12.714 1.00 72.13 H new ATOM 535 N GLU A1700 0.695 2.971 -10.232 1.00 50.41 N ATOM 536 CA GLU A1700 0.801 1.592 -9.790 1.00 25.35 C ATOM 537 C GLU A1700 -0.013 1.397 -8.543 1.00 54.04 C ATOM 538 O GLU A1700 -0.792 0.450 -8.430 1.00 72.20 O ATOM 539 CB GLU A1700 2.249 1.273 -9.516 1.00 1.43 C ATOM 540 CG GLU A1700 3.099 1.418 -10.735 1.00 71.11 C ATOM 541 CD GLU A1700 4.567 1.346 -10.465 1.00 3.11 C ATOM 542 OE1 GLU A1700 5.001 1.702 -9.354 1.00 3.21 O ATOM 543 OE2 GLU A1700 5.324 1.028 -11.408 1.00 0.35 O ATOM 0 H GLU A1700 1.580 3.477 -10.194 1.00 50.41 H new ATOM 0 HA GLU A1700 0.423 0.926 -10.565 1.00 25.35 H new ATOM 0 HB2 GLU A1700 2.623 1.933 -8.734 1.00 1.43 H new ATOM 0 HB3 GLU A1700 2.330 0.254 -9.138 1.00 1.43 H new ATOM 0 HG2 GLU A1700 2.832 0.636 -11.446 1.00 71.11 H new ATOM 0 HG3 GLU A1700 2.874 2.373 -11.211 1.00 71.11 H new ATOM 550 N ALA A1701 0.158 2.311 -7.616 1.00 42.33 N ATOM 551 CA ALA A1701 -0.599 2.312 -6.398 1.00 70.35 C ATOM 552 C ALA A1701 -2.104 2.298 -6.676 1.00 13.44 C ATOM 553 O ALA A1701 -2.827 1.534 -6.074 1.00 32.03 O ATOM 554 CB ALA A1701 -0.217 3.491 -5.535 1.00 60.31 C ATOM 0 H ALA A1701 0.830 3.075 -7.691 1.00 42.33 H new ATOM 0 HA ALA A1701 -0.359 1.399 -5.854 1.00 70.35 H new ATOM 0 HB1 ALA A1701 -0.802 3.474 -4.616 1.00 60.31 H new ATOM 0 HB2 ALA A1701 0.844 3.435 -5.291 1.00 60.31 H new ATOM 0 HB3 ALA A1701 -0.416 4.417 -6.075 1.00 60.31 H new ATOM 560 N LEU A1702 -2.552 3.097 -7.633 1.00 41.13 N ATOM 561 CA LEU A1702 -3.972 3.168 -7.962 1.00 74.33 C ATOM 562 C LEU A1702 -4.493 1.877 -8.588 1.00 52.02 C ATOM 563 O LEU A1702 -5.569 1.396 -8.209 1.00 14.11 O ATOM 564 CB LEU A1702 -4.297 4.368 -8.862 1.00 53.23 C ATOM 565 CG LEU A1702 -4.123 5.758 -8.237 1.00 53.24 C ATOM 566 CD1 LEU A1702 -4.442 6.844 -9.253 1.00 5.02 C ATOM 567 CD2 LEU A1702 -5.003 5.912 -7.005 1.00 44.02 C ATOM 0 H LEU A1702 -1.956 3.705 -8.195 1.00 41.13 H new ATOM 0 HA LEU A1702 -4.489 3.307 -7.013 1.00 74.33 H new ATOM 0 HB2 LEU A1702 -3.665 4.311 -9.748 1.00 53.23 H new ATOM 0 HB3 LEU A1702 -5.329 4.272 -9.199 1.00 53.23 H new ATOM 0 HG LEU A1702 -3.082 5.863 -7.930 1.00 53.24 H new ATOM 0 HD11 LEU A1702 -4.313 7.823 -8.792 1.00 5.02 H new ATOM 0 HD12 LEU A1702 -3.769 6.753 -10.106 1.00 5.02 H new ATOM 0 HD13 LEU A1702 -5.473 6.735 -9.591 1.00 5.02 H new ATOM 0 HD21 LEU A1702 -4.862 6.906 -6.579 1.00 44.02 H new ATOM 0 HD22 LEU A1702 -6.048 5.782 -7.286 1.00 44.02 H new ATOM 0 HD23 LEU A1702 -4.730 5.159 -6.266 1.00 44.02 H new ATOM 579 N GLU A1703 -3.735 1.299 -9.516 1.00 1.45 N ATOM 580 CA GLU A1703 -4.173 0.091 -10.197 1.00 12.43 C ATOM 581 C GLU A1703 -4.235 -1.100 -9.232 1.00 22.31 C ATOM 582 O GLU A1703 -5.206 -1.875 -9.242 1.00 70.42 O ATOM 583 CB GLU A1703 -3.314 -0.212 -11.436 1.00 52.41 C ATOM 584 CG GLU A1703 -1.852 -0.478 -11.153 1.00 11.14 C ATOM 585 CD GLU A1703 -1.070 -0.825 -12.381 1.00 24.33 C ATOM 586 OE1 GLU A1703 -1.126 -1.998 -12.820 1.00 64.20 O ATOM 587 OE2 GLU A1703 -0.381 0.047 -12.934 1.00 72.31 O ATOM 0 H GLU A1703 -2.822 1.647 -9.810 1.00 1.45 H new ATOM 0 HA GLU A1703 -5.186 0.267 -10.558 1.00 12.43 H new ATOM 0 HB2 GLU A1703 -3.733 -1.079 -11.946 1.00 52.41 H new ATOM 0 HB3 GLU A1703 -3.388 0.630 -12.125 1.00 52.41 H new ATOM 0 HG2 GLU A1703 -1.412 0.403 -10.686 1.00 11.14 H new ATOM 0 HG3 GLU A1703 -1.770 -1.294 -10.435 1.00 11.14 H new ATOM 594 N HIS A1704 -3.231 -1.214 -8.362 1.00 55.44 N ATOM 595 CA HIS A1704 -3.211 -2.276 -7.370 1.00 54.31 C ATOM 596 C HIS A1704 -4.314 -2.051 -6.340 1.00 2.14 C ATOM 597 O HIS A1704 -4.968 -2.994 -5.899 1.00 31.24 O ATOM 598 CB HIS A1704 -1.831 -2.410 -6.677 1.00 42.31 C ATOM 599 CG HIS A1704 -0.712 -2.924 -7.562 1.00 42.34 C ATOM 600 ND1 HIS A1704 -0.671 -4.200 -8.070 1.00 61.35 N ATOM 601 CD2 HIS A1704 0.426 -2.316 -8.013 1.00 74.23 C ATOM 602 CE1 HIS A1704 0.445 -4.333 -8.788 1.00 22.03 C ATOM 603 NE2 HIS A1704 1.151 -3.222 -8.788 1.00 20.45 N ATOM 0 H HIS A1704 -2.428 -0.586 -8.328 1.00 55.44 H new ATOM 0 HA HIS A1704 -3.393 -3.216 -7.892 1.00 54.31 H new ATOM 0 HB2 HIS A1704 -1.543 -1.435 -6.284 1.00 42.31 H new ATOM 0 HB3 HIS A1704 -1.934 -3.080 -5.823 1.00 42.31 H new ATOM 0 HD2 HIS A1704 0.717 -1.297 -7.803 1.00 74.23 H new ATOM 0 HE1 HIS A1704 0.733 -5.237 -9.304 1.00 22.03 H new ATOM 0 HE2 HIS A1704 2.042 -3.058 -9.257 1.00 20.45 H new ATOM 611 N LEU A1705 -4.545 -0.789 -6.016 1.00 1.21 N ATOM 612 CA LEU A1705 -5.566 -0.383 -5.058 1.00 45.44 C ATOM 613 C LEU A1705 -6.952 -0.767 -5.547 1.00 34.51 C ATOM 614 O LEU A1705 -7.688 -1.477 -4.862 1.00 22.23 O ATOM 615 CB LEU A1705 -5.529 1.136 -4.885 1.00 53.11 C ATOM 616 CG LEU A1705 -6.587 1.750 -3.982 1.00 11.33 C ATOM 617 CD1 LEU A1705 -6.310 1.455 -2.523 1.00 4.12 C ATOM 618 CD2 LEU A1705 -6.719 3.238 -4.244 1.00 74.32 C ATOM 0 H LEU A1705 -4.024 -0.008 -6.414 1.00 1.21 H new ATOM 0 HA LEU A1705 -5.361 -0.887 -4.113 1.00 45.44 H new ATOM 0 HB2 LEU A1705 -4.549 1.409 -4.494 1.00 53.11 H new ATOM 0 HB3 LEU A1705 -5.618 1.592 -5.871 1.00 53.11 H new ATOM 0 HG LEU A1705 -7.545 1.287 -4.220 1.00 11.33 H new ATOM 0 HD11 LEU A1705 -7.086 1.909 -1.906 1.00 4.12 H new ATOM 0 HD12 LEU A1705 -6.305 0.377 -2.364 1.00 4.12 H new ATOM 0 HD13 LEU A1705 -5.339 1.867 -2.246 1.00 4.12 H new ATOM 0 HD21 LEU A1705 -7.481 3.657 -3.587 1.00 74.32 H new ATOM 0 HD22 LEU A1705 -5.765 3.728 -4.051 1.00 74.32 H new ATOM 0 HD23 LEU A1705 -7.006 3.400 -5.283 1.00 74.32 H new ATOM 630 N MET A1706 -7.281 -0.318 -6.749 1.00 41.51 N ATOM 631 CA MET A1706 -8.617 -0.480 -7.309 1.00 4.42 C ATOM 632 C MET A1706 -9.025 -1.930 -7.440 1.00 54.14 C ATOM 633 O MET A1706 -10.136 -2.296 -7.061 1.00 34.54 O ATOM 634 CB MET A1706 -8.771 0.258 -8.652 1.00 72.44 C ATOM 635 CG MET A1706 -7.932 -0.273 -9.811 1.00 35.02 C ATOM 636 SD MET A1706 -8.118 0.696 -11.329 1.00 65.25 S ATOM 637 CE MET A1706 -7.482 2.286 -10.791 1.00 24.11 C ATOM 0 H MET A1706 -6.630 0.169 -7.365 1.00 41.51 H new ATOM 0 HA MET A1706 -9.298 -0.020 -6.593 1.00 4.42 H new ATOM 0 HB2 MET A1706 -9.821 0.223 -8.944 1.00 72.44 H new ATOM 0 HB3 MET A1706 -8.518 1.307 -8.498 1.00 72.44 H new ATOM 0 HG2 MET A1706 -6.882 -0.279 -9.518 1.00 35.02 H new ATOM 0 HG3 MET A1706 -8.213 -1.307 -10.011 1.00 35.02 H new ATOM 0 HE1 MET A1706 -7.380 2.947 -11.652 1.00 24.11 H new ATOM 0 HE2 MET A1706 -8.172 2.730 -10.073 1.00 24.11 H new ATOM 0 HE3 MET A1706 -6.508 2.148 -10.321 1.00 24.11 H new ATOM 647 N ARG A1707 -8.112 -2.763 -7.911 1.00 61.32 N ATOM 648 CA ARG A1707 -8.426 -4.154 -8.145 1.00 22.12 C ATOM 649 C ARG A1707 -8.647 -4.889 -6.817 1.00 34.21 C ATOM 650 O ARG A1707 -9.426 -5.841 -6.737 1.00 63.24 O ATOM 651 CB ARG A1707 -7.348 -4.833 -9.004 1.00 64.14 C ATOM 652 CG ARG A1707 -6.007 -5.031 -8.319 1.00 43.31 C ATOM 653 CD ARG A1707 -4.986 -5.601 -9.275 1.00 11.25 C ATOM 654 NE ARG A1707 -3.786 -6.069 -8.577 1.00 64.14 N ATOM 655 CZ ARG A1707 -2.697 -6.551 -9.180 1.00 33.22 C ATOM 656 NH1 ARG A1707 -2.516 -6.374 -10.479 1.00 10.04 N ATOM 657 NH2 ARG A1707 -1.750 -7.140 -8.457 1.00 54.21 N ATOM 0 H ARG A1707 -7.153 -2.498 -8.137 1.00 61.32 H new ATOM 0 HA ARG A1707 -9.358 -4.204 -8.709 1.00 22.12 H new ATOM 0 HB2 ARG A1707 -7.721 -5.805 -9.325 1.00 64.14 H new ATOM 0 HB3 ARG A1707 -7.194 -4.237 -9.904 1.00 64.14 H new ATOM 0 HG2 ARG A1707 -5.651 -4.078 -7.928 1.00 43.31 H new ATOM 0 HG3 ARG A1707 -6.126 -5.701 -7.467 1.00 43.31 H new ATOM 0 HD2 ARG A1707 -5.430 -6.428 -9.829 1.00 11.25 H new ATOM 0 HD3 ARG A1707 -4.708 -4.841 -10.005 1.00 11.25 H new ATOM 0 HE ARG A1707 -3.782 -6.023 -7.558 1.00 64.14 H new ATOM 0 HH11 ARG A1707 -3.211 -5.866 -11.026 1.00 10.04 H new ATOM 0 HH12 ARG A1707 -1.681 -6.745 -10.933 1.00 10.04 H new ATOM 0 HH21 ARG A1707 -1.857 -7.222 -7.446 1.00 54.21 H new ATOM 0 HH22 ARG A1707 -0.916 -7.510 -8.913 1.00 54.21 H new ATOM 671 N VAL A1708 -7.934 -4.478 -5.794 1.00 4.10 N ATOM 672 CA VAL A1708 -8.114 -5.040 -4.474 1.00 64.32 C ATOM 673 C VAL A1708 -9.388 -4.499 -3.811 1.00 10.01 C ATOM 674 O VAL A1708 -10.168 -5.261 -3.285 1.00 74.44 O ATOM 675 CB VAL A1708 -6.857 -4.861 -3.569 1.00 52.42 C ATOM 676 CG1 VAL A1708 -7.095 -5.391 -2.165 1.00 44.32 C ATOM 677 CG2 VAL A1708 -5.676 -5.581 -4.187 1.00 22.22 C ATOM 0 H VAL A1708 -7.220 -3.752 -5.851 1.00 4.10 H new ATOM 0 HA VAL A1708 -8.240 -6.115 -4.599 1.00 64.32 H new ATOM 0 HB VAL A1708 -6.649 -3.794 -3.496 1.00 52.42 H new ATOM 0 HG11 VAL A1708 -6.196 -5.248 -1.565 1.00 44.32 H new ATOM 0 HG12 VAL A1708 -7.925 -4.852 -1.709 1.00 44.32 H new ATOM 0 HG13 VAL A1708 -7.334 -6.453 -2.213 1.00 44.32 H new ATOM 0 HG21 VAL A1708 -4.799 -5.454 -3.552 1.00 22.22 H new ATOM 0 HG22 VAL A1708 -5.905 -6.642 -4.281 1.00 22.22 H new ATOM 0 HG23 VAL A1708 -5.472 -5.166 -5.174 1.00 22.22 H new ATOM 687 N LEU A1709 -9.604 -3.190 -3.869 1.00 53.31 N ATOM 688 CA LEU A1709 -10.795 -2.568 -3.254 1.00 40.14 C ATOM 689 C LEU A1709 -12.097 -3.153 -3.752 1.00 41.20 C ATOM 690 O LEU A1709 -13.020 -3.393 -2.949 1.00 53.24 O ATOM 691 CB LEU A1709 -10.809 -1.051 -3.412 1.00 45.53 C ATOM 692 CG LEU A1709 -10.021 -0.257 -2.374 1.00 71.23 C ATOM 693 CD1 LEU A1709 -9.977 1.187 -2.772 1.00 43.21 C ATOM 694 CD2 LEU A1709 -10.691 -0.369 -1.011 1.00 32.53 C ATOM 0 H LEU A1709 -8.978 -2.531 -4.332 1.00 53.31 H new ATOM 0 HA LEU A1709 -10.714 -2.801 -2.192 1.00 40.14 H new ATOM 0 HB2 LEU A1709 -10.418 -0.806 -4.400 1.00 45.53 H new ATOM 0 HB3 LEU A1709 -11.845 -0.714 -3.387 1.00 45.53 H new ATOM 0 HG LEU A1709 -9.010 -0.660 -2.319 1.00 71.23 H new ATOM 0 HD11 LEU A1709 -9.414 1.752 -2.029 1.00 43.21 H new ATOM 0 HD12 LEU A1709 -9.493 1.282 -3.744 1.00 43.21 H new ATOM 0 HD13 LEU A1709 -10.992 1.579 -2.833 1.00 43.21 H new ATOM 0 HD21 LEU A1709 -10.121 0.201 -0.277 1.00 32.53 H new ATOM 0 HD22 LEU A1709 -11.705 0.027 -1.070 1.00 32.53 H new ATOM 0 HD23 LEU A1709 -10.728 -1.416 -0.708 1.00 32.53 H new ATOM 706 N GLU A1710 -12.172 -3.413 -5.045 1.00 31.13 N ATOM 707 CA GLU A1710 -13.369 -3.979 -5.615 1.00 11.11 C ATOM 708 C GLU A1710 -13.615 -5.389 -5.054 1.00 63.35 C ATOM 709 O GLU A1710 -14.720 -5.687 -4.582 1.00 50.15 O ATOM 710 CB GLU A1710 -13.330 -3.978 -7.158 1.00 51.11 C ATOM 711 CG GLU A1710 -12.158 -4.736 -7.752 1.00 73.33 C ATOM 712 CD GLU A1710 -12.216 -4.886 -9.248 1.00 12.32 C ATOM 713 OE1 GLU A1710 -11.817 -3.961 -9.968 1.00 50.24 O ATOM 714 OE2 GLU A1710 -12.638 -5.970 -9.730 1.00 63.11 O ATOM 0 H GLU A1710 -11.420 -3.241 -5.712 1.00 31.13 H new ATOM 0 HA GLU A1710 -14.209 -3.347 -5.326 1.00 11.11 H new ATOM 0 HB2 GLU A1710 -14.257 -4.412 -7.534 1.00 51.11 H new ATOM 0 HB3 GLU A1710 -13.296 -2.946 -7.509 1.00 51.11 H new ATOM 0 HG2 GLU A1710 -11.234 -4.222 -7.485 1.00 73.33 H new ATOM 0 HG3 GLU A1710 -12.114 -5.727 -7.300 1.00 73.33 H new ATOM 721 N LYS A1711 -12.552 -6.213 -5.018 1.00 14.32 N ATOM 722 CA LYS A1711 -12.657 -7.590 -4.547 1.00 2.20 C ATOM 723 C LYS A1711 -12.843 -7.649 -3.054 1.00 33.15 C ATOM 724 O LYS A1711 -13.521 -8.529 -2.549 1.00 13.32 O ATOM 725 CB LYS A1711 -11.466 -8.467 -4.991 1.00 63.11 C ATOM 726 CG LYS A1711 -10.104 -8.091 -4.463 1.00 61.34 C ATOM 727 CD LYS A1711 -9.065 -9.174 -4.769 1.00 61.54 C ATOM 728 CE LYS A1711 -9.044 -9.602 -6.248 1.00 1.11 C ATOM 729 NZ LYS A1711 -8.696 -8.497 -7.167 1.00 64.32 N ATOM 0 H LYS A1711 -11.614 -5.941 -5.311 1.00 14.32 H new ATOM 0 HA LYS A1711 -13.547 -8.006 -5.019 1.00 2.20 H new ATOM 0 HB2 LYS A1711 -11.673 -9.495 -4.693 1.00 63.11 H new ATOM 0 HB3 LYS A1711 -11.423 -8.453 -6.080 1.00 63.11 H new ATOM 0 HG2 LYS A1711 -9.788 -7.147 -4.907 1.00 61.34 H new ATOM 0 HG3 LYS A1711 -10.161 -7.934 -3.386 1.00 61.34 H new ATOM 0 HD2 LYS A1711 -8.077 -8.808 -4.491 1.00 61.54 H new ATOM 0 HD3 LYS A1711 -9.268 -10.047 -4.149 1.00 61.54 H new ATOM 0 HE2 LYS A1711 -8.326 -10.412 -6.375 1.00 1.11 H new ATOM 0 HE3 LYS A1711 -10.023 -9.998 -6.519 1.00 1.11 H new ATOM 0 HZ1 LYS A1711 -9.033 -8.723 -8.125 1.00 64.32 H new ATOM 0 HZ2 LYS A1711 -9.146 -7.618 -6.840 1.00 64.32 H new ATOM 0 HZ3 LYS A1711 -7.664 -8.371 -7.184 1.00 64.32 H new ATOM 743 N LYS A1712 -12.268 -6.700 -2.353 1.00 23.43 N ATOM 744 CA LYS A1712 -12.425 -6.635 -0.925 1.00 62.04 C ATOM 745 C LYS A1712 -13.844 -6.292 -0.567 1.00 73.01 C ATOM 746 O LYS A1712 -14.417 -6.896 0.322 1.00 43.23 O ATOM 747 CB LYS A1712 -11.421 -5.679 -0.267 1.00 63.43 C ATOM 748 CG LYS A1712 -9.994 -6.197 -0.280 1.00 23.33 C ATOM 749 CD LYS A1712 -9.880 -7.433 0.575 1.00 54.33 C ATOM 750 CE LYS A1712 -8.541 -8.121 0.454 1.00 31.23 C ATOM 751 NZ LYS A1712 -8.569 -9.409 1.176 1.00 64.21 N ATOM 0 H LYS A1712 -11.687 -5.963 -2.752 1.00 23.43 H new ATOM 0 HA LYS A1712 -12.203 -7.624 -0.525 1.00 62.04 H new ATOM 0 HB2 LYS A1712 -11.455 -4.719 -0.781 1.00 63.43 H new ATOM 0 HB3 LYS A1712 -11.725 -5.499 0.764 1.00 63.43 H new ATOM 0 HG2 LYS A1712 -9.691 -6.424 -1.302 1.00 23.33 H new ATOM 0 HG3 LYS A1712 -9.317 -5.427 0.089 1.00 23.33 H new ATOM 0 HD2 LYS A1712 -10.049 -7.162 1.617 1.00 54.33 H new ATOM 0 HD3 LYS A1712 -10.667 -8.133 0.296 1.00 54.33 H new ATOM 0 HE2 LYS A1712 -8.302 -8.288 -0.596 1.00 31.23 H new ATOM 0 HE3 LYS A1712 -7.757 -7.483 0.861 1.00 31.23 H new ATOM 0 HZ1 LYS A1712 -7.661 -9.900 1.046 1.00 64.21 H new ATOM 0 HZ2 LYS A1712 -8.727 -9.236 2.189 1.00 64.21 H new ATOM 0 HZ3 LYS A1712 -9.339 -10.000 0.802 1.00 64.21 H new ATOM 765 N THR A1713 -14.426 -5.359 -1.290 1.00 51.22 N ATOM 766 CA THR A1713 -15.803 -5.001 -1.059 1.00 32.44 C ATOM 767 C THR A1713 -16.712 -6.211 -1.403 1.00 1.44 C ATOM 768 O THR A1713 -17.722 -6.468 -0.724 1.00 22.33 O ATOM 769 CB THR A1713 -16.206 -3.757 -1.886 1.00 34.50 C ATOM 770 OG1 THR A1713 -15.299 -2.670 -1.618 1.00 51.45 O ATOM 771 CG2 THR A1713 -17.608 -3.308 -1.531 1.00 43.33 C ATOM 0 H THR A1713 -13.967 -4.839 -2.038 1.00 51.22 H new ATOM 0 HA THR A1713 -15.928 -4.744 -0.007 1.00 32.44 H new ATOM 0 HB THR A1713 -16.166 -4.030 -2.941 1.00 34.50 H new ATOM 0 HG1 THR A1713 -14.496 -2.770 -2.171 1.00 51.45 H new ATOM 0 HG21 THR A1713 -17.871 -2.432 -2.124 1.00 43.33 H new ATOM 0 HG22 THR A1713 -18.312 -4.113 -1.741 1.00 43.33 H new ATOM 0 HG23 THR A1713 -17.652 -3.055 -0.472 1.00 43.33 H new ATOM 779 N GLU A1714 -16.315 -6.970 -2.429 1.00 62.24 N ATOM 780 CA GLU A1714 -17.022 -8.174 -2.806 1.00 23.13 C ATOM 781 C GLU A1714 -16.939 -9.220 -1.703 1.00 20.12 C ATOM 782 O GLU A1714 -17.961 -9.704 -1.240 1.00 41.13 O ATOM 783 CB GLU A1714 -16.482 -8.775 -4.103 1.00 32.11 C ATOM 784 CG GLU A1714 -16.739 -7.964 -5.354 1.00 34.35 C ATOM 785 CD GLU A1714 -16.266 -8.693 -6.583 1.00 34.41 C ATOM 786 OE1 GLU A1714 -16.961 -9.637 -7.022 1.00 64.54 O ATOM 787 OE2 GLU A1714 -15.199 -8.361 -7.128 1.00 73.12 O ATOM 0 H GLU A1714 -15.502 -6.761 -3.009 1.00 62.24 H new ATOM 0 HA GLU A1714 -18.061 -7.887 -2.964 1.00 23.13 H new ATOM 0 HB2 GLU A1714 -15.406 -8.916 -3.997 1.00 32.11 H new ATOM 0 HB3 GLU A1714 -16.922 -9.764 -4.235 1.00 32.11 H new ATOM 0 HG2 GLU A1714 -17.805 -7.753 -5.441 1.00 34.35 H new ATOM 0 HG3 GLU A1714 -16.229 -7.004 -5.279 1.00 34.35 H new ATOM 794 N GLU A1715 -15.729 -9.533 -1.257 1.00 52.03 N ATOM 795 CA GLU A1715 -15.523 -10.552 -0.239 1.00 21.24 C ATOM 796 C GLU A1715 -16.174 -10.141 1.075 1.00 24.51 C ATOM 797 O GLU A1715 -16.631 -10.977 1.821 1.00 24.11 O ATOM 798 CB GLU A1715 -14.034 -10.883 -0.033 1.00 23.13 C ATOM 799 CG GLU A1715 -13.238 -9.852 0.717 1.00 31.54 C ATOM 800 CD GLU A1715 -11.830 -10.311 0.992 1.00 64.43 C ATOM 801 OE1 GLU A1715 -10.968 -10.217 0.111 1.00 22.43 O ATOM 802 OE2 GLU A1715 -11.554 -10.776 2.102 1.00 14.35 O ATOM 0 H GLU A1715 -14.871 -9.092 -1.588 1.00 52.03 H new ATOM 0 HA GLU A1715 -16.003 -11.463 -0.597 1.00 21.24 H new ATOM 0 HB2 GLU A1715 -13.961 -11.831 0.500 1.00 23.13 H new ATOM 0 HB3 GLU A1715 -13.574 -11.031 -1.010 1.00 23.13 H new ATOM 0 HG2 GLU A1715 -13.211 -8.927 0.141 1.00 31.54 H new ATOM 0 HG3 GLU A1715 -13.736 -9.626 1.660 1.00 31.54 H new ATOM 809 N PHE A1716 -16.219 -8.859 1.322 1.00 44.10 N ATOM 810 CA PHE A1716 -16.879 -8.282 2.483 1.00 40.13 C ATOM 811 C PHE A1716 -18.351 -8.702 2.562 1.00 70.21 C ATOM 812 O PHE A1716 -18.777 -9.313 3.544 1.00 60.22 O ATOM 813 CB PHE A1716 -16.715 -6.745 2.428 1.00 24.53 C ATOM 814 CG PHE A1716 -17.652 -5.915 3.269 1.00 74.34 C ATOM 815 CD1 PHE A1716 -17.819 -6.150 4.619 1.00 23.20 C ATOM 816 CD2 PHE A1716 -18.354 -4.874 2.681 1.00 1.24 C ATOM 817 CE1 PHE A1716 -18.672 -5.364 5.368 1.00 32.41 C ATOM 818 CE2 PHE A1716 -19.202 -4.087 3.418 1.00 70.00 C ATOM 819 CZ PHE A1716 -19.365 -4.331 4.768 1.00 43.12 C ATOM 0 H PHE A1716 -15.790 -8.163 0.712 1.00 44.10 H new ATOM 0 HA PHE A1716 -16.413 -8.658 3.394 1.00 40.13 H new ATOM 0 HB2 PHE A1716 -15.694 -6.505 2.725 1.00 24.53 H new ATOM 0 HB3 PHE A1716 -16.827 -6.432 1.390 1.00 24.53 H new ATOM 0 HD1 PHE A1716 -17.278 -6.955 5.093 1.00 23.20 H new ATOM 0 HD2 PHE A1716 -18.231 -4.680 1.626 1.00 1.24 H new ATOM 0 HE1 PHE A1716 -18.797 -5.557 6.423 1.00 32.41 H new ATOM 0 HE2 PHE A1716 -19.740 -3.279 2.944 1.00 70.00 H new ATOM 0 HZ PHE A1716 -20.033 -3.716 5.353 1.00 43.12 H new ATOM 829 N LYS A1717 -19.095 -8.428 1.520 1.00 73.13 N ATOM 830 CA LYS A1717 -20.530 -8.695 1.530 1.00 10.03 C ATOM 831 C LYS A1717 -20.889 -10.098 1.041 1.00 20.03 C ATOM 832 O LYS A1717 -21.995 -10.586 1.294 1.00 4.10 O ATOM 833 CB LYS A1717 -21.284 -7.612 0.753 1.00 21.54 C ATOM 834 CG LYS A1717 -20.869 -7.463 -0.708 1.00 3.22 C ATOM 835 CD LYS A1717 -21.499 -6.230 -1.355 1.00 44.01 C ATOM 836 CE LYS A1717 -21.045 -4.948 -0.662 1.00 75.03 C ATOM 837 NZ LYS A1717 -21.588 -3.726 -1.290 1.00 50.32 N ATOM 0 H LYS A1717 -18.743 -8.022 0.653 1.00 73.13 H new ATOM 0 HA LYS A1717 -20.849 -8.660 2.572 1.00 10.03 H new ATOM 0 HB2 LYS A1717 -22.351 -7.833 0.792 1.00 21.54 H new ATOM 0 HB3 LYS A1717 -21.138 -6.656 1.256 1.00 21.54 H new ATOM 0 HG2 LYS A1717 -19.783 -7.392 -0.772 1.00 3.22 H new ATOM 0 HG3 LYS A1717 -21.163 -8.354 -1.262 1.00 3.22 H new ATOM 0 HD2 LYS A1717 -21.228 -6.191 -2.410 1.00 44.01 H new ATOM 0 HD3 LYS A1717 -22.585 -6.307 -1.308 1.00 44.01 H new ATOM 0 HE2 LYS A1717 -21.352 -4.979 0.383 1.00 75.03 H new ATOM 0 HE3 LYS A1717 -19.956 -4.902 -0.673 1.00 75.03 H new ATOM 0 HZ1 LYS A1717 -21.635 -2.964 -0.584 1.00 50.32 H new ATOM 0 HZ2 LYS A1717 -20.970 -3.434 -2.074 1.00 50.32 H new ATOM 0 HZ3 LYS A1717 -22.542 -3.918 -1.655 1.00 50.32 H new ATOM 851 N GLN A1718 -19.982 -10.732 0.336 1.00 13.21 N ATOM 852 CA GLN A1718 -20.226 -12.069 -0.188 1.00 35.32 C ATOM 853 C GLN A1718 -19.664 -13.162 0.700 1.00 33.24 C ATOM 854 O GLN A1718 -20.382 -14.071 1.102 1.00 12.50 O ATOM 855 CB GLN A1718 -19.692 -12.214 -1.613 1.00 73.32 C ATOM 856 CG GLN A1718 -20.495 -11.439 -2.637 1.00 4.43 C ATOM 857 CD GLN A1718 -19.966 -11.595 -4.045 1.00 55.34 C ATOM 858 OE1 GLN A1718 -20.348 -12.504 -4.769 1.00 32.13 O ATOM 859 NE2 GLN A1718 -19.124 -10.695 -4.461 1.00 1.12 N ATOM 0 H GLN A1718 -19.065 -10.349 0.108 1.00 13.21 H new ATOM 0 HA GLN A1718 -21.309 -12.194 -0.204 1.00 35.32 H new ATOM 0 HB2 GLN A1718 -18.657 -11.875 -1.642 1.00 73.32 H new ATOM 0 HB3 GLN A1718 -19.689 -13.269 -1.887 1.00 73.32 H new ATOM 0 HG2 GLN A1718 -21.532 -11.773 -2.606 1.00 4.43 H new ATOM 0 HG3 GLN A1718 -20.492 -10.383 -2.369 1.00 4.43 H new ATOM 0 HE21 GLN A1718 -18.824 -9.949 -3.834 1.00 1.12 H new ATOM 0 HE22 GLN A1718 -18.764 -10.736 -5.414 1.00 1.12 H new ATOM 868 N ASN A1719 -18.398 -13.063 1.013 1.00 54.43 N ATOM 869 CA ASN A1719 -17.718 -14.107 1.776 1.00 42.12 C ATOM 870 C ASN A1719 -17.800 -13.844 3.266 1.00 62.13 C ATOM 871 O ASN A1719 -17.949 -14.768 4.077 1.00 23.15 O ATOM 872 CB ASN A1719 -16.244 -14.233 1.352 1.00 32.23 C ATOM 873 CG ASN A1719 -16.067 -14.642 -0.102 1.00 23.44 C ATOM 874 OD1 ASN A1719 -16.904 -15.322 -0.681 1.00 73.44 O ATOM 875 ND2 ASN A1719 -14.975 -14.246 -0.683 1.00 62.34 N ATOM 0 H ASN A1719 -17.806 -12.273 0.756 1.00 54.43 H new ATOM 0 HA ASN A1719 -18.228 -15.046 1.560 1.00 42.12 H new ATOM 0 HB2 ASN A1719 -15.743 -13.279 1.517 1.00 32.23 H new ATOM 0 HB3 ASN A1719 -15.751 -14.966 1.991 1.00 32.23 H new ATOM 0 HD21 ASN A1719 -14.792 -14.501 -1.654 1.00 62.34 H new ATOM 0 HD22 ASN A1719 -14.300 -13.680 -0.169 1.00 62.34 H new ATOM 882 N GLY A1720 -17.708 -12.594 3.622 1.00 21.34 N ATOM 883 CA GLY A1720 -17.746 -12.197 4.996 1.00 31.41 C ATOM 884 C GLY A1720 -16.363 -11.924 5.524 1.00 41.24 C ATOM 885 O GLY A1720 -16.001 -12.396 6.607 1.00 42.53 O ATOM 0 H GLY A1720 -17.604 -11.822 2.964 1.00 21.34 H new ATOM 0 HA2 GLY A1720 -18.361 -11.303 5.102 1.00 31.41 H new ATOM 0 HA3 GLY A1720 -18.217 -12.980 5.590 1.00 31.41 H new ATOM 889 N GLY A1721 -15.581 -11.182 4.762 1.00 63.10 N ATOM 890 CA GLY A1721 -14.232 -10.844 5.183 1.00 60.13 C ATOM 891 C GLY A1721 -14.218 -9.638 6.103 1.00 72.01 C ATOM 892 O GLY A1721 -15.217 -9.352 6.773 1.00 74.33 O ATOM 0 H GLY A1721 -15.853 -10.804 3.855 1.00 63.10 H new ATOM 0 HA2 GLY A1721 -13.786 -11.697 5.694 1.00 60.13 H new ATOM 0 HA3 GLY A1721 -13.617 -10.640 4.306 1.00 60.13 H new ATOM 896 N LYS A1722 -13.111 -8.937 6.148 1.00 33.10 N ATOM 897 CA LYS A1722 -13.001 -7.747 6.962 1.00 41.12 C ATOM 898 C LYS A1722 -13.810 -6.632 6.320 1.00 24.11 C ATOM 899 O LYS A1722 -13.782 -6.472 5.109 1.00 1.11 O ATOM 900 CB LYS A1722 -11.543 -7.291 7.083 1.00 71.31 C ATOM 901 CG LYS A1722 -10.586 -8.303 7.686 1.00 2.34 C ATOM 902 CD LYS A1722 -10.899 -8.597 9.135 1.00 62.14 C ATOM 903 CE LYS A1722 -9.923 -9.613 9.690 1.00 33.31 C ATOM 904 NZ LYS A1722 -10.138 -9.864 11.123 1.00 65.25 N ATOM 0 H LYS A1722 -12.266 -9.171 5.627 1.00 33.10 H new ATOM 0 HA LYS A1722 -13.378 -7.976 7.959 1.00 41.12 H new ATOM 0 HB2 LYS A1722 -11.182 -7.023 6.090 1.00 71.31 H new ATOM 0 HB3 LYS A1722 -11.514 -6.385 7.688 1.00 71.31 H new ATOM 0 HG2 LYS A1722 -10.631 -9.229 7.112 1.00 2.34 H new ATOM 0 HG3 LYS A1722 -9.566 -7.927 7.606 1.00 2.34 H new ATOM 0 HD2 LYS A1722 -10.848 -7.678 9.718 1.00 62.14 H new ATOM 0 HD3 LYS A1722 -11.917 -8.975 9.224 1.00 62.14 H new ATOM 0 HE2 LYS A1722 -10.023 -10.549 9.140 1.00 33.31 H new ATOM 0 HE3 LYS A1722 -8.904 -9.259 9.534 1.00 33.31 H new ATOM 0 HZ1 LYS A1722 -9.448 -10.565 11.460 1.00 65.25 H new ATOM 0 HZ2 LYS A1722 -10.017 -8.977 11.653 1.00 65.25 H new ATOM 0 HZ3 LYS A1722 -11.101 -10.227 11.271 1.00 65.25 H new ATOM 918 N PRO A1723 -14.524 -5.845 7.118 1.00 0.23 N ATOM 919 CA PRO A1723 -15.341 -4.730 6.620 1.00 42.11 C ATOM 920 C PRO A1723 -14.502 -3.500 6.231 1.00 40.13 C ATOM 921 O PRO A1723 -15.044 -2.440 5.901 1.00 74.24 O ATOM 922 CB PRO A1723 -16.237 -4.398 7.820 1.00 23.13 C ATOM 923 CG PRO A1723 -15.438 -4.803 9.011 1.00 44.25 C ATOM 924 CD PRO A1723 -14.630 -5.996 8.581 1.00 33.03 C ATOM 0 HA PRO A1723 -15.882 -4.998 5.712 1.00 42.11 H new ATOM 0 HB2 PRO A1723 -16.482 -3.336 7.850 1.00 23.13 H new ATOM 0 HB3 PRO A1723 -17.181 -4.942 7.772 1.00 23.13 H new ATOM 0 HG2 PRO A1723 -14.790 -3.991 9.341 1.00 44.25 H new ATOM 0 HG3 PRO A1723 -16.087 -5.053 9.850 1.00 44.25 H new ATOM 0 HD2 PRO A1723 -13.648 -6.005 9.054 1.00 33.03 H new ATOM 0 HD3 PRO A1723 -15.122 -6.930 8.851 1.00 33.03 H new ATOM 932 N TYR A1724 -13.202 -3.657 6.233 1.00 33.14 N ATOM 933 CA TYR A1724 -12.296 -2.571 5.975 1.00 20.44 C ATOM 934 C TYR A1724 -11.123 -3.058 5.158 1.00 50.01 C ATOM 935 O TYR A1724 -10.941 -4.264 4.980 1.00 44.22 O ATOM 936 CB TYR A1724 -11.777 -1.976 7.307 1.00 11.14 C ATOM 937 CG TYR A1724 -10.979 -2.946 8.170 1.00 12.42 C ATOM 938 CD1 TYR A1724 -11.618 -3.862 8.987 1.00 74.24 C ATOM 939 CD2 TYR A1724 -9.589 -2.941 8.159 1.00 5.12 C ATOM 940 CE1 TYR A1724 -10.906 -4.746 9.762 1.00 43.31 C ATOM 941 CE2 TYR A1724 -8.869 -3.823 8.937 1.00 64.13 C ATOM 942 CZ TYR A1724 -9.537 -4.725 9.737 1.00 51.11 C ATOM 943 OH TYR A1724 -8.833 -5.617 10.512 1.00 51.10 O ATOM 0 H TYR A1724 -12.742 -4.549 6.415 1.00 33.14 H new ATOM 0 HA TYR A1724 -12.831 -1.800 5.421 1.00 20.44 H new ATOM 0 HB2 TYR A1724 -11.152 -1.111 7.084 1.00 11.14 H new ATOM 0 HB3 TYR A1724 -12.628 -1.614 7.884 1.00 11.14 H new ATOM 0 HD1 TYR A1724 -12.697 -3.883 9.016 1.00 74.24 H new ATOM 0 HD2 TYR A1724 -9.065 -2.235 7.531 1.00 5.12 H new ATOM 0 HE1 TYR A1724 -11.425 -5.456 10.389 1.00 43.31 H new ATOM 0 HE2 TYR A1724 -7.789 -3.807 8.920 1.00 64.13 H new ATOM 0 HH TYR A1724 -7.872 -5.476 10.382 1.00 51.10 H new ATOM 953 N LEU A1725 -10.354 -2.129 4.680 1.00 53.24 N ATOM 954 CA LEU A1725 -9.123 -2.376 4.001 1.00 34.42 C ATOM 955 C LEU A1725 -8.162 -1.280 4.421 1.00 20.32 C ATOM 956 O LEU A1725 -8.440 -0.098 4.246 1.00 72.34 O ATOM 957 CB LEU A1725 -9.306 -2.375 2.471 1.00 20.23 C ATOM 958 CG LEU A1725 -8.057 -2.740 1.642 1.00 30.21 C ATOM 959 CD1 LEU A1725 -7.610 -4.155 1.935 1.00 72.11 C ATOM 960 CD2 LEU A1725 -8.315 -2.576 0.164 1.00 45.22 C ATOM 0 H LEU A1725 -10.578 -1.137 4.756 1.00 53.24 H new ATOM 0 HA LEU A1725 -8.741 -3.362 4.265 1.00 34.42 H new ATOM 0 HB2 LEU A1725 -10.102 -3.075 2.219 1.00 20.23 H new ATOM 0 HB3 LEU A1725 -9.644 -1.385 2.166 1.00 20.23 H new ATOM 0 HG LEU A1725 -7.261 -2.054 1.931 1.00 30.21 H new ATOM 0 HD11 LEU A1725 -6.728 -4.389 1.339 1.00 72.11 H new ATOM 0 HD12 LEU A1725 -7.367 -4.248 2.994 1.00 72.11 H new ATOM 0 HD13 LEU A1725 -8.412 -4.849 1.684 1.00 72.11 H new ATOM 0 HD21 LEU A1725 -7.417 -2.841 -0.394 1.00 45.22 H new ATOM 0 HD22 LEU A1725 -9.134 -3.229 -0.137 1.00 45.22 H new ATOM 0 HD23 LEU A1725 -8.581 -1.540 -0.046 1.00 45.22 H new ATOM 972 N SER A1726 -7.076 -1.655 4.999 1.00 4.31 N ATOM 973 CA SER A1726 -6.116 -0.708 5.461 1.00 62.23 C ATOM 974 C SER A1726 -5.109 -0.493 4.347 1.00 13.33 C ATOM 975 O SER A1726 -4.450 -1.426 3.923 1.00 35.31 O ATOM 976 CB SER A1726 -5.448 -1.250 6.735 1.00 52.05 C ATOM 977 OG SER A1726 -4.546 -0.318 7.327 1.00 43.04 O ATOM 0 H SER A1726 -6.825 -2.629 5.167 1.00 4.31 H new ATOM 0 HA SER A1726 -6.579 0.246 5.711 1.00 62.23 H new ATOM 0 HB2 SER A1726 -6.219 -1.513 7.460 1.00 52.05 H new ATOM 0 HB3 SER A1726 -4.910 -2.167 6.495 1.00 52.05 H new ATOM 0 HG SER A1726 -4.151 -0.712 8.133 1.00 43.04 H new ATOM 983 N VAL A1727 -5.034 0.721 3.858 1.00 54.13 N ATOM 984 CA VAL A1727 -4.181 1.061 2.748 1.00 21.11 C ATOM 985 C VAL A1727 -2.975 1.861 3.219 1.00 33.41 C ATOM 986 O VAL A1727 -3.092 3.018 3.648 1.00 21.43 O ATOM 987 CB VAL A1727 -4.952 1.870 1.669 1.00 73.32 C ATOM 988 CG1 VAL A1727 -4.041 2.246 0.504 1.00 42.13 C ATOM 989 CG2 VAL A1727 -6.161 1.089 1.172 1.00 34.55 C ATOM 0 H VAL A1727 -5.570 1.508 4.224 1.00 54.13 H new ATOM 0 HA VAL A1727 -3.840 0.126 2.303 1.00 21.11 H new ATOM 0 HB VAL A1727 -5.303 2.792 2.132 1.00 73.32 H new ATOM 0 HG11 VAL A1727 -4.609 2.811 -0.235 1.00 42.13 H new ATOM 0 HG12 VAL A1727 -3.215 2.855 0.870 1.00 42.13 H new ATOM 0 HG13 VAL A1727 -3.647 1.340 0.043 1.00 42.13 H new ATOM 0 HG21 VAL A1727 -6.687 1.674 0.417 1.00 34.55 H new ATOM 0 HG22 VAL A1727 -5.831 0.146 0.736 1.00 34.55 H new ATOM 0 HG23 VAL A1727 -6.832 0.887 2.007 1.00 34.55 H new ATOM 999 N ILE A1728 -1.840 1.255 3.158 1.00 2.24 N ATOM 1000 CA ILE A1728 -0.626 1.924 3.518 1.00 71.02 C ATOM 1001 C ILE A1728 -0.047 2.541 2.257 1.00 40.53 C ATOM 1002 O ILE A1728 0.443 1.835 1.372 1.00 11.52 O ATOM 1003 CB ILE A1728 0.429 0.987 4.220 1.00 31.14 C ATOM 1004 CG1 ILE A1728 -0.046 0.494 5.613 1.00 51.15 C ATOM 1005 CG2 ILE A1728 1.768 1.689 4.370 1.00 42.13 C ATOM 1006 CD1 ILE A1728 -1.205 -0.486 5.607 1.00 53.21 C ATOM 0 H ILE A1728 -1.721 0.287 2.860 1.00 2.24 H new ATOM 0 HA ILE A1728 -0.862 2.687 4.259 1.00 71.02 H new ATOM 0 HB ILE A1728 0.540 0.118 3.572 1.00 31.14 H new ATOM 0 HG12 ILE A1728 0.798 0.026 6.119 1.00 51.15 H new ATOM 0 HG13 ILE A1728 -0.332 1.362 6.207 1.00 51.15 H new ATOM 0 HG21 ILE A1728 2.477 1.020 4.857 1.00 42.13 H new ATOM 0 HG22 ILE A1728 2.147 1.965 3.386 1.00 42.13 H new ATOM 0 HG23 ILE A1728 1.642 2.587 4.975 1.00 42.13 H new ATOM 0 HD11 ILE A1728 -1.453 -0.763 6.632 1.00 53.21 H new ATOM 0 HD12 ILE A1728 -2.072 -0.022 5.137 1.00 53.21 H new ATOM 0 HD13 ILE A1728 -0.924 -1.379 5.048 1.00 53.21 H new ATOM 1018 N THR A1729 -0.160 3.846 2.156 1.00 73.33 N ATOM 1019 CA THR A1729 0.288 4.553 0.991 1.00 1.30 C ATOM 1020 C THR A1729 1.741 4.918 1.108 1.00 63.32 C ATOM 1021 O THR A1729 2.470 4.959 0.120 1.00 14.11 O ATOM 1022 CB THR A1729 -0.519 5.845 0.785 1.00 64.11 C ATOM 1023 OG1 THR A1729 -0.482 6.647 1.986 1.00 0.43 O ATOM 1024 CG2 THR A1729 -1.956 5.551 0.457 1.00 14.14 C ATOM 0 H THR A1729 -0.564 4.440 2.880 1.00 73.33 H new ATOM 0 HA THR A1729 0.142 3.888 0.140 1.00 1.30 H new ATOM 0 HB THR A1729 -0.066 6.382 -0.049 1.00 64.11 H new ATOM 0 HG1 THR A1729 -0.035 6.146 2.700 1.00 0.43 H new ATOM 0 HG21 THR A1729 -2.496 6.487 0.318 1.00 14.14 H new ATOM 0 HG22 THR A1729 -2.007 4.963 -0.459 1.00 14.14 H new ATOM 0 HG23 THR A1729 -2.408 4.989 1.274 1.00 14.14 H new ATOM 1169 N ARG A1741 3.233 10.996 -2.497 1.00 70.51 N ATOM 1170 CA ARG A1741 2.105 11.452 -3.345 1.00 1.51 C ATOM 1171 C ARG A1741 1.076 10.381 -3.551 1.00 30.45 C ATOM 1172 O ARG A1741 -0.011 10.633 -4.067 1.00 32.40 O ATOM 1173 CB ARG A1741 2.570 11.902 -4.686 1.00 21.43 C ATOM 1174 CG ARG A1741 3.571 13.001 -4.663 1.00 13.12 C ATOM 1175 CD ARG A1741 3.787 13.482 -6.054 1.00 31.22 C ATOM 1176 NE ARG A1741 4.159 12.387 -6.971 1.00 61.10 N ATOM 1177 CZ ARG A1741 5.301 12.310 -7.668 1.00 14.14 C ATOM 1178 NH1 ARG A1741 6.248 13.248 -7.526 1.00 24.53 N ATOM 1179 NH2 ARG A1741 5.491 11.288 -8.507 1.00 45.42 N ATOM 0 HA ARG A1741 1.657 12.286 -2.805 1.00 1.51 H new ATOM 0 HB2 ARG A1741 3.000 11.049 -5.211 1.00 21.43 H new ATOM 0 HB3 ARG A1741 1.706 12.229 -5.264 1.00 21.43 H new ATOM 0 HG2 ARG A1741 3.221 13.817 -4.032 1.00 13.12 H new ATOM 0 HG3 ARG A1741 4.510 12.648 -4.236 1.00 13.12 H new ATOM 0 HD2 ARG A1741 2.878 13.963 -6.415 1.00 31.22 H new ATOM 0 HD3 ARG A1741 4.572 14.239 -6.057 1.00 31.22 H new ATOM 0 HE ARG A1741 3.491 11.625 -7.084 1.00 61.10 H new ATOM 0 HH11 ARG A1741 6.102 14.027 -6.884 1.00 24.53 H new ATOM 0 HH12 ARG A1741 7.115 13.183 -8.060 1.00 24.53 H new ATOM 0 HH21 ARG A1741 4.770 10.574 -8.613 1.00 45.42 H new ATOM 0 HH22 ARG A1741 6.357 11.221 -9.042 1.00 45.42 H new ATOM 1193 N ILE A1742 1.442 9.194 -3.193 1.00 20.15 N ATOM 1194 CA ILE A1742 0.543 8.066 -3.206 1.00 21.21 C ATOM 1195 C ILE A1742 -0.683 8.390 -2.341 1.00 63.24 C ATOM 1196 O ILE A1742 -1.794 8.062 -2.702 1.00 1.22 O ATOM 1197 CB ILE A1742 1.242 6.788 -2.676 1.00 13.41 C ATOM 1198 CG1 ILE A1742 2.491 6.491 -3.509 1.00 2.41 C ATOM 1199 CG2 ILE A1742 0.287 5.598 -2.717 1.00 71.52 C ATOM 1200 CD1 ILE A1742 3.283 5.308 -3.017 1.00 73.12 C ATOM 0 H ILE A1742 2.385 8.968 -2.877 1.00 20.15 H new ATOM 0 HA ILE A1742 0.233 7.877 -4.234 1.00 21.21 H new ATOM 0 HB ILE A1742 1.537 6.957 -1.641 1.00 13.41 H new ATOM 0 HG12 ILE A1742 2.193 6.313 -4.542 1.00 2.41 H new ATOM 0 HG13 ILE A1742 3.134 7.371 -3.510 1.00 2.41 H new ATOM 0 HG21 ILE A1742 0.796 4.710 -2.341 1.00 71.52 H new ATOM 0 HG22 ILE A1742 -0.583 5.808 -2.095 1.00 71.52 H new ATOM 0 HG23 ILE A1742 -0.034 5.425 -3.744 1.00 71.52 H new ATOM 0 HD11 ILE A1742 4.152 5.160 -3.658 1.00 73.12 H new ATOM 0 HD12 ILE A1742 3.613 5.491 -1.994 1.00 73.12 H new ATOM 0 HD13 ILE A1742 2.658 4.416 -3.043 1.00 73.12 H new ATOM 1212 N LYS A1743 -0.463 9.114 -1.240 1.00 64.24 N ATOM 1213 CA LYS A1743 -1.533 9.483 -0.347 1.00 40.31 C ATOM 1214 C LYS A1743 -2.591 10.376 -1.056 1.00 31.05 C ATOM 1215 O LYS A1743 -3.738 9.960 -1.135 1.00 53.33 O ATOM 1216 CB LYS A1743 -0.972 10.123 0.944 1.00 71.13 C ATOM 1217 CG LYS A1743 -2.018 10.698 1.883 1.00 71.30 C ATOM 1218 CD LYS A1743 -1.364 11.337 3.091 1.00 55.25 C ATOM 1219 CE LYS A1743 -2.374 12.086 3.943 1.00 72.04 C ATOM 1220 NZ LYS A1743 -1.746 12.676 5.139 1.00 21.31 N ATOM 0 H LYS A1743 0.457 9.452 -0.956 1.00 64.24 H new ATOM 0 HA LYS A1743 -2.059 8.576 -0.049 1.00 40.31 H new ATOM 0 HB2 LYS A1743 -0.396 9.371 1.483 1.00 71.13 H new ATOM 0 HB3 LYS A1743 -0.279 10.917 0.666 1.00 71.13 H new ATOM 0 HG2 LYS A1743 -2.619 11.438 1.355 1.00 71.30 H new ATOM 0 HG3 LYS A1743 -2.696 9.908 2.206 1.00 71.30 H new ATOM 0 HD2 LYS A1743 -0.879 10.568 3.692 1.00 55.25 H new ATOM 0 HD3 LYS A1743 -0.584 12.024 2.762 1.00 55.25 H new ATOM 0 HE2 LYS A1743 -2.838 12.874 3.349 1.00 72.04 H new ATOM 0 HE3 LYS A1743 -3.169 11.406 4.247 1.00 72.04 H new ATOM 0 HZ1 LYS A1743 -2.465 13.179 5.696 1.00 21.31 H new ATOM 0 HZ2 LYS A1743 -1.325 11.922 5.718 1.00 21.31 H new ATOM 0 HZ3 LYS A1743 -1.004 13.344 4.848 1.00 21.31 H new ATOM 1234 N PRO A1744 -2.237 11.582 -1.629 1.00 3.31 N ATOM 1235 CA PRO A1744 -3.218 12.399 -2.356 1.00 70.24 C ATOM 1236 C PRO A1744 -3.842 11.662 -3.554 1.00 25.24 C ATOM 1237 O PRO A1744 -5.038 11.822 -3.837 1.00 24.30 O ATOM 1238 CB PRO A1744 -2.437 13.634 -2.835 1.00 2.43 C ATOM 1239 CG PRO A1744 -0.994 13.329 -2.606 1.00 72.31 C ATOM 1240 CD PRO A1744 -0.935 12.279 -1.528 1.00 35.12 C ATOM 0 HA PRO A1744 -4.057 12.652 -1.708 1.00 70.24 H new ATOM 0 HB2 PRO A1744 -2.630 13.832 -3.889 1.00 2.43 H new ATOM 0 HB3 PRO A1744 -2.739 14.524 -2.283 1.00 2.43 H new ATOM 0 HG2 PRO A1744 -0.525 12.969 -3.522 1.00 72.31 H new ATOM 0 HG3 PRO A1744 -0.453 14.225 -2.302 1.00 72.31 H new ATOM 0 HD2 PRO A1744 -0.103 11.593 -1.685 1.00 35.12 H new ATOM 0 HD3 PRO A1744 -0.798 12.726 -0.543 1.00 35.12 H new ATOM 1248 N ALA A1745 -3.036 10.841 -4.231 1.00 50.42 N ATOM 1249 CA ALA A1745 -3.486 10.085 -5.388 1.00 22.34 C ATOM 1250 C ALA A1745 -4.567 9.095 -4.984 1.00 42.41 C ATOM 1251 O ALA A1745 -5.629 9.009 -5.620 1.00 52.34 O ATOM 1252 CB ALA A1745 -2.316 9.355 -6.019 1.00 62.31 C ATOM 0 H ALA A1745 -2.057 10.686 -3.989 1.00 50.42 H new ATOM 0 HA ALA A1745 -3.905 10.778 -6.118 1.00 22.34 H new ATOM 0 HB1 ALA A1745 -2.663 8.791 -6.885 1.00 62.31 H new ATOM 0 HB2 ALA A1745 -1.563 10.078 -6.334 1.00 62.31 H new ATOM 0 HB3 ALA A1745 -1.879 8.670 -5.292 1.00 62.31 H new ATOM 1258 N VAL A1746 -4.302 8.379 -3.913 1.00 43.21 N ATOM 1259 CA VAL A1746 -5.217 7.402 -3.387 1.00 15.14 C ATOM 1260 C VAL A1746 -6.460 8.055 -2.784 1.00 33.42 C ATOM 1261 O VAL A1746 -7.564 7.637 -3.092 1.00 51.25 O ATOM 1262 CB VAL A1746 -4.504 6.426 -2.393 1.00 1.00 C ATOM 1263 CG1 VAL A1746 -5.485 5.563 -1.629 1.00 31.54 C ATOM 1264 CG2 VAL A1746 -3.568 5.526 -3.173 1.00 13.21 C ATOM 0 H VAL A1746 -3.436 8.463 -3.381 1.00 43.21 H new ATOM 0 HA VAL A1746 -5.567 6.795 -4.222 1.00 15.14 H new ATOM 0 HB VAL A1746 -3.959 7.032 -1.669 1.00 1.00 H new ATOM 0 HG11 VAL A1746 -4.940 4.904 -0.953 1.00 31.54 H new ATOM 0 HG12 VAL A1746 -6.157 6.199 -1.052 1.00 31.54 H new ATOM 0 HG13 VAL A1746 -6.066 4.964 -2.330 1.00 31.54 H new ATOM 0 HG21 VAL A1746 -3.066 4.842 -2.488 1.00 13.21 H new ATOM 0 HG22 VAL A1746 -4.139 4.954 -3.904 1.00 13.21 H new ATOM 0 HG23 VAL A1746 -2.824 6.134 -3.688 1.00 13.21 H new ATOM 1274 N ILE A1747 -6.283 9.123 -1.993 1.00 63.33 N ATOM 1275 CA ILE A1747 -7.417 9.840 -1.367 1.00 33.25 C ATOM 1276 C ILE A1747 -8.473 10.222 -2.418 1.00 30.11 C ATOM 1277 O ILE A1747 -9.679 9.986 -2.228 1.00 11.13 O ATOM 1278 CB ILE A1747 -6.947 11.123 -0.600 1.00 63.05 C ATOM 1279 CG1 ILE A1747 -6.093 10.746 0.618 1.00 43.41 C ATOM 1280 CG2 ILE A1747 -8.135 11.963 -0.165 1.00 53.02 C ATOM 1281 CD1 ILE A1747 -5.554 11.935 1.399 1.00 61.53 C ATOM 0 H ILE A1747 -5.368 9.514 -1.768 1.00 63.33 H new ATOM 0 HA ILE A1747 -7.862 9.156 -0.644 1.00 33.25 H new ATOM 0 HB ILE A1747 -6.338 11.715 -1.284 1.00 63.05 H new ATOM 0 HG12 ILE A1747 -6.690 10.127 1.288 1.00 43.41 H new ATOM 0 HG13 ILE A1747 -5.254 10.136 0.284 1.00 43.41 H new ATOM 0 HG21 ILE A1747 -7.781 12.847 0.365 1.00 53.02 H new ATOM 0 HG22 ILE A1747 -8.705 12.270 -1.042 1.00 53.02 H new ATOM 0 HG23 ILE A1747 -8.774 11.376 0.495 1.00 53.02 H new ATOM 0 HD11 ILE A1747 -4.962 11.578 2.242 1.00 61.53 H new ATOM 0 HD12 ILE A1747 -4.927 12.544 0.748 1.00 61.53 H new ATOM 0 HD13 ILE A1747 -6.386 12.535 1.768 1.00 61.53 H new ATOM 1293 N LYS A1748 -7.993 10.754 -3.536 1.00 12.45 N ATOM 1294 CA LYS A1748 -8.757 11.154 -4.645 1.00 73.42 C ATOM 1295 C LYS A1748 -9.592 9.988 -5.198 1.00 32.41 C ATOM 1296 O LYS A1748 -10.749 10.161 -5.578 1.00 51.45 O ATOM 1297 CB LYS A1748 -7.752 11.572 -5.670 1.00 73.51 C ATOM 1298 CG LYS A1748 -8.340 12.161 -6.859 1.00 64.43 C ATOM 1299 CD LYS A1748 -7.306 12.375 -7.960 1.00 43.10 C ATOM 1300 CE LYS A1748 -6.777 11.054 -8.530 1.00 73.21 C ATOM 1301 NZ LYS A1748 -7.829 10.309 -9.259 1.00 34.43 N ATOM 0 H LYS A1748 -6.995 10.915 -3.671 1.00 12.45 H new ATOM 0 HA LYS A1748 -9.456 11.947 -4.379 1.00 73.42 H new ATOM 0 HB2 LYS A1748 -7.066 12.290 -5.221 1.00 73.51 H new ATOM 0 HB3 LYS A1748 -7.160 10.704 -5.960 1.00 73.51 H new ATOM 0 HG2 LYS A1748 -9.135 11.514 -7.229 1.00 64.43 H new ATOM 0 HG3 LYS A1748 -8.799 13.116 -6.602 1.00 64.43 H new ATOM 0 HD2 LYS A1748 -7.751 12.962 -8.763 1.00 43.10 H new ATOM 0 HD3 LYS A1748 -6.473 12.956 -7.564 1.00 43.10 H new ATOM 0 HE2 LYS A1748 -5.943 11.256 -9.202 1.00 73.21 H new ATOM 0 HE3 LYS A1748 -6.390 10.437 -7.719 1.00 73.21 H new ATOM 0 HZ1 LYS A1748 -7.399 9.512 -9.770 1.00 34.43 H new ATOM 0 HZ2 LYS A1748 -8.531 9.948 -8.582 1.00 34.43 H new ATOM 0 HZ3 LYS A1748 -8.297 10.943 -9.937 1.00 34.43 H new ATOM 1315 N TYR A1749 -9.006 8.812 -5.221 1.00 21.34 N ATOM 1316 CA TYR A1749 -9.676 7.642 -5.735 1.00 73.31 C ATOM 1317 C TYR A1749 -10.865 7.286 -4.842 1.00 13.22 C ATOM 1318 O TYR A1749 -11.972 6.997 -5.332 1.00 5.03 O ATOM 1319 CB TYR A1749 -8.694 6.441 -5.842 1.00 22.32 C ATOM 1320 CG TYR A1749 -9.372 5.119 -6.164 1.00 65.10 C ATOM 1321 CD1 TYR A1749 -9.941 4.360 -5.150 1.00 41.43 C ATOM 1322 CD2 TYR A1749 -9.479 4.655 -7.463 1.00 44.11 C ATOM 1323 CE1 TYR A1749 -10.598 3.201 -5.404 1.00 20.10 C ATOM 1324 CE2 TYR A1749 -10.132 3.467 -7.735 1.00 2.23 C ATOM 1325 CZ TYR A1749 -10.696 2.744 -6.697 1.00 72.52 C ATOM 1326 OH TYR A1749 -11.398 1.590 -6.964 1.00 11.32 O ATOM 0 H TYR A1749 -8.058 8.642 -4.886 1.00 21.34 H new ATOM 0 HA TYR A1749 -10.042 7.865 -6.737 1.00 73.31 H new ATOM 0 HB2 TYR A1749 -7.954 6.656 -6.613 1.00 22.32 H new ATOM 0 HB3 TYR A1749 -8.153 6.341 -4.901 1.00 22.32 H new ATOM 0 HD1 TYR A1749 -9.858 4.703 -4.129 1.00 41.43 H new ATOM 0 HD2 TYR A1749 -9.048 5.226 -8.272 1.00 44.11 H new ATOM 0 HE1 TYR A1749 -11.042 2.640 -4.595 1.00 20.10 H new ATOM 0 HE2 TYR A1749 -10.202 3.105 -8.750 1.00 2.23 H new ATOM 0 HH TYR A1749 -11.372 1.406 -7.926 1.00 11.32 H new ATOM 1336 N LEU A1750 -10.630 7.297 -3.549 1.00 14.05 N ATOM 1337 CA LEU A1750 -11.656 6.934 -2.578 1.00 45.04 C ATOM 1338 C LEU A1750 -12.815 7.912 -2.577 1.00 74.02 C ATOM 1339 O LEU A1750 -13.977 7.498 -2.647 1.00 51.31 O ATOM 1340 CB LEU A1750 -11.096 6.779 -1.157 1.00 24.23 C ATOM 1341 CG LEU A1750 -10.247 5.536 -0.827 1.00 62.33 C ATOM 1342 CD1 LEU A1750 -10.909 4.254 -1.232 1.00 64.23 C ATOM 1343 CD2 LEU A1750 -8.869 5.607 -1.375 1.00 1.25 C ATOM 0 H LEU A1750 -9.733 7.554 -3.137 1.00 14.05 H new ATOM 0 HA LEU A1750 -12.029 5.961 -2.898 1.00 45.04 H new ATOM 0 HB2 LEU A1750 -10.490 7.659 -0.943 1.00 24.23 H new ATOM 0 HB3 LEU A1750 -11.939 6.796 -0.466 1.00 24.23 H new ATOM 0 HG LEU A1750 -10.165 5.537 0.260 1.00 62.33 H new ATOM 0 HD11 LEU A1750 -10.264 3.414 -0.974 1.00 64.23 H new ATOM 0 HD12 LEU A1750 -11.860 4.155 -0.709 1.00 64.23 H new ATOM 0 HD13 LEU A1750 -11.085 4.259 -2.308 1.00 64.23 H new ATOM 0 HD21 LEU A1750 -8.324 4.702 -1.107 1.00 1.25 H new ATOM 0 HD22 LEU A1750 -8.913 5.697 -2.460 1.00 1.25 H new ATOM 0 HD23 LEU A1750 -8.357 6.475 -0.960 1.00 1.25 H new ATOM 1355 N ILE A1751 -12.512 9.194 -2.527 1.00 1.54 N ATOM 1356 CA ILE A1751 -13.552 10.231 -2.485 1.00 72.45 C ATOM 1357 C ILE A1751 -14.409 10.242 -3.725 1.00 2.14 C ATOM 1358 O ILE A1751 -15.619 10.419 -3.642 1.00 70.42 O ATOM 1359 CB ILE A1751 -12.991 11.641 -2.214 1.00 12.22 C ATOM 1360 CG1 ILE A1751 -11.904 12.037 -3.218 1.00 64.30 C ATOM 1361 CG2 ILE A1751 -12.515 11.752 -0.799 1.00 41.33 C ATOM 1362 CD1 ILE A1751 -12.356 13.042 -4.261 1.00 73.11 C ATOM 0 H ILE A1751 -11.558 9.554 -2.514 1.00 1.54 H new ATOM 0 HA ILE A1751 -14.183 9.960 -1.638 1.00 72.45 H new ATOM 0 HB ILE A1751 -13.804 12.354 -2.354 1.00 12.22 H new ATOM 0 HG12 ILE A1751 -11.056 12.452 -2.673 1.00 64.30 H new ATOM 0 HG13 ILE A1751 -11.549 11.140 -3.725 1.00 64.30 H new ATOM 0 HG21 ILE A1751 -12.122 12.754 -0.625 1.00 41.33 H new ATOM 0 HG22 ILE A1751 -13.347 11.565 -0.120 1.00 41.33 H new ATOM 0 HG23 ILE A1751 -11.729 11.018 -0.621 1.00 41.33 H new ATOM 0 HD11 ILE A1751 -11.527 13.268 -4.932 1.00 73.11 H new ATOM 0 HD12 ILE A1751 -13.183 12.624 -4.835 1.00 73.11 H new ATOM 0 HD13 ILE A1751 -12.683 13.957 -3.767 1.00 73.11 H new ATOM 1374 N SER A1752 -13.796 9.995 -4.854 1.00 35.10 N ATOM 1375 CA SER A1752 -14.499 10.021 -6.108 1.00 0.43 C ATOM 1376 C SER A1752 -15.481 8.849 -6.234 1.00 15.41 C ATOM 1377 O SER A1752 -16.472 8.931 -6.956 1.00 32.34 O ATOM 1378 CB SER A1752 -13.489 10.037 -7.235 1.00 71.42 C ATOM 1379 OG SER A1752 -12.680 11.204 -7.154 1.00 4.22 O ATOM 0 H SER A1752 -12.804 9.772 -4.929 1.00 35.10 H new ATOM 0 HA SER A1752 -15.104 10.926 -6.161 1.00 0.43 H new ATOM 0 HB2 SER A1752 -12.862 9.147 -7.184 1.00 71.42 H new ATOM 0 HB3 SER A1752 -14.004 10.009 -8.195 1.00 71.42 H new ATOM 0 HG SER A1752 -11.920 11.034 -6.559 1.00 4.22 H new ATOM 1385 N HIS A1753 -15.236 7.788 -5.483 1.00 3.53 N ATOM 1386 CA HIS A1753 -16.096 6.618 -5.513 1.00 55.05 C ATOM 1387 C HIS A1753 -16.942 6.532 -4.262 1.00 15.10 C ATOM 1388 O HIS A1753 -17.567 5.503 -4.009 1.00 24.44 O ATOM 1389 CB HIS A1753 -15.288 5.342 -5.668 1.00 22.54 C ATOM 1390 CG HIS A1753 -14.603 5.194 -6.978 1.00 20.34 C ATOM 1391 ND1 HIS A1753 -13.248 5.261 -7.116 1.00 72.33 N ATOM 1392 CD2 HIS A1753 -15.088 4.915 -8.199 1.00 3.14 C ATOM 1393 CE1 HIS A1753 -12.929 5.017 -8.361 1.00 51.14 C ATOM 1394 NE2 HIS A1753 -14.022 4.807 -9.038 1.00 74.45 N ATOM 0 H HIS A1753 -14.445 7.714 -4.843 1.00 3.53 H new ATOM 0 HA HIS A1753 -16.751 6.724 -6.378 1.00 55.05 H new ATOM 0 HB2 HIS A1753 -14.540 5.304 -4.876 1.00 22.54 H new ATOM 0 HB3 HIS A1753 -15.951 4.489 -5.522 1.00 22.54 H new ATOM 0 HD1 HIS A1753 -12.588 5.469 -6.367 1.00 72.33 H new ATOM 0 HD2 HIS A1753 -16.128 4.798 -8.465 1.00 3.14 H new ATOM 0 HE1 HIS A1753 -11.926 4.994 -8.761 1.00 51.14 H new ATOM 1403 N SER A1754 -16.938 7.606 -3.479 1.00 21.44 N ATOM 1404 CA SER A1754 -17.754 7.723 -2.270 1.00 32.32 C ATOM 1405 C SER A1754 -17.387 6.651 -1.213 1.00 20.32 C ATOM 1406 O SER A1754 -18.252 6.130 -0.496 1.00 43.35 O ATOM 1407 CB SER A1754 -19.244 7.644 -2.650 1.00 43.35 C ATOM 1408 OG SER A1754 -19.548 8.588 -3.683 1.00 23.13 O ATOM 0 H SER A1754 -16.364 8.428 -3.665 1.00 21.44 H new ATOM 0 HA SER A1754 -17.550 8.690 -1.811 1.00 32.32 H new ATOM 0 HB2 SER A1754 -19.487 6.636 -2.987 1.00 43.35 H new ATOM 0 HB3 SER A1754 -19.860 7.844 -1.773 1.00 43.35 H new ATOM 0 HG SER A1754 -20.498 8.525 -3.915 1.00 23.13 H new ATOM 1414 N PHE A1755 -16.102 6.364 -1.083 1.00 1.52 N ATOM 1415 CA PHE A1755 -15.645 5.433 -0.068 1.00 65.42 C ATOM 1416 C PHE A1755 -15.571 6.107 1.273 1.00 50.44 C ATOM 1417 O PHE A1755 -15.733 7.332 1.388 1.00 71.53 O ATOM 1418 CB PHE A1755 -14.274 4.866 -0.384 1.00 35.32 C ATOM 1419 CG PHE A1755 -14.267 3.704 -1.314 1.00 23.45 C ATOM 1420 CD1 PHE A1755 -14.373 2.419 -0.817 1.00 71.24 C ATOM 1421 CD2 PHE A1755 -14.117 3.883 -2.662 1.00 41.24 C ATOM 1422 CE1 PHE A1755 -14.331 1.334 -1.654 1.00 73.54 C ATOM 1423 CE2 PHE A1755 -14.079 2.805 -3.510 1.00 62.45 C ATOM 1424 CZ PHE A1755 -14.184 1.523 -3.008 1.00 41.21 C ATOM 0 H PHE A1755 -15.363 6.760 -1.664 1.00 1.52 H new ATOM 0 HA PHE A1755 -16.370 4.619 -0.051 1.00 65.42 H new ATOM 0 HB2 PHE A1755 -13.661 5.658 -0.814 1.00 35.32 H new ATOM 0 HB3 PHE A1755 -13.799 4.566 0.550 1.00 35.32 H new ATOM 0 HD1 PHE A1755 -14.491 2.267 0.246 1.00 71.24 H new ATOM 0 HD2 PHE A1755 -14.028 4.882 -3.062 1.00 41.24 H new ATOM 0 HE1 PHE A1755 -14.413 0.335 -1.252 1.00 73.54 H new ATOM 0 HE2 PHE A1755 -13.967 2.960 -4.573 1.00 62.45 H new ATOM 0 HZ PHE A1755 -14.151 0.674 -3.675 1.00 41.21 H new ATOM 1434 N ARG A1756 -15.317 5.335 2.279 1.00 34.14 N ATOM 1435 CA ARG A1756 -15.178 5.852 3.600 1.00 31.01 C ATOM 1436 C ARG A1756 -13.803 5.503 4.054 1.00 52.44 C ATOM 1437 O ARG A1756 -13.468 4.348 4.123 1.00 2.43 O ATOM 1438 CB ARG A1756 -16.188 5.192 4.521 1.00 61.53 C ATOM 1439 CG ARG A1756 -17.611 5.288 4.036 1.00 63.14 C ATOM 1440 CD ARG A1756 -18.224 3.911 3.927 1.00 13.43 C ATOM 1441 NE ARG A1756 -18.312 3.249 5.237 1.00 22.12 N ATOM 1442 CZ ARG A1756 -19.075 2.189 5.520 1.00 52.22 C ATOM 1443 NH1 ARG A1756 -19.849 1.654 4.580 1.00 71.41 N ATOM 1444 NH2 ARG A1756 -19.080 1.685 6.754 1.00 11.43 N ATOM 0 H ARG A1756 -15.200 4.324 2.207 1.00 34.14 H new ATOM 0 HA ARG A1756 -15.345 6.929 3.616 1.00 31.01 H new ATOM 0 HB2 ARG A1756 -15.925 4.141 4.639 1.00 61.53 H new ATOM 0 HB3 ARG A1756 -16.119 5.650 5.508 1.00 61.53 H new ATOM 0 HG2 ARG A1756 -18.196 5.900 4.723 1.00 63.14 H new ATOM 0 HG3 ARG A1756 -17.639 5.783 3.065 1.00 63.14 H new ATOM 0 HD2 ARG A1756 -19.220 3.990 3.492 1.00 13.43 H new ATOM 0 HD3 ARG A1756 -17.627 3.300 3.250 1.00 13.43 H new ATOM 0 HE ARG A1756 -17.743 3.631 5.993 1.00 22.12 H new ATOM 0 HH11 ARG A1756 -19.861 2.053 3.641 1.00 71.41 H new ATOM 0 HH12 ARG A1756 -20.431 0.845 4.798 1.00 71.41 H new ATOM 0 HH21 ARG A1756 -18.502 2.108 7.480 1.00 11.43 H new ATOM 0 HH22 ARG A1756 -19.662 0.876 6.972 1.00 11.43 H new ATOM 1458 N PHE A1757 -13.008 6.470 4.292 1.00 21.15 N ATOM 1459 CA PHE A1757 -11.661 6.238 4.755 1.00 21.54 C ATOM 1460 C PHE A1757 -11.264 7.283 5.769 1.00 10.01 C ATOM 1461 O PHE A1757 -11.964 8.281 5.950 1.00 22.22 O ATOM 1462 CB PHE A1757 -10.671 6.253 3.576 1.00 70.11 C ATOM 1463 CG PHE A1757 -10.589 7.577 2.870 1.00 35.32 C ATOM 1464 CD1 PHE A1757 -11.557 7.941 1.961 1.00 20.12 C ATOM 1465 CD2 PHE A1757 -9.556 8.464 3.136 1.00 53.14 C ATOM 1466 CE1 PHE A1757 -11.507 9.150 1.329 1.00 42.13 C ATOM 1467 CE2 PHE A1757 -9.506 9.683 2.503 1.00 22.11 C ATOM 1468 CZ PHE A1757 -10.486 10.020 1.597 1.00 74.30 C ATOM 0 H PHE A1757 -13.253 7.453 4.178 1.00 21.15 H new ATOM 0 HA PHE A1757 -11.630 5.256 5.227 1.00 21.54 H new ATOM 0 HB2 PHE A1757 -9.680 5.985 3.942 1.00 70.11 H new ATOM 0 HB3 PHE A1757 -10.963 5.487 2.858 1.00 70.11 H new ATOM 0 HD1 PHE A1757 -12.367 7.260 1.745 1.00 20.12 H new ATOM 0 HD2 PHE A1757 -8.787 8.195 3.845 1.00 53.14 H new ATOM 0 HE1 PHE A1757 -12.273 9.420 0.617 1.00 42.13 H new ATOM 0 HE2 PHE A1757 -8.702 10.373 2.715 1.00 22.11 H new ATOM 0 HZ PHE A1757 -10.449 10.976 1.095 1.00 74.30 H new ATOM 1478 N SER A1758 -10.176 7.044 6.425 1.00 4.51 N ATOM 1479 CA SER A1758 -9.614 7.962 7.354 1.00 12.44 C ATOM 1480 C SER A1758 -8.160 7.596 7.522 1.00 74.15 C ATOM 1481 O SER A1758 -7.829 6.414 7.561 1.00 31.24 O ATOM 1482 CB SER A1758 -10.352 7.852 8.697 1.00 2.11 C ATOM 1483 OG SER A1758 -9.872 8.781 9.651 1.00 11.21 O ATOM 0 H SER A1758 -9.641 6.181 6.325 1.00 4.51 H new ATOM 0 HA SER A1758 -9.708 8.988 6.999 1.00 12.44 H new ATOM 0 HB2 SER A1758 -11.418 8.016 8.538 1.00 2.11 H new ATOM 0 HB3 SER A1758 -10.240 6.841 9.089 1.00 2.11 H new ATOM 0 HG SER A1758 -10.370 8.677 10.488 1.00 11.21 H new ATOM 1489 N GLU A1759 -7.298 8.570 7.556 1.00 44.01 N ATOM 1490 CA GLU A1759 -5.906 8.306 7.792 1.00 4.33 C ATOM 1491 C GLU A1759 -5.715 8.079 9.269 1.00 23.23 C ATOM 1492 O GLU A1759 -6.276 8.817 10.094 1.00 75.44 O ATOM 1493 CB GLU A1759 -5.020 9.458 7.278 1.00 4.25 C ATOM 1494 CG GLU A1759 -3.544 9.365 7.662 1.00 0.24 C ATOM 1495 CD GLU A1759 -2.742 10.588 7.256 1.00 22.12 C ATOM 1496 OE1 GLU A1759 -3.209 11.724 7.464 1.00 70.23 O ATOM 1497 OE2 GLU A1759 -1.621 10.445 6.692 1.00 34.34 O ATOM 0 H GLU A1759 -7.532 9.554 7.424 1.00 44.01 H new ATOM 0 HA GLU A1759 -5.601 7.416 7.242 1.00 4.33 H new ATOM 0 HB2 GLU A1759 -5.094 9.495 6.191 1.00 4.25 H new ATOM 0 HB3 GLU A1759 -5.419 10.399 7.657 1.00 4.25 H new ATOM 0 HG2 GLU A1759 -3.464 9.228 8.740 1.00 0.24 H new ATOM 0 HG3 GLU A1759 -3.109 8.482 7.195 1.00 0.24 H new ATOM 1504 N ILE A1760 -5.001 7.031 9.597 1.00 43.04 N ATOM 1505 CA ILE A1760 -4.682 6.733 10.965 1.00 70.51 C ATOM 1506 C ILE A1760 -3.767 7.826 11.455 1.00 34.31 C ATOM 1507 O ILE A1760 -4.085 8.515 12.429 1.00 51.41 O ATOM 1508 CB ILE A1760 -3.985 5.346 11.089 1.00 44.03 C ATOM 1509 CG1 ILE A1760 -4.940 4.231 10.614 1.00 14.00 C ATOM 1510 CG2 ILE A1760 -3.501 5.094 12.524 1.00 2.22 C ATOM 1511 CD1 ILE A1760 -4.333 2.841 10.610 1.00 64.12 C ATOM 0 H ILE A1760 -4.627 6.364 8.922 1.00 43.04 H new ATOM 0 HA ILE A1760 -5.592 6.687 11.564 1.00 70.51 H new ATOM 0 HB ILE A1760 -3.104 5.341 10.447 1.00 44.03 H new ATOM 0 HG12 ILE A1760 -5.821 4.227 11.256 1.00 14.00 H new ATOM 0 HG13 ILE A1760 -5.281 4.467 9.606 1.00 14.00 H new ATOM 0 HG21 ILE A1760 -3.019 4.118 12.579 1.00 2.22 H new ATOM 0 HG22 ILE A1760 -2.788 5.868 12.809 1.00 2.22 H new ATOM 0 HG23 ILE A1760 -4.352 5.117 13.204 1.00 2.22 H new ATOM 0 HD11 ILE A1760 -5.074 2.121 10.263 1.00 64.12 H new ATOM 0 HD12 ILE A1760 -3.470 2.823 9.945 1.00 64.12 H new ATOM 0 HD13 ILE A1760 -4.018 2.579 11.620 1.00 64.12 H new ATOM 1523 N LYS A1761 -2.645 7.962 10.740 1.00 10.23 N ATOM 1524 CA LYS A1761 -1.632 8.937 10.872 1.00 65.13 C ATOM 1525 C LYS A1761 -0.546 8.475 9.872 1.00 0.22 C ATOM 1526 O LYS A1761 -0.964 7.821 8.901 1.00 4.23 O ATOM 1527 CB LYS A1761 -1.247 9.280 12.353 1.00 63.24 C ATOM 1528 CG LYS A1761 -1.925 10.576 12.835 1.00 33.32 C ATOM 1529 CD LYS A1761 -1.777 10.815 14.332 1.00 22.12 C ATOM 1530 CE LYS A1761 -2.624 9.845 15.149 1.00 44.04 C ATOM 1531 NZ LYS A1761 -4.063 9.921 14.778 1.00 42.03 N ATOM 0 H LYS A1761 -2.432 7.310 9.985 1.00 10.23 H new ATOM 0 HA LYS A1761 -1.934 9.949 10.603 1.00 65.13 H new ATOM 0 HB2 LYS A1761 -1.536 8.455 13.004 1.00 63.24 H new ATOM 0 HB3 LYS A1761 -0.165 9.385 12.432 1.00 63.24 H new ATOM 0 HG2 LYS A1761 -1.500 11.422 12.296 1.00 33.32 H new ATOM 0 HG3 LYS A1761 -2.985 10.538 12.584 1.00 33.32 H new ATOM 0 HD2 LYS A1761 -0.730 10.709 14.615 1.00 22.12 H new ATOM 0 HD3 LYS A1761 -2.069 11.839 14.567 1.00 22.12 H new ATOM 0 HE2 LYS A1761 -2.262 8.828 14.996 1.00 44.04 H new ATOM 0 HE3 LYS A1761 -2.510 10.067 16.210 1.00 44.04 H new ATOM 0 HZ1 LYS A1761 -4.645 9.605 15.580 1.00 42.03 H new ATOM 0 HZ2 LYS A1761 -4.308 10.903 14.538 1.00 42.03 H new ATOM 0 HZ3 LYS A1761 -4.243 9.308 13.957 1.00 42.03 H new ATOM 1545 N PRO A1762 0.784 8.643 10.074 1.00 5.02 N ATOM 1546 CA PRO A1762 1.805 8.635 8.988 1.00 20.31 C ATOM 1547 C PRO A1762 1.536 7.807 7.711 1.00 72.43 C ATOM 1548 O PRO A1762 1.877 6.625 7.649 1.00 65.52 O ATOM 1549 CB PRO A1762 3.011 8.046 9.653 1.00 72.12 C ATOM 1550 CG PRO A1762 2.521 7.557 10.941 1.00 45.13 C ATOM 1551 CD PRO A1762 1.496 8.525 11.336 1.00 63.33 C ATOM 0 HA PRO A1762 1.864 9.654 8.606 1.00 20.31 H new ATOM 0 HB2 PRO A1762 3.436 7.238 9.058 1.00 72.12 H new ATOM 0 HB3 PRO A1762 3.795 8.792 9.784 1.00 72.12 H new ATOM 0 HG2 PRO A1762 2.105 6.553 10.852 1.00 45.13 H new ATOM 0 HG3 PRO A1762 3.323 7.506 11.677 1.00 45.13 H new ATOM 0 HD2 PRO A1762 0.862 8.158 12.143 1.00 63.33 H new ATOM 0 HD3 PRO A1762 1.920 9.472 11.669 1.00 63.33 H new ATOM 1559 N GLY A1763 0.928 8.430 6.715 1.00 24.40 N ATOM 1560 CA GLY A1763 0.770 7.823 5.404 1.00 73.31 C ATOM 1561 C GLY A1763 -0.005 6.514 5.375 1.00 24.10 C ATOM 1562 O GLY A1763 0.320 5.625 4.569 1.00 4.23 O ATOM 0 H GLY A1763 0.532 9.367 6.792 1.00 24.40 H new ATOM 0 HA2 GLY A1763 0.267 8.537 4.751 1.00 73.31 H new ATOM 0 HA3 GLY A1763 1.760 7.648 4.983 1.00 73.31 H new ATOM 1566 N CYS A1764 -0.939 6.336 6.271 1.00 74.02 N ATOM 1567 CA CYS A1764 -1.754 5.138 6.236 1.00 62.13 C ATOM 1568 C CYS A1764 -3.259 5.440 6.318 1.00 11.45 C ATOM 1569 O CYS A1764 -3.771 5.895 7.344 1.00 65.34 O ATOM 1570 CB CYS A1764 -1.274 4.110 7.271 1.00 34.04 C ATOM 1571 SG CYS A1764 -1.075 4.748 8.955 1.00 52.13 S ATOM 0 H CYS A1764 -1.157 6.989 7.024 1.00 74.02 H new ATOM 0 HA CYS A1764 -1.618 4.677 5.257 1.00 62.13 H new ATOM 0 HB2 CYS A1764 -1.983 3.283 7.294 1.00 34.04 H new ATOM 0 HB3 CYS A1764 -0.319 3.702 6.939 1.00 34.04 H new ATOM 0 HG CYS A1764 -0.878 6.032 8.912 1.00 52.13 H new ATOM 1577 N LEU A1765 -3.941 5.200 5.212 1.00 4.05 N ATOM 1578 CA LEU A1765 -5.361 5.440 5.060 1.00 34.13 C ATOM 1579 C LEU A1765 -6.126 4.152 5.364 1.00 12.22 C ATOM 1580 O LEU A1765 -5.864 3.119 4.771 1.00 4.53 O ATOM 1581 CB LEU A1765 -5.657 5.858 3.600 1.00 20.44 C ATOM 1582 CG LEU A1765 -4.834 7.028 3.027 1.00 54.43 C ATOM 1583 CD1 LEU A1765 -5.196 7.284 1.576 1.00 61.14 C ATOM 1584 CD2 LEU A1765 -5.037 8.285 3.843 1.00 24.40 C ATOM 0 H LEU A1765 -3.506 4.821 4.371 1.00 4.05 H new ATOM 0 HA LEU A1765 -5.670 6.230 5.745 1.00 34.13 H new ATOM 0 HB2 LEU A1765 -5.501 4.989 2.961 1.00 20.44 H new ATOM 0 HB3 LEU A1765 -6.713 6.120 3.530 1.00 20.44 H new ATOM 0 HG LEU A1765 -3.782 6.749 3.079 1.00 54.43 H new ATOM 0 HD11 LEU A1765 -4.602 8.114 1.194 1.00 61.14 H new ATOM 0 HD12 LEU A1765 -4.991 6.390 0.987 1.00 61.14 H new ATOM 0 HD13 LEU A1765 -6.255 7.532 1.503 1.00 61.14 H new ATOM 0 HD21 LEU A1765 -4.445 9.095 3.417 1.00 24.40 H new ATOM 0 HD22 LEU A1765 -6.091 8.561 3.830 1.00 24.40 H new ATOM 0 HD23 LEU A1765 -4.721 8.107 4.871 1.00 24.40 H new ATOM 1596 N LYS A1766 -7.036 4.202 6.275 1.00 75.22 N ATOM 1597 CA LYS A1766 -7.840 3.049 6.594 1.00 50.55 C ATOM 1598 C LYS A1766 -9.195 3.230 5.931 1.00 14.31 C ATOM 1599 O LYS A1766 -9.917 4.173 6.243 1.00 44.34 O ATOM 1600 CB LYS A1766 -7.979 2.914 8.109 1.00 14.31 C ATOM 1601 CG LYS A1766 -8.646 1.632 8.574 1.00 14.14 C ATOM 1602 CD LYS A1766 -8.724 1.601 10.085 1.00 52.41 C ATOM 1603 CE LYS A1766 -9.279 0.291 10.599 1.00 74.54 C ATOM 1604 NZ LYS A1766 -9.362 0.294 12.068 1.00 65.33 N ATOM 0 H LYS A1766 -7.251 5.034 6.824 1.00 75.22 H new ATOM 0 HA LYS A1766 -7.373 2.135 6.226 1.00 50.55 H new ATOM 0 HB2 LYS A1766 -6.988 2.975 8.558 1.00 14.31 H new ATOM 0 HB3 LYS A1766 -8.552 3.762 8.484 1.00 14.31 H new ATOM 0 HG2 LYS A1766 -9.647 1.560 8.149 1.00 14.14 H new ATOM 0 HG3 LYS A1766 -8.084 0.770 8.214 1.00 14.14 H new ATOM 0 HD2 LYS A1766 -7.730 1.762 10.502 1.00 52.41 H new ATOM 0 HD3 LYS A1766 -9.352 2.421 10.432 1.00 52.41 H new ATOM 0 HE2 LYS A1766 -10.269 0.120 10.176 1.00 74.54 H new ATOM 0 HE3 LYS A1766 -8.645 -0.532 10.269 1.00 74.54 H new ATOM 0 HZ1 LYS A1766 -9.746 -0.615 12.396 1.00 65.33 H new ATOM 0 HZ2 LYS A1766 -8.413 0.434 12.469 1.00 65.33 H new ATOM 0 HZ3 LYS A1766 -9.986 1.065 12.379 1.00 65.33 H new ATOM 1618 N VAL A1767 -9.509 2.367 5.003 1.00 14.14 N ATOM 1619 CA VAL A1767 -10.728 2.468 4.224 1.00 55.44 C ATOM 1620 C VAL A1767 -11.752 1.445 4.714 1.00 12.21 C ATOM 1621 O VAL A1767 -11.395 0.331 5.072 1.00 52.52 O ATOM 1622 CB VAL A1767 -10.429 2.188 2.713 1.00 1.31 C ATOM 1623 CG1 VAL A1767 -11.665 2.375 1.846 1.00 54.25 C ATOM 1624 CG2 VAL A1767 -9.280 3.057 2.208 1.00 1.35 C ATOM 0 H VAL A1767 -8.927 1.566 4.759 1.00 14.14 H new ATOM 0 HA VAL A1767 -11.125 3.476 4.342 1.00 55.44 H new ATOM 0 HB VAL A1767 -10.128 1.143 2.636 1.00 1.31 H new ATOM 0 HG11 VAL A1767 -11.414 2.171 0.805 1.00 54.25 H new ATOM 0 HG12 VAL A1767 -12.446 1.688 2.172 1.00 54.25 H new ATOM 0 HG13 VAL A1767 -12.023 3.401 1.939 1.00 54.25 H new ATOM 0 HG21 VAL A1767 -9.095 2.840 1.156 1.00 1.35 H new ATOM 0 HG22 VAL A1767 -9.542 4.109 2.321 1.00 1.35 H new ATOM 0 HG23 VAL A1767 -8.381 2.843 2.786 1.00 1.35 H new ATOM 1634 N MET A1768 -12.987 1.848 4.762 1.00 20.32 N ATOM 1635 CA MET A1768 -14.093 0.995 5.086 1.00 64.21 C ATOM 1636 C MET A1768 -14.804 0.603 3.825 1.00 41.43 C ATOM 1637 O MET A1768 -15.063 1.450 2.949 1.00 20.52 O ATOM 1638 CB MET A1768 -15.051 1.679 6.047 1.00 11.40 C ATOM 1639 CG MET A1768 -14.526 1.723 7.444 1.00 21.22 C ATOM 1640 SD MET A1768 -14.344 0.068 8.108 1.00 14.24 S ATOM 1641 CE MET A1768 -13.528 0.423 9.634 1.00 40.15 C ATOM 0 H MET A1768 -13.262 2.811 4.570 1.00 20.32 H new ATOM 0 HA MET A1768 -13.713 0.101 5.581 1.00 64.21 H new ATOM 0 HB2 MET A1768 -15.242 2.695 5.702 1.00 11.40 H new ATOM 0 HB3 MET A1768 -16.006 1.154 6.038 1.00 11.40 H new ATOM 0 HG2 MET A1768 -13.563 2.234 7.460 1.00 21.22 H new ATOM 0 HG3 MET A1768 -15.203 2.300 8.074 1.00 21.22 H new ATOM 0 HE1 MET A1768 -13.341 -0.507 10.172 1.00 40.15 H new ATOM 0 HE2 MET A1768 -12.580 0.922 9.432 1.00 40.15 H new ATOM 0 HE3 MET A1768 -14.158 1.073 10.241 1.00 40.15 H new ATOM 1651 N LEU A1769 -15.114 -0.651 3.727 1.00 14.00 N ATOM 1652 CA LEU A1769 -15.730 -1.202 2.542 1.00 23.52 C ATOM 1653 C LEU A1769 -17.221 -0.906 2.528 1.00 63.53 C ATOM 1654 O LEU A1769 -17.875 -0.873 3.580 1.00 54.44 O ATOM 1655 CB LEU A1769 -15.448 -2.694 2.460 1.00 24.21 C ATOM 1656 CG LEU A1769 -13.957 -3.072 2.478 1.00 42.00 C ATOM 1657 CD1 LEU A1769 -13.784 -4.564 2.548 1.00 51.03 C ATOM 1658 CD2 LEU A1769 -13.235 -2.515 1.257 1.00 4.31 C ATOM 0 H LEU A1769 -14.949 -1.333 4.467 1.00 14.00 H new ATOM 0 HA LEU A1769 -15.300 -0.730 1.659 1.00 23.52 H new ATOM 0 HB2 LEU A1769 -15.944 -3.189 3.295 1.00 24.21 H new ATOM 0 HB3 LEU A1769 -15.896 -3.084 1.546 1.00 24.21 H new ATOM 0 HG LEU A1769 -13.514 -2.629 3.370 1.00 42.00 H new ATOM 0 HD11 LEU A1769 -12.721 -4.807 2.560 1.00 51.03 H new ATOM 0 HD12 LEU A1769 -14.253 -4.942 3.456 1.00 51.03 H new ATOM 0 HD13 LEU A1769 -14.252 -5.026 1.679 1.00 51.03 H new ATOM 0 HD21 LEU A1769 -12.183 -2.798 1.296 1.00 4.31 H new ATOM 0 HD22 LEU A1769 -13.686 -2.920 0.351 1.00 4.31 H new ATOM 0 HD23 LEU A1769 -13.319 -1.428 1.249 1.00 4.31 H new ATOM 1670 N LYS A1770 -17.751 -0.699 1.353 1.00 22.31 N ATOM 1671 CA LYS A1770 -19.114 -0.249 1.194 1.00 12.21 C ATOM 1672 C LYS A1770 -19.887 -1.034 0.131 1.00 22.23 C ATOM 1673 O LYS A1770 -20.070 -0.552 -0.992 1.00 75.10 O ATOM 1674 CB LYS A1770 -19.144 1.292 0.967 1.00 70.03 C ATOM 1675 CG LYS A1770 -17.936 1.883 0.200 1.00 22.43 C ATOM 1676 CD LYS A1770 -17.874 1.493 -1.281 1.00 22.32 C ATOM 1677 CE LYS A1770 -18.964 2.168 -2.103 1.00 50.51 C ATOM 1678 NZ LYS A1770 -19.001 1.678 -3.504 1.00 44.31 N ATOM 0 H LYS A1770 -17.251 -0.837 0.475 1.00 22.31 H new ATOM 0 HA LYS A1770 -19.647 -0.458 2.121 1.00 12.21 H new ATOM 0 HB2 LYS A1770 -20.054 1.542 0.422 1.00 70.03 H new ATOM 0 HB3 LYS A1770 -19.209 1.782 1.938 1.00 70.03 H new ATOM 0 HG2 LYS A1770 -17.969 2.970 0.276 1.00 22.43 H new ATOM 0 HG3 LYS A1770 -17.017 1.558 0.688 1.00 22.43 H new ATOM 0 HD2 LYS A1770 -16.898 1.763 -1.685 1.00 22.32 H new ATOM 0 HD3 LYS A1770 -17.970 0.411 -1.374 1.00 22.32 H new ATOM 0 HE2 LYS A1770 -19.932 1.991 -1.633 1.00 50.51 H new ATOM 0 HE3 LYS A1770 -18.801 3.246 -2.102 1.00 50.51 H new ATOM 0 HZ1 LYS A1770 -19.758 2.167 -4.023 1.00 44.31 H new ATOM 0 HZ2 LYS A1770 -18.088 1.870 -3.963 1.00 44.31 H new ATOM 0 HZ3 LYS A1770 -19.183 0.654 -3.509 1.00 44.31 H new