USER MOD reduce.3.24.130724 H: found=0, std=0, add=612, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 614 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 830 MET CE :methyl 151:sc= 0 (180deg=-0.632) USER MOD Set 1.2: A 879 TYR OH : rot 47:sc= -0.735 USER MOD Single : A 832 SER OG : rot 120:sc= -0.374 USER MOD Single : A 834 LYS NZ :NH3+ 170:sc= 1.01 (180deg=0.941) USER MOD Single : A 840 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 841 ASN : amide:sc= 0.382 K(o=0.38,f=-0.12) USER MOD Single : A 842 TYR OH : rot 156:sc= -1.14! USER MOD Single : A 844 THR OG1 : rot 180:sc= -0.675 USER MOD Single : A 845 MET CE :methyl 161:sc= -0.185 (180deg=-0.861) USER MOD Single : A 856 GLN : amide:sc= -0.0504 K(o=-0.05,f=-0.62) USER MOD Single : A 859 TYR OH : rot 180:sc= 0.722 USER MOD Single : A 860 CYS SG : rot -38:sc= 1.78 USER MOD Single : A 864 MET CE :methyl -146:sc= -0.367 (180deg=-1.75) USER MOD Single : A 867 TYR OH : rot 180:sc= 0 USER MOD Single : A 868 THR OG1 : rot 65:sc= 1.23 USER MOD Single : A 872 SER OG : rot 180:sc= -1.82! USER MOD Single : A 880 MET CE :methyl 164:sc= -0.0288 (180deg=-0.347) USER MOD Single : A 881 SER OG : rot 61:sc= 0.387 USER MOD Single : A 883 SER OG : rot -155:sc= 1.55 USER MOD Single : A 884 THR OG1 : rot 83:sc= 1.29 USER MOD Single : A 887 TYR OH : rot 180:sc= 0 USER MOD Single : B1655 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B1657 TYR OH : rot 180:sc= 0 USER MOD Single : B1660 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B1662 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B1663 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00538) USER MOD Single : B1665 LYS NZ :NH3+ -156:sc= 1.26 (180deg=1.22) USER MOD Single : B1667 GLN : amide:sc= -0.161 X(o=-0.16,f=-0.36) USER MOD ----------------------------------------------------------------- ATOM 94 N VAL A 829 -6.752 -5.049 -7.036 1.00 10.00 N ATOM 95 CA VAL A 829 -5.404 -4.523 -6.825 1.00 10.00 C ATOM 96 C VAL A 829 -4.460 -5.648 -6.388 1.00 10.00 C ATOM 97 O VAL A 829 -3.317 -5.715 -6.829 1.00 10.00 O ATOM 98 CB VAL A 829 -5.404 -3.382 -5.776 1.00 10.00 C ATOM 99 CG1 VAL A 829 -3.994 -3.033 -5.314 1.00 10.00 C ATOM 100 CG2 VAL A 829 -6.093 -2.151 -6.347 1.00 10.00 C ATOM 0 HA VAL A 829 -5.051 -4.110 -7.770 1.00 10.00 H new ATOM 0 HB VAL A 829 -5.954 -3.734 -4.903 1.00 10.00 H new ATOM 0 HG11 VAL A 829 -4.040 -2.229 -4.579 1.00 10.00 H new ATOM 0 HG12 VAL A 829 -3.531 -3.911 -4.863 1.00 10.00 H new ATOM 0 HG13 VAL A 829 -3.401 -2.709 -6.169 1.00 10.00 H new ATOM 0 HG21 VAL A 829 -6.089 -1.354 -5.604 1.00 10.00 H new ATOM 0 HG22 VAL A 829 -5.562 -1.818 -7.239 1.00 10.00 H new ATOM 0 HG23 VAL A 829 -7.122 -2.398 -6.608 1.00 10.00 H new ATOM 110 N MET A 830 -4.964 -6.544 -5.542 1.00 10.00 N ATOM 111 CA MET A 830 -4.179 -7.681 -5.064 1.00 10.00 C ATOM 112 C MET A 830 -3.756 -8.566 -6.225 1.00 10.00 C ATOM 113 O MET A 830 -2.585 -8.922 -6.348 1.00 10.00 O ATOM 114 CB MET A 830 -4.986 -8.490 -4.047 1.00 10.00 C ATOM 115 CG MET A 830 -4.974 -7.879 -2.660 1.00 10.00 C ATOM 116 SD MET A 830 -3.395 -8.095 -1.825 1.00 10.00 S ATOM 117 CE MET A 830 -3.559 -9.763 -1.185 1.00 10.00 C ATOM 0 H MET A 830 -5.914 -6.505 -5.173 1.00 10.00 H new ATOM 0 HA MET A 830 -3.281 -7.300 -4.577 1.00 10.00 H new ATOM 0 HB2 MET A 830 -6.016 -8.573 -4.393 1.00 10.00 H new ATOM 0 HB3 MET A 830 -4.585 -9.502 -3.996 1.00 10.00 H new ATOM 0 HG2 MET A 830 -5.200 -6.815 -2.733 1.00 10.00 H new ATOM 0 HG3 MET A 830 -5.763 -8.332 -2.060 1.00 10.00 H new ATOM 0 HE1 MET A 830 -2.574 -10.224 -1.114 1.00 10.00 H new ATOM 0 HE2 MET A 830 -4.016 -9.730 -0.196 1.00 10.00 H new ATOM 0 HE3 MET A 830 -4.187 -10.350 -1.855 1.00 10.00 H new ATOM 127 N ALA A 831 -4.713 -8.915 -7.082 1.00 10.00 N ATOM 128 CA ALA A 831 -4.428 -9.732 -8.254 1.00 10.00 C ATOM 129 C ALA A 831 -3.424 -9.023 -9.158 1.00 10.00 C ATOM 130 O ALA A 831 -2.510 -9.643 -9.702 1.00 10.00 O ATOM 131 CB ALA A 831 -5.701 -10.032 -9.020 1.00 10.00 C ATOM 0 H ALA A 831 -5.691 -8.644 -6.985 1.00 10.00 H new ATOM 0 HA ALA A 831 -3.997 -10.676 -7.919 1.00 10.00 H new ATOM 0 HB1 ALA A 831 -5.466 -10.643 -9.891 1.00 10.00 H new ATOM 0 HB2 ALA A 831 -6.395 -10.571 -8.375 1.00 10.00 H new ATOM 0 HB3 ALA A 831 -6.159 -9.098 -9.345 1.00 10.00 H new ATOM 137 N SER A 832 -3.590 -7.714 -9.289 1.00 10.00 N ATOM 138 CA SER A 832 -2.699 -6.909 -10.111 1.00 10.00 C ATOM 139 C SER A 832 -1.316 -6.820 -9.478 1.00 10.00 C ATOM 140 O SER A 832 -0.312 -6.808 -10.185 1.00 10.00 O ATOM 141 CB SER A 832 -3.299 -5.517 -10.311 1.00 10.00 C ATOM 142 OG SER A 832 -4.549 -5.597 -10.973 1.00 10.00 O ATOM 0 H SER A 832 -4.336 -7.186 -8.835 1.00 10.00 H new ATOM 0 HA SER A 832 -2.588 -7.386 -11.085 1.00 10.00 H new ATOM 0 HB2 SER A 832 -3.425 -5.028 -9.345 1.00 10.00 H new ATOM 0 HB3 SER A 832 -2.613 -4.901 -10.893 1.00 10.00 H new ATOM 0 HG SER A 832 -5.247 -5.215 -10.401 1.00 10.00 H new ATOM 148 N PHE A 833 -1.262 -6.766 -8.153 1.00 10.00 N ATOM 149 CA PHE A 833 0.011 -6.716 -7.456 1.00 10.00 C ATOM 150 C PHE A 833 0.731 -8.035 -7.672 1.00 10.00 C ATOM 151 O PHE A 833 1.914 -8.059 -8.002 1.00 10.00 O ATOM 152 CB PHE A 833 -0.179 -6.449 -5.965 1.00 10.00 C ATOM 153 CG PHE A 833 0.601 -5.255 -5.486 1.00 10.00 C ATOM 154 CD1 PHE A 833 1.941 -5.379 -5.151 1.00 10.00 C ATOM 155 CD2 PHE A 833 0.003 -4.007 -5.378 1.00 10.00 C ATOM 156 CE1 PHE A 833 2.668 -4.288 -4.722 1.00 10.00 C ATOM 157 CE2 PHE A 833 0.728 -2.915 -4.945 1.00 10.00 C ATOM 158 CZ PHE A 833 2.063 -3.055 -4.619 1.00 10.00 C ATOM 0 H PHE A 833 -2.081 -6.756 -7.545 1.00 10.00 H new ATOM 0 HA PHE A 833 0.605 -5.894 -7.856 1.00 10.00 H new ATOM 0 HB2 PHE A 833 -1.238 -6.292 -5.760 1.00 10.00 H new ATOM 0 HB3 PHE A 833 0.128 -7.329 -5.400 1.00 10.00 H new ATOM 0 HD1 PHE A 833 2.422 -6.343 -5.227 1.00 10.00 H new ATOM 0 HD2 PHE A 833 -1.039 -3.889 -5.635 1.00 10.00 H new ATOM 0 HE1 PHE A 833 3.711 -4.401 -4.467 1.00 10.00 H new ATOM 0 HE2 PHE A 833 0.251 -1.950 -4.861 1.00 10.00 H new ATOM 0 HZ PHE A 833 2.631 -2.200 -4.284 1.00 10.00 H new ATOM 168 N LYS A 834 0.025 -9.128 -7.410 1.00 10.00 N ATOM 169 CA LYS A 834 0.558 -10.459 -7.655 1.00 10.00 C ATOM 170 C LYS A 834 1.194 -10.531 -9.040 1.00 10.00 C ATOM 171 O LYS A 834 2.317 -11.017 -9.182 1.00 10.00 O ATOM 172 CB LYS A 834 -0.537 -11.515 -7.519 1.00 10.00 C ATOM 173 CG LYS A 834 -0.439 -12.346 -6.244 1.00 10.00 C ATOM 174 CD LYS A 834 0.938 -12.981 -6.098 1.00 10.00 C ATOM 175 CE LYS A 834 0.882 -14.281 -5.309 1.00 10.00 C ATOM 176 NZ LYS A 834 0.188 -15.367 -6.055 1.00 10.00 N ATOM 0 H LYS A 834 -0.920 -9.117 -7.027 1.00 10.00 H new ATOM 0 HA LYS A 834 1.325 -10.662 -6.907 1.00 10.00 H new ATOM 0 HB2 LYS A 834 -1.509 -11.022 -7.546 1.00 10.00 H new ATOM 0 HB3 LYS A 834 -0.494 -12.182 -8.380 1.00 10.00 H new ATOM 0 HG2 LYS A 834 -0.643 -11.714 -5.380 1.00 10.00 H new ATOM 0 HG3 LYS A 834 -1.201 -13.125 -6.256 1.00 10.00 H new ATOM 0 HD2 LYS A 834 1.356 -13.174 -7.086 1.00 10.00 H new ATOM 0 HD3 LYS A 834 1.609 -12.282 -5.599 1.00 10.00 H new ATOM 0 HE2 LYS A 834 1.896 -14.600 -5.067 1.00 10.00 H new ATOM 0 HE3 LYS A 834 0.368 -14.107 -4.363 1.00 10.00 H new ATOM 0 HZ1 LYS A 834 0.321 -16.270 -5.557 1.00 10.00 H new ATOM 0 HZ2 LYS A 834 -0.828 -15.152 -6.116 1.00 10.00 H new ATOM 0 HZ3 LYS A 834 0.585 -15.438 -7.014 1.00 10.00 H new ATOM 190 N ILE A 835 0.494 -10.031 -10.063 1.00 10.00 N ATOM 191 CA ILE A 835 1.012 -10.025 -11.418 1.00 10.00 C ATOM 192 C ILE A 835 2.170 -9.027 -11.567 1.00 10.00 C ATOM 193 O ILE A 835 3.092 -9.247 -12.353 1.00 10.00 O ATOM 194 CB ILE A 835 -0.122 -9.696 -12.420 1.00 10.00 C ATOM 195 CG1 ILE A 835 -1.126 -10.849 -12.452 1.00 10.00 C ATOM 196 CG2 ILE A 835 0.436 -9.444 -13.818 1.00 10.00 C ATOM 197 CD1 ILE A 835 -2.451 -10.486 -13.083 1.00 10.00 C ATOM 0 H ILE A 835 -0.437 -9.625 -9.969 1.00 10.00 H new ATOM 0 HA ILE A 835 1.401 -11.019 -11.638 1.00 10.00 H new ATOM 0 HB ILE A 835 -0.623 -8.786 -12.091 1.00 10.00 H new ATOM 0 HG12 ILE A 835 -0.689 -11.684 -13.000 1.00 10.00 H new ATOM 0 HG13 ILE A 835 -1.302 -11.194 -11.433 1.00 10.00 H new ATOM 0 HG21 ILE A 835 -0.382 -9.215 -14.501 1.00 10.00 H new ATOM 0 HG22 ILE A 835 1.128 -8.603 -13.787 1.00 10.00 H new ATOM 0 HG23 ILE A 835 0.961 -10.334 -14.166 1.00 10.00 H new ATOM 0 HD11 ILE A 835 -3.110 -11.354 -13.069 1.00 10.00 H new ATOM 0 HD12 ILE A 835 -2.911 -9.672 -12.522 1.00 10.00 H new ATOM 0 HD13 ILE A 835 -2.289 -10.170 -14.113 1.00 10.00 H new ATOM 209 N LEU A 836 2.109 -7.939 -10.806 1.00 10.00 N ATOM 210 CA LEU A 836 3.146 -6.906 -10.827 1.00 10.00 C ATOM 211 C LEU A 836 4.503 -7.500 -10.448 1.00 10.00 C ATOM 212 O LEU A 836 5.518 -7.234 -11.096 1.00 10.00 O ATOM 213 CB LEU A 836 2.779 -5.778 -9.849 1.00 10.00 C ATOM 214 CG LEU A 836 3.444 -4.426 -10.106 1.00 10.00 C ATOM 215 CD1 LEU A 836 2.635 -3.623 -11.112 1.00 10.00 C ATOM 216 CD2 LEU A 836 3.594 -3.651 -8.805 1.00 10.00 C ATOM 0 H LEU A 836 1.344 -7.746 -10.159 1.00 10.00 H new ATOM 0 HA LEU A 836 3.213 -6.501 -11.837 1.00 10.00 H new ATOM 0 HB2 LEU A 836 1.698 -5.640 -9.874 1.00 10.00 H new ATOM 0 HB3 LEU A 836 3.036 -6.101 -8.840 1.00 10.00 H new ATOM 0 HG LEU A 836 4.437 -4.601 -10.519 1.00 10.00 H new ATOM 0 HD11 LEU A 836 3.120 -2.663 -11.285 1.00 10.00 H new ATOM 0 HD12 LEU A 836 2.573 -4.173 -12.051 1.00 10.00 H new ATOM 0 HD13 LEU A 836 1.631 -3.457 -10.722 1.00 10.00 H new ATOM 0 HD21 LEU A 836 4.069 -2.691 -9.006 1.00 10.00 H new ATOM 0 HD22 LEU A 836 2.611 -3.484 -8.365 1.00 10.00 H new ATOM 0 HD23 LEU A 836 4.210 -4.222 -8.110 1.00 10.00 H new ATOM 228 N ALA A 837 4.512 -8.277 -9.370 1.00 10.00 N ATOM 229 CA ALA A 837 5.736 -8.916 -8.895 1.00 10.00 C ATOM 230 C ALA A 837 6.028 -10.198 -9.668 1.00 10.00 C ATOM 231 O ALA A 837 7.190 -10.569 -9.858 1.00 10.00 O ATOM 232 CB ALA A 837 5.624 -9.220 -7.415 1.00 10.00 C ATOM 0 H ALA A 837 3.685 -8.480 -8.808 1.00 10.00 H new ATOM 0 HA ALA A 837 6.562 -8.224 -9.061 1.00 10.00 H new ATOM 0 HB1 ALA A 837 6.542 -9.696 -7.071 1.00 10.00 H new ATOM 0 HB2 ALA A 837 5.468 -8.293 -6.864 1.00 10.00 H new ATOM 0 HB3 ALA A 837 4.781 -9.890 -7.244 1.00 10.00 H new ATOM 238 N GLY A 838 4.969 -10.874 -10.108 1.00 10.00 N ATOM 239 CA GLY A 838 5.131 -12.109 -10.850 1.00 10.00 C ATOM 240 C GLY A 838 4.857 -13.327 -9.990 1.00 10.00 C ATOM 241 O GLY A 838 5.760 -14.120 -9.714 1.00 10.00 O ATOM 0 H GLY A 838 4.001 -10.586 -9.963 1.00 10.00 H new ATOM 0 HA2 GLY A 838 4.455 -12.110 -11.705 1.00 10.00 H new ATOM 0 HA3 GLY A 838 6.145 -12.165 -11.245 1.00 10.00 H new ATOM 245 N ASP A 839 3.597 -13.452 -9.566 1.00 10.00 N ATOM 246 CA ASP A 839 3.144 -14.550 -8.705 1.00 10.00 C ATOM 247 C ASP A 839 3.986 -14.645 -7.439 1.00 10.00 C ATOM 248 O ASP A 839 4.303 -15.731 -6.952 1.00 10.00 O ATOM 249 CB ASP A 839 3.149 -15.895 -9.446 1.00 10.00 C ATOM 250 CG ASP A 839 2.274 -16.920 -8.755 1.00 10.00 C ATOM 251 OD1 ASP A 839 1.160 -16.551 -8.323 1.00 10.00 O ATOM 252 OD2 ASP A 839 2.700 -18.096 -8.628 1.00 10.00 O ATOM 0 H ASP A 839 2.858 -12.792 -9.811 1.00 10.00 H new ATOM 0 HA ASP A 839 2.116 -14.324 -8.422 1.00 10.00 H new ATOM 0 HB2 ASP A 839 2.800 -15.748 -10.468 1.00 10.00 H new ATOM 0 HB3 ASP A 839 4.170 -16.272 -9.509 1.00 10.00 H new ATOM 257 N LYS A 840 4.343 -13.489 -6.900 1.00 10.00 N ATOM 258 CA LYS A 840 5.130 -13.430 -5.683 1.00 10.00 C ATOM 259 C LYS A 840 4.360 -12.679 -4.609 1.00 10.00 C ATOM 260 O LYS A 840 3.736 -11.650 -4.885 1.00 10.00 O ATOM 261 CB LYS A 840 6.484 -12.758 -5.952 1.00 10.00 C ATOM 262 CG LYS A 840 7.303 -13.478 -7.015 1.00 10.00 C ATOM 263 CD LYS A 840 8.509 -12.667 -7.451 1.00 10.00 C ATOM 264 CE LYS A 840 9.094 -13.216 -8.737 1.00 10.00 C ATOM 265 NZ LYS A 840 10.323 -12.491 -9.142 1.00 10.00 N ATOM 0 H LYS A 840 4.098 -12.578 -7.289 1.00 10.00 H new ATOM 0 HA LYS A 840 5.320 -14.444 -5.333 1.00 10.00 H new ATOM 0 HB2 LYS A 840 6.316 -11.728 -6.266 1.00 10.00 H new ATOM 0 HB3 LYS A 840 7.055 -12.720 -5.025 1.00 10.00 H new ATOM 0 HG2 LYS A 840 7.635 -14.441 -6.626 1.00 10.00 H new ATOM 0 HG3 LYS A 840 6.673 -13.684 -7.880 1.00 10.00 H new ATOM 0 HD2 LYS A 840 8.220 -11.626 -7.594 1.00 10.00 H new ATOM 0 HD3 LYS A 840 9.266 -12.683 -6.667 1.00 10.00 H new ATOM 0 HE2 LYS A 840 9.323 -14.274 -8.609 1.00 10.00 H new ATOM 0 HE3 LYS A 840 8.352 -13.145 -9.532 1.00 10.00 H new ATOM 0 HZ1 LYS A 840 10.691 -12.898 -10.026 1.00 10.00 H new ATOM 0 HZ2 LYS A 840 10.100 -11.486 -9.290 1.00 10.00 H new ATOM 0 HZ3 LYS A 840 11.041 -12.580 -8.395 1.00 10.00 H new ATOM 279 N ASN A 841 4.391 -13.203 -3.390 1.00 10.00 N ATOM 280 CA ASN A 841 3.695 -12.578 -2.266 1.00 10.00 C ATOM 281 C ASN A 841 4.542 -11.451 -1.689 1.00 10.00 C ATOM 282 O ASN A 841 4.139 -10.747 -0.763 1.00 10.00 O ATOM 283 CB ASN A 841 3.381 -13.620 -1.186 1.00 10.00 C ATOM 284 CG ASN A 841 2.045 -13.382 -0.503 1.00 10.00 C ATOM 285 OD1 ASN A 841 1.012 -13.912 -0.927 1.00 10.00 O ATOM 286 ND2 ASN A 841 2.044 -12.586 0.549 1.00 10.00 N ATOM 0 H ASN A 841 4.890 -14.060 -3.152 1.00 10.00 H new ATOM 0 HA ASN A 841 2.754 -12.160 -2.624 1.00 10.00 H new ATOM 0 HB2 ASN A 841 3.381 -14.613 -1.636 1.00 10.00 H new ATOM 0 HB3 ASN A 841 4.173 -13.609 -0.437 1.00 10.00 H new ATOM 0 HD21 ASN A 841 1.172 -12.391 1.040 1.00 10.00 H new ATOM 0 HD22 ASN A 841 2.916 -12.166 0.871 1.00 10.00 H new ATOM 293 N TYR A 842 5.728 -11.304 -2.245 1.00 10.00 N ATOM 294 CA TYR A 842 6.656 -10.269 -1.828 1.00 10.00 C ATOM 295 C TYR A 842 7.148 -9.542 -3.067 1.00 10.00 C ATOM 296 O TYR A 842 7.292 -10.153 -4.130 1.00 10.00 O ATOM 297 CB TYR A 842 7.841 -10.866 -1.050 1.00 10.00 C ATOM 298 CG TYR A 842 7.539 -12.204 -0.414 1.00 10.00 C ATOM 299 CD1 TYR A 842 8.105 -13.367 -0.914 1.00 10.00 C ATOM 300 CD2 TYR A 842 6.670 -12.311 0.666 1.00 10.00 C ATOM 301 CE1 TYR A 842 7.815 -14.598 -0.361 1.00 10.00 C ATOM 302 CE2 TYR A 842 6.381 -13.538 1.230 1.00 10.00 C ATOM 303 CZ TYR A 842 6.954 -14.678 0.710 1.00 10.00 C ATOM 304 OH TYR A 842 6.662 -15.900 1.262 1.00 10.00 O ATOM 0 H TYR A 842 6.076 -11.897 -2.998 1.00 10.00 H new ATOM 0 HA TYR A 842 6.148 -9.573 -1.160 1.00 10.00 H new ATOM 0 HB2 TYR A 842 8.688 -10.978 -1.726 1.00 10.00 H new ATOM 0 HB3 TYR A 842 8.144 -10.164 -0.273 1.00 10.00 H new ATOM 0 HD1 TYR A 842 8.785 -13.309 -1.751 1.00 10.00 H new ATOM 0 HD2 TYR A 842 6.213 -11.420 1.071 1.00 10.00 H new ATOM 0 HE1 TYR A 842 8.261 -15.494 -0.767 1.00 10.00 H new ATOM 0 HE2 TYR A 842 5.710 -13.604 2.074 1.00 10.00 H new ATOM 0 HH TYR A 842 6.376 -15.779 2.191 1.00 10.00 H new ATOM 314 N ILE A 843 7.393 -8.250 -2.938 1.00 10.00 N ATOM 315 CA ILE A 843 7.854 -7.450 -4.064 1.00 10.00 C ATOM 316 C ILE A 843 9.042 -6.585 -3.653 1.00 10.00 C ATOM 317 O ILE A 843 9.172 -6.222 -2.486 1.00 10.00 O ATOM 318 CB ILE A 843 6.716 -6.564 -4.647 1.00 10.00 C ATOM 319 CG1 ILE A 843 7.151 -5.911 -5.970 1.00 10.00 C ATOM 320 CG2 ILE A 843 6.279 -5.508 -3.638 1.00 10.00 C ATOM 321 CD1 ILE A 843 6.068 -5.081 -6.639 1.00 10.00 C ATOM 0 H ILE A 843 7.281 -7.731 -2.067 1.00 10.00 H new ATOM 0 HA ILE A 843 8.170 -8.139 -4.847 1.00 10.00 H new ATOM 0 HB ILE A 843 5.861 -7.207 -4.854 1.00 10.00 H new ATOM 0 HG12 ILE A 843 8.016 -5.275 -5.782 1.00 10.00 H new ATOM 0 HG13 ILE A 843 7.473 -6.692 -6.659 1.00 10.00 H new ATOM 0 HG21 ILE A 843 5.483 -4.901 -4.069 1.00 10.00 H new ATOM 0 HG22 ILE A 843 5.915 -5.997 -2.734 1.00 10.00 H new ATOM 0 HG23 ILE A 843 7.127 -4.870 -3.389 1.00 10.00 H new ATOM 0 HD11 ILE A 843 6.455 -4.656 -7.565 1.00 10.00 H new ATOM 0 HD12 ILE A 843 5.210 -5.715 -6.862 1.00 10.00 H new ATOM 0 HD13 ILE A 843 5.761 -4.276 -5.971 1.00 10.00 H new ATOM 333 N THR A 844 9.882 -6.270 -4.615 1.00 10.00 N ATOM 334 CA THR A 844 11.066 -5.459 -4.368 1.00 10.00 C ATOM 335 C THR A 844 10.648 -4.031 -3.971 1.00 10.00 C ATOM 336 O THR A 844 9.746 -3.442 -4.563 1.00 10.00 O ATOM 337 CB THR A 844 11.975 -5.434 -5.602 1.00 10.00 C ATOM 338 OG1 THR A 844 11.309 -6.068 -6.699 1.00 10.00 O ATOM 339 CG2 THR A 844 13.279 -6.160 -5.313 1.00 10.00 C ATOM 0 H THR A 844 9.770 -6.564 -5.585 1.00 10.00 H new ATOM 0 HA THR A 844 11.629 -5.902 -3.547 1.00 10.00 H new ATOM 0 HB THR A 844 12.197 -4.397 -5.855 1.00 10.00 H new ATOM 0 HG1 THR A 844 11.889 -6.050 -7.488 1.00 10.00 H new ATOM 0 HG21 THR A 844 13.914 -6.134 -6.199 1.00 10.00 H new ATOM 0 HG22 THR A 844 13.792 -5.671 -4.484 1.00 10.00 H new ATOM 0 HG23 THR A 844 13.068 -7.196 -5.049 1.00 10.00 H new ATOM 347 N MET A 845 11.348 -3.489 -2.987 1.00 10.00 N ATOM 348 CA MET A 845 11.050 -2.148 -2.458 1.00 10.00 C ATOM 349 C MET A 845 11.258 -1.083 -3.529 1.00 10.00 C ATOM 350 O MET A 845 10.448 -0.162 -3.680 1.00 10.00 O ATOM 351 CB MET A 845 11.908 -1.841 -1.225 1.00 10.00 C ATOM 352 CG MET A 845 13.394 -2.106 -1.419 1.00 10.00 C ATOM 353 SD MET A 845 14.351 -1.877 0.091 1.00 10.00 S ATOM 354 CE MET A 845 13.612 -3.115 1.156 1.00 10.00 C ATOM 0 H MET A 845 12.133 -3.953 -2.530 1.00 10.00 H new ATOM 0 HA MET A 845 10.002 -2.134 -2.158 1.00 10.00 H new ATOM 0 HB2 MET A 845 11.769 -0.795 -0.951 1.00 10.00 H new ATOM 0 HB3 MET A 845 11.549 -2.440 -0.388 1.00 10.00 H new ATOM 0 HG2 MET A 845 13.532 -3.125 -1.779 1.00 10.00 H new ATOM 0 HG3 MET A 845 13.779 -1.440 -2.191 1.00 10.00 H new ATOM 0 HE1 MET A 845 14.288 -3.335 1.982 1.00 10.00 H new ATOM 0 HE2 MET A 845 12.668 -2.739 1.550 1.00 10.00 H new ATOM 0 HE3 MET A 845 13.430 -4.025 0.584 1.00 10.00 H new ATOM 364 N ASP A 846 12.328 -1.222 -4.308 1.00 10.00 N ATOM 365 CA ASP A 846 12.614 -0.249 -5.340 1.00 10.00 C ATOM 366 C ASP A 846 11.697 -0.444 -6.547 1.00 10.00 C ATOM 367 O ASP A 846 11.391 0.513 -7.247 1.00 10.00 O ATOM 368 CB ASP A 846 14.080 -0.325 -5.767 1.00 10.00 C ATOM 369 CG ASP A 846 14.586 1.012 -6.262 1.00 10.00 C ATOM 370 OD1 ASP A 846 14.880 1.137 -7.476 1.00 10.00 O ATOM 371 OD2 ASP A 846 14.674 1.953 -5.446 1.00 10.00 O ATOM 0 H ASP A 846 12.997 -1.989 -4.241 1.00 10.00 H new ATOM 0 HA ASP A 846 12.426 0.741 -4.925 1.00 10.00 H new ATOM 0 HB2 ASP A 846 14.688 -0.656 -4.925 1.00 10.00 H new ATOM 0 HB3 ASP A 846 14.192 -1.071 -6.554 1.00 10.00 H new ATOM 376 N GLU A 847 11.250 -1.681 -6.773 1.00 10.00 N ATOM 377 CA GLU A 847 10.354 -1.980 -7.893 1.00 10.00 C ATOM 378 C GLU A 847 9.011 -1.282 -7.697 1.00 10.00 C ATOM 379 O GLU A 847 8.501 -0.626 -8.601 1.00 10.00 O ATOM 380 CB GLU A 847 10.137 -3.487 -8.024 1.00 10.00 C ATOM 381 CG GLU A 847 10.631 -4.084 -9.333 1.00 10.00 C ATOM 382 CD GLU A 847 9.736 -3.755 -10.511 1.00 10.00 C ATOM 383 OE1 GLU A 847 8.803 -4.541 -10.797 1.00 10.00 O ATOM 384 OE2 GLU A 847 9.963 -2.721 -11.169 1.00 10.00 O ATOM 0 H GLU A 847 11.492 -2.489 -6.199 1.00 10.00 H new ATOM 0 HA GLU A 847 10.819 -1.612 -8.808 1.00 10.00 H new ATOM 0 HB2 GLU A 847 10.642 -3.987 -7.198 1.00 10.00 H new ATOM 0 HB3 GLU A 847 9.073 -3.698 -7.922 1.00 10.00 H new ATOM 0 HG2 GLU A 847 11.638 -3.718 -9.536 1.00 10.00 H new ATOM 0 HG3 GLU A 847 10.701 -5.167 -9.228 1.00 10.00 H new ATOM 391 N LEU A 848 8.445 -1.405 -6.499 1.00 10.00 N ATOM 392 CA LEU A 848 7.172 -0.764 -6.199 1.00 10.00 C ATOM 393 C LEU A 848 7.351 0.754 -6.158 1.00 10.00 C ATOM 394 O LEU A 848 6.421 1.500 -6.453 1.00 10.00 O ATOM 395 CB LEU A 848 6.592 -1.298 -4.878 1.00 10.00 C ATOM 396 CG LEU A 848 7.163 -0.683 -3.601 1.00 10.00 C ATOM 397 CD1 LEU A 848 6.178 0.306 -2.991 1.00 10.00 C ATOM 398 CD2 LEU A 848 7.518 -1.773 -2.606 1.00 10.00 C ATOM 0 H LEU A 848 8.845 -1.938 -5.727 1.00 10.00 H new ATOM 0 HA LEU A 848 6.459 -1.003 -6.988 1.00 10.00 H new ATOM 0 HB2 LEU A 848 5.514 -1.136 -4.885 1.00 10.00 H new ATOM 0 HB3 LEU A 848 6.753 -2.376 -4.842 1.00 10.00 H new ATOM 0 HG LEU A 848 8.072 -0.138 -3.856 1.00 10.00 H new ATOM 0 HD11 LEU A 848 6.605 0.732 -2.083 1.00 10.00 H new ATOM 0 HD12 LEU A 848 5.974 1.104 -3.705 1.00 10.00 H new ATOM 0 HD13 LEU A 848 5.249 -0.209 -2.748 1.00 10.00 H new ATOM 0 HD21 LEU A 848 7.924 -1.321 -1.701 1.00 10.00 H new ATOM 0 HD22 LEU A 848 6.623 -2.344 -2.357 1.00 10.00 H new ATOM 0 HD23 LEU A 848 8.262 -2.438 -3.045 1.00 10.00 H new ATOM 410 N ARG A 849 8.560 1.206 -5.812 1.00 10.00 N ATOM 411 CA ARG A 849 8.870 2.636 -5.772 1.00 10.00 C ATOM 412 C ARG A 849 9.018 3.164 -7.194 1.00 10.00 C ATOM 413 O ARG A 849 8.979 4.370 -7.442 1.00 10.00 O ATOM 414 CB ARG A 849 10.152 2.890 -4.967 1.00 10.00 C ATOM 415 CG ARG A 849 10.525 4.360 -4.816 1.00 10.00 C ATOM 416 CD ARG A 849 11.429 4.572 -3.612 1.00 10.00 C ATOM 417 NE ARG A 849 12.603 3.698 -3.653 1.00 10.00 N ATOM 418 CZ ARG A 849 13.183 3.151 -2.581 1.00 10.00 C ATOM 419 NH1 ARG A 849 12.713 3.393 -1.355 1.00 10.00 N ATOM 420 NH2 ARG A 849 14.217 2.335 -2.741 1.00 10.00 N ATOM 0 H ARG A 849 9.340 0.601 -5.556 1.00 10.00 H new ATOM 0 HA ARG A 849 8.054 3.163 -5.278 1.00 10.00 H new ATOM 0 HB2 ARG A 849 10.035 2.455 -3.975 1.00 10.00 H new ATOM 0 HB3 ARG A 849 10.978 2.367 -5.449 1.00 10.00 H new ATOM 0 HG2 ARG A 849 11.029 4.706 -5.719 1.00 10.00 H new ATOM 0 HG3 ARG A 849 9.621 4.959 -4.706 1.00 10.00 H new ATOM 0 HD2 ARG A 849 11.752 5.613 -3.578 1.00 10.00 H new ATOM 0 HD3 ARG A 849 10.867 4.383 -2.698 1.00 10.00 H new ATOM 0 HE ARG A 849 13.007 3.492 -4.566 1.00 10.00 H new ATOM 0 HH11 ARG A 849 11.903 4.001 -1.230 1.00 10.00 H new ATOM 0 HH12 ARG A 849 13.164 2.970 -0.543 1.00 10.00 H new ATOM 0 HH21 ARG A 849 14.564 2.129 -3.678 1.00 10.00 H new ATOM 0 HH22 ARG A 849 14.665 1.914 -1.927 1.00 10.00 H new ATOM 434 N ARG A 850 9.207 2.243 -8.126 1.00 10.00 N ATOM 435 CA ARG A 850 9.327 2.589 -9.532 1.00 10.00 C ATOM 436 C ARG A 850 7.946 2.649 -10.169 1.00 10.00 C ATOM 437 O ARG A 850 7.719 3.357 -11.151 1.00 10.00 O ATOM 438 CB ARG A 850 10.211 1.568 -10.258 1.00 10.00 C ATOM 439 CG ARG A 850 11.564 2.124 -10.664 1.00 10.00 C ATOM 440 CD ARG A 850 12.349 2.613 -9.461 1.00 10.00 C ATOM 441 NE ARG A 850 12.078 4.015 -9.171 1.00 10.00 N ATOM 442 CZ ARG A 850 12.660 4.692 -8.187 1.00 10.00 C ATOM 443 NH1 ARG A 850 13.546 4.087 -7.401 1.00 10.00 N ATOM 444 NH2 ARG A 850 12.351 5.968 -7.992 1.00 10.00 N ATOM 0 H ARG A 850 9.281 1.244 -7.931 1.00 10.00 H new ATOM 0 HA ARG A 850 9.796 3.569 -9.618 1.00 10.00 H new ATOM 0 HB2 ARG A 850 10.361 0.703 -9.612 1.00 10.00 H new ATOM 0 HB3 ARG A 850 9.690 1.214 -11.148 1.00 10.00 H new ATOM 0 HG2 ARG A 850 12.134 1.353 -11.183 1.00 10.00 H new ATOM 0 HG3 ARG A 850 11.425 2.945 -11.367 1.00 10.00 H new ATOM 0 HD2 ARG A 850 12.096 2.007 -8.591 1.00 10.00 H new ATOM 0 HD3 ARG A 850 13.415 2.479 -9.644 1.00 10.00 H new ATOM 0 HE ARG A 850 11.402 4.505 -9.757 1.00 10.00 H new ATOM 0 HH11 ARG A 850 13.777 3.105 -7.554 1.00 10.00 H new ATOM 0 HH12 ARG A 850 13.994 4.605 -6.645 1.00 10.00 H new ATOM 0 HH21 ARG A 850 11.669 6.426 -8.597 1.00 10.00 H new ATOM 0 HH22 ARG A 850 12.796 6.491 -7.238 1.00 10.00 H new ATOM 458 N GLU A 851 7.016 1.899 -9.588 1.00 10.00 N ATOM 459 CA GLU A 851 5.654 1.857 -10.087 1.00 10.00 C ATOM 460 C GLU A 851 4.798 2.930 -9.429 1.00 10.00 C ATOM 461 O GLU A 851 4.139 3.722 -10.111 1.00 10.00 O ATOM 462 CB GLU A 851 5.037 0.479 -9.844 1.00 10.00 C ATOM 463 CG GLU A 851 5.616 -0.605 -10.738 1.00 10.00 C ATOM 464 CD GLU A 851 5.677 -0.202 -12.202 1.00 10.00 C ATOM 465 OE1 GLU A 851 4.897 0.682 -12.630 1.00 10.00 O ATOM 466 OE2 GLU A 851 6.504 -0.777 -12.935 1.00 10.00 O ATOM 0 H GLU A 851 7.185 1.313 -8.770 1.00 10.00 H new ATOM 0 HA GLU A 851 5.685 2.049 -11.160 1.00 10.00 H new ATOM 0 HB2 GLU A 851 5.188 0.200 -8.801 1.00 10.00 H new ATOM 0 HB3 GLU A 851 3.961 0.537 -10.005 1.00 10.00 H new ATOM 0 HG2 GLU A 851 6.620 -0.853 -10.394 1.00 10.00 H new ATOM 0 HG3 GLU A 851 5.013 -1.508 -10.641 1.00 10.00 H new ATOM 473 N LEU A 852 4.832 2.975 -8.110 1.00 10.00 N ATOM 474 CA LEU A 852 4.057 3.941 -7.359 1.00 10.00 C ATOM 475 C LEU A 852 4.914 5.147 -7.015 1.00 10.00 C ATOM 476 O LEU A 852 6.128 5.024 -6.870 1.00 10.00 O ATOM 477 CB LEU A 852 3.521 3.294 -6.080 1.00 10.00 C ATOM 478 CG LEU A 852 2.446 2.231 -6.297 1.00 10.00 C ATOM 479 CD1 LEU A 852 2.166 1.494 -4.999 1.00 10.00 C ATOM 480 CD2 LEU A 852 1.171 2.864 -6.837 1.00 10.00 C ATOM 0 H LEU A 852 5.393 2.348 -7.534 1.00 10.00 H new ATOM 0 HA LEU A 852 3.217 4.273 -7.969 1.00 10.00 H new ATOM 0 HB2 LEU A 852 4.355 2.842 -5.542 1.00 10.00 H new ATOM 0 HB3 LEU A 852 3.114 4.075 -5.438 1.00 10.00 H new ATOM 0 HG LEU A 852 2.810 1.514 -7.032 1.00 10.00 H new ATOM 0 HD11 LEU A 852 1.398 0.739 -5.168 1.00 10.00 H new ATOM 0 HD12 LEU A 852 3.079 1.011 -4.650 1.00 10.00 H new ATOM 0 HD13 LEU A 852 1.820 2.202 -4.246 1.00 10.00 H new ATOM 0 HD21 LEU A 852 0.416 2.092 -6.986 1.00 10.00 H new ATOM 0 HD22 LEU A 852 0.801 3.601 -6.125 1.00 10.00 H new ATOM 0 HD23 LEU A 852 1.382 3.353 -7.788 1.00 10.00 H new ATOM 492 N PRO A 853 4.302 6.333 -6.909 1.00 10.00 N ATOM 493 CA PRO A 853 5.028 7.559 -6.572 1.00 10.00 C ATOM 494 C PRO A 853 5.701 7.435 -5.211 1.00 10.00 C ATOM 495 O PRO A 853 5.171 6.761 -4.333 1.00 10.00 O ATOM 496 CB PRO A 853 3.939 8.644 -6.539 1.00 10.00 C ATOM 497 CG PRO A 853 2.643 7.911 -6.455 1.00 10.00 C ATOM 498 CD PRO A 853 2.864 6.580 -7.115 1.00 10.00 C ATOM 0 HA PRO A 853 5.822 7.781 -7.285 1.00 10.00 H new ATOM 0 HB2 PRO A 853 4.071 9.306 -5.683 1.00 10.00 H new ATOM 0 HB3 PRO A 853 3.980 9.267 -7.433 1.00 10.00 H new ATOM 0 HG2 PRO A 853 2.336 7.783 -5.417 1.00 10.00 H new ATOM 0 HG3 PRO A 853 1.850 8.466 -6.956 1.00 10.00 H new ATOM 0 HD2 PRO A 853 2.253 5.800 -6.661 1.00 10.00 H new ATOM 0 HD3 PRO A 853 2.609 6.609 -8.174 1.00 10.00 H new ATOM 506 N PRO A 854 6.881 8.065 -5.034 1.00 10.00 N ATOM 507 CA PRO A 854 7.638 8.021 -3.775 1.00 10.00 C ATOM 508 C PRO A 854 6.761 8.132 -2.527 1.00 10.00 C ATOM 509 O PRO A 854 6.950 7.397 -1.562 1.00 10.00 O ATOM 510 CB PRO A 854 8.545 9.239 -3.885 1.00 10.00 C ATOM 511 CG PRO A 854 8.796 9.402 -5.343 1.00 10.00 C ATOM 512 CD PRO A 854 7.589 8.850 -6.064 1.00 10.00 C ATOM 0 HA PRO A 854 8.157 7.070 -3.656 1.00 10.00 H new ATOM 0 HB2 PRO A 854 8.069 10.125 -3.465 1.00 10.00 H new ATOM 0 HB3 PRO A 854 9.476 9.088 -3.339 1.00 10.00 H new ATOM 0 HG2 PRO A 854 8.948 10.452 -5.593 1.00 10.00 H new ATOM 0 HG3 PRO A 854 9.700 8.870 -5.641 1.00 10.00 H new ATOM 0 HD2 PRO A 854 6.961 9.649 -6.458 1.00 10.00 H new ATOM 0 HD3 PRO A 854 7.880 8.227 -6.910 1.00 10.00 H new ATOM 520 N ASP A 855 5.782 9.032 -2.571 1.00 10.00 N ATOM 521 CA ASP A 855 4.873 9.258 -1.443 1.00 10.00 C ATOM 522 C ASP A 855 4.111 7.994 -1.057 1.00 10.00 C ATOM 523 O ASP A 855 4.131 7.567 0.097 1.00 10.00 O ATOM 524 CB ASP A 855 3.858 10.344 -1.796 1.00 10.00 C ATOM 525 CG ASP A 855 4.494 11.557 -2.437 1.00 10.00 C ATOM 526 OD1 ASP A 855 4.823 11.496 -3.640 1.00 10.00 O ATOM 527 OD2 ASP A 855 4.669 12.576 -1.743 1.00 10.00 O ATOM 0 H ASP A 855 5.595 9.623 -3.381 1.00 10.00 H new ATOM 0 HA ASP A 855 5.488 9.566 -0.597 1.00 10.00 H new ATOM 0 HB2 ASP A 855 3.112 9.930 -2.474 1.00 10.00 H new ATOM 0 HB3 ASP A 855 3.332 10.651 -0.892 1.00 10.00 H new ATOM 532 N GLN A 856 3.473 7.389 -2.039 1.00 10.00 N ATOM 533 CA GLN A 856 2.688 6.185 -1.820 1.00 10.00 C ATOM 534 C GLN A 856 3.628 5.000 -1.587 1.00 10.00 C ATOM 535 O GLN A 856 3.415 4.192 -0.689 1.00 10.00 O ATOM 536 CB GLN A 856 1.770 5.912 -3.016 1.00 10.00 C ATOM 537 CG GLN A 856 0.311 6.250 -2.755 1.00 10.00 C ATOM 538 CD GLN A 856 0.114 7.697 -2.340 1.00 10.00 C ATOM 539 OE1 GLN A 856 0.230 8.043 -1.166 1.00 10.00 O ATOM 540 NE2 GLN A 856 -0.201 8.551 -3.298 1.00 10.00 N ATOM 0 H GLN A 856 3.482 7.713 -3.006 1.00 10.00 H new ATOM 0 HA GLN A 856 2.061 6.326 -0.940 1.00 10.00 H new ATOM 0 HB2 GLN A 856 2.120 6.490 -3.871 1.00 10.00 H new ATOM 0 HB3 GLN A 856 1.847 4.860 -3.289 1.00 10.00 H new ATOM 0 HG2 GLN A 856 -0.271 6.051 -3.655 1.00 10.00 H new ATOM 0 HG3 GLN A 856 -0.076 5.596 -1.974 1.00 10.00 H new ATOM 0 HE21 GLN A 856 -0.288 8.227 -4.261 1.00 10.00 H new ATOM 0 HE22 GLN A 856 -0.357 9.534 -3.074 1.00 10.00 H new ATOM 549 N ALA A 857 4.668 4.939 -2.401 1.00 10.00 N ATOM 550 CA ALA A 857 5.670 3.883 -2.324 1.00 10.00 C ATOM 551 C ALA A 857 6.324 3.825 -0.952 1.00 10.00 C ATOM 552 O ALA A 857 6.474 2.744 -0.383 1.00 10.00 O ATOM 553 CB ALA A 857 6.716 4.097 -3.394 1.00 10.00 C ATOM 0 H ALA A 857 4.844 5.622 -3.138 1.00 10.00 H new ATOM 0 HA ALA A 857 5.169 2.929 -2.487 1.00 10.00 H new ATOM 0 HB1 ALA A 857 7.464 3.307 -3.335 1.00 10.00 H new ATOM 0 HB2 ALA A 857 6.242 4.075 -4.375 1.00 10.00 H new ATOM 0 HB3 ALA A 857 7.197 5.064 -3.245 1.00 10.00 H new ATOM 559 N GLU A 858 6.722 4.976 -0.414 1.00 10.00 N ATOM 560 CA GLU A 858 7.359 4.999 0.895 1.00 10.00 C ATOM 561 C GLU A 858 6.372 4.520 1.951 1.00 10.00 C ATOM 562 O GLU A 858 6.735 3.752 2.845 1.00 10.00 O ATOM 563 CB GLU A 858 7.905 6.390 1.244 1.00 10.00 C ATOM 564 CG GLU A 858 9.218 6.729 0.544 1.00 10.00 C ATOM 565 CD GLU A 858 10.361 5.812 0.951 1.00 10.00 C ATOM 566 OE1 GLU A 858 11.018 5.231 0.056 1.00 10.00 O ATOM 567 OE2 GLU A 858 10.615 5.680 2.172 1.00 10.00 O ATOM 0 H GLU A 858 6.616 5.889 -0.857 1.00 10.00 H new ATOM 0 HA GLU A 858 8.214 4.324 0.869 1.00 10.00 H new ATOM 0 HB2 GLU A 858 7.159 7.140 0.980 1.00 10.00 H new ATOM 0 HB3 GLU A 858 8.052 6.452 2.322 1.00 10.00 H new ATOM 0 HG2 GLU A 858 9.075 6.666 -0.535 1.00 10.00 H new ATOM 0 HG3 GLU A 858 9.488 7.760 0.770 1.00 10.00 H new ATOM 574 N TYR A 859 5.121 4.969 1.847 1.00 10.00 N ATOM 575 CA TYR A 859 4.086 4.544 2.783 1.00 10.00 C ATOM 576 C TYR A 859 3.881 3.035 2.677 1.00 10.00 C ATOM 577 O TYR A 859 3.754 2.350 3.685 1.00 10.00 O ATOM 578 CB TYR A 859 2.763 5.265 2.510 1.00 10.00 C ATOM 579 CG TYR A 859 1.613 4.812 3.398 1.00 10.00 C ATOM 580 CD1 TYR A 859 1.658 4.975 4.782 1.00 10.00 C ATOM 581 CD2 TYR A 859 0.478 4.231 2.849 1.00 10.00 C ATOM 582 CE1 TYR A 859 0.606 4.566 5.587 1.00 10.00 C ATOM 583 CE2 TYR A 859 -0.576 3.821 3.645 1.00 10.00 C ATOM 584 CZ TYR A 859 -0.509 3.989 5.012 1.00 10.00 C ATOM 585 OH TYR A 859 -1.563 3.575 5.806 1.00 10.00 O ATOM 0 H TYR A 859 4.804 5.621 1.130 1.00 10.00 H new ATOM 0 HA TYR A 859 4.413 4.800 3.791 1.00 10.00 H new ATOM 0 HB2 TYR A 859 2.911 6.336 2.644 1.00 10.00 H new ATOM 0 HB3 TYR A 859 2.486 5.110 1.467 1.00 10.00 H new ATOM 0 HD1 TYR A 859 2.528 5.428 5.235 1.00 10.00 H new ATOM 0 HD2 TYR A 859 0.417 4.097 1.779 1.00 10.00 H new ATOM 0 HE1 TYR A 859 0.658 4.698 6.658 1.00 10.00 H new ATOM 0 HE2 TYR A 859 -1.449 3.370 3.197 1.00 10.00 H new ATOM 0 HH TYR A 859 -2.267 3.192 5.242 1.00 10.00 H new ATOM 595 N CYS A 860 3.851 2.527 1.447 1.00 10.00 N ATOM 596 CA CYS A 860 3.684 1.099 1.212 1.00 10.00 C ATOM 597 C CYS A 860 4.850 0.319 1.815 1.00 10.00 C ATOM 598 O CYS A 860 4.642 -0.668 2.514 1.00 10.00 O ATOM 599 CB CYS A 860 3.569 0.798 -0.289 1.00 10.00 C ATOM 600 SG CYS A 860 2.043 1.391 -1.044 1.00 10.00 S ATOM 0 H CYS A 860 3.940 3.086 0.598 1.00 10.00 H new ATOM 0 HA CYS A 860 2.760 0.785 1.697 1.00 10.00 H new ATOM 0 HB2 CYS A 860 4.416 1.249 -0.805 1.00 10.00 H new ATOM 0 HB3 CYS A 860 3.641 -0.279 -0.439 1.00 10.00 H new ATOM 0 HG CYS A 860 1.056 1.225 -0.215 1.00 10.00 H new ATOM 606 N ILE A 861 6.069 0.785 1.559 1.00 10.00 N ATOM 607 CA ILE A 861 7.271 0.144 2.083 1.00 10.00 C ATOM 608 C ILE A 861 7.216 0.045 3.605 1.00 10.00 C ATOM 609 O ILE A 861 7.527 -1.002 4.186 1.00 10.00 O ATOM 610 CB ILE A 861 8.543 0.923 1.664 1.00 10.00 C ATOM 611 CG1 ILE A 861 8.854 0.674 0.186 1.00 10.00 C ATOM 612 CG2 ILE A 861 9.736 0.544 2.538 1.00 10.00 C ATOM 613 CD1 ILE A 861 9.933 1.582 -0.359 1.00 10.00 C ATOM 0 H ILE A 861 6.251 1.610 0.988 1.00 10.00 H new ATOM 0 HA ILE A 861 7.315 -0.860 1.662 1.00 10.00 H new ATOM 0 HB ILE A 861 8.353 1.987 1.807 1.00 10.00 H new ATOM 0 HG12 ILE A 861 9.162 -0.363 0.056 1.00 10.00 H new ATOM 0 HG13 ILE A 861 7.944 0.811 -0.398 1.00 10.00 H new ATOM 0 HG21 ILE A 861 10.614 1.107 2.220 1.00 10.00 H new ATOM 0 HG22 ILE A 861 9.513 0.777 3.579 1.00 10.00 H new ATOM 0 HG23 ILE A 861 9.934 -0.523 2.440 1.00 10.00 H new ATOM 0 HD11 ILE A 861 10.104 1.353 -1.411 1.00 10.00 H new ATOM 0 HD12 ILE A 861 9.618 2.621 -0.260 1.00 10.00 H new ATOM 0 HD13 ILE A 861 10.855 1.428 0.201 1.00 10.00 H new ATOM 625 N ALA A 862 6.799 1.134 4.243 1.00 10.00 N ATOM 626 CA ALA A 862 6.714 1.178 5.696 1.00 10.00 C ATOM 627 C ALA A 862 5.544 0.341 6.215 1.00 10.00 C ATOM 628 O ALA A 862 5.620 -0.243 7.299 1.00 10.00 O ATOM 629 CB ALA A 862 6.593 2.618 6.175 1.00 10.00 C ATOM 0 H ALA A 862 6.515 1.996 3.777 1.00 10.00 H new ATOM 0 HA ALA A 862 7.632 0.748 6.097 1.00 10.00 H new ATOM 0 HB1 ALA A 862 6.530 2.635 7.263 1.00 10.00 H new ATOM 0 HB2 ALA A 862 7.467 3.183 5.853 1.00 10.00 H new ATOM 0 HB3 ALA A 862 5.694 3.068 5.753 1.00 10.00 H new ATOM 635 N ARG A 863 4.473 0.270 5.431 1.00 10.00 N ATOM 636 CA ARG A 863 3.282 -0.485 5.821 1.00 10.00 C ATOM 637 C ARG A 863 3.438 -1.977 5.543 1.00 10.00 C ATOM 638 O ARG A 863 2.622 -2.778 5.995 1.00 10.00 O ATOM 639 CB ARG A 863 2.049 0.030 5.074 1.00 10.00 C ATOM 640 CG ARG A 863 1.247 1.086 5.817 1.00 10.00 C ATOM 641 CD ARG A 863 0.456 0.494 6.974 1.00 10.00 C ATOM 642 NE ARG A 863 -0.813 1.194 7.185 1.00 10.00 N ATOM 643 CZ ARG A 863 -1.584 1.033 8.259 1.00 10.00 C ATOM 644 NH1 ARG A 863 -1.220 0.194 9.220 1.00 10.00 N ATOM 645 NH2 ARG A 863 -2.725 1.709 8.375 1.00 10.00 N ATOM 0 H ARG A 863 4.403 0.725 4.521 1.00 10.00 H new ATOM 0 HA ARG A 863 3.155 -0.341 6.894 1.00 10.00 H new ATOM 0 HB2 ARG A 863 2.368 0.443 4.117 1.00 10.00 H new ATOM 0 HB3 ARG A 863 1.396 -0.814 4.855 1.00 10.00 H new ATOM 0 HG2 ARG A 863 1.922 1.854 6.195 1.00 10.00 H new ATOM 0 HG3 ARG A 863 0.563 1.576 5.124 1.00 10.00 H new ATOM 0 HD2 ARG A 863 0.260 -0.560 6.778 1.00 10.00 H new ATOM 0 HD3 ARG A 863 1.053 0.543 7.884 1.00 10.00 H new ATOM 0 HE ARG A 863 -1.126 1.845 6.465 1.00 10.00 H new ATOM 0 HH11 ARG A 863 -0.348 -0.329 9.137 1.00 10.00 H new ATOM 0 HH12 ARG A 863 -1.812 0.072 10.042 1.00 10.00 H new ATOM 0 HH21 ARG A 863 -3.013 2.354 7.639 1.00 10.00 H new ATOM 0 HH22 ARG A 863 -3.312 1.582 9.200 1.00 10.00 H new ATOM 659 N MET A 864 4.464 -2.348 4.795 1.00 10.00 N ATOM 660 CA MET A 864 4.696 -3.748 4.473 1.00 10.00 C ATOM 661 C MET A 864 5.321 -4.469 5.651 1.00 10.00 C ATOM 662 O MET A 864 5.730 -3.845 6.638 1.00 10.00 O ATOM 663 CB MET A 864 5.582 -3.891 3.231 1.00 10.00 C ATOM 664 CG MET A 864 4.855 -3.588 1.930 1.00 10.00 C ATOM 665 SD MET A 864 5.876 -3.848 0.470 1.00 10.00 S ATOM 666 CE MET A 864 4.683 -3.520 -0.827 1.00 10.00 C ATOM 0 H MET A 864 5.148 -1.702 4.400 1.00 10.00 H new ATOM 0 HA MET A 864 3.731 -4.205 4.255 1.00 10.00 H new ATOM 0 HB2 MET A 864 6.437 -3.221 3.325 1.00 10.00 H new ATOM 0 HB3 MET A 864 5.976 -4.907 3.190 1.00 10.00 H new ATOM 0 HG2 MET A 864 3.968 -4.218 1.862 1.00 10.00 H new ATOM 0 HG3 MET A 864 4.511 -2.554 1.946 1.00 10.00 H new ATOM 0 HE1 MET A 864 4.890 -4.163 -1.683 1.00 10.00 H new ATOM 0 HE2 MET A 864 3.678 -3.721 -0.456 1.00 10.00 H new ATOM 0 HE3 MET A 864 4.755 -2.476 -1.132 1.00 10.00 H new ATOM 676 N ALA A 865 5.403 -5.786 5.552 1.00 10.00 N ATOM 677 CA ALA A 865 5.978 -6.604 6.606 1.00 10.00 C ATOM 678 C ALA A 865 7.153 -7.410 6.052 1.00 10.00 C ATOM 679 O ALA A 865 7.201 -7.682 4.856 1.00 10.00 O ATOM 680 CB ALA A 865 4.916 -7.528 7.183 1.00 10.00 C ATOM 0 H ALA A 865 5.075 -6.315 4.744 1.00 10.00 H new ATOM 0 HA ALA A 865 6.345 -5.960 7.405 1.00 10.00 H new ATOM 0 HB1 ALA A 865 5.355 -8.138 7.973 1.00 10.00 H new ATOM 0 HB2 ALA A 865 4.101 -6.933 7.595 1.00 10.00 H new ATOM 0 HB3 ALA A 865 4.531 -8.176 6.396 1.00 10.00 H new ATOM 686 N PRO A 866 8.116 -7.775 6.912 1.00 10.00 N ATOM 687 CA PRO A 866 9.301 -8.539 6.504 1.00 10.00 C ATOM 688 C PRO A 866 8.965 -9.866 5.809 1.00 10.00 C ATOM 689 O PRO A 866 8.800 -10.881 6.477 1.00 10.00 O ATOM 690 CB PRO A 866 10.046 -8.800 7.822 1.00 10.00 C ATOM 691 CG PRO A 866 9.085 -8.472 8.911 1.00 10.00 C ATOM 692 CD PRO A 866 8.135 -7.459 8.348 1.00 10.00 C ATOM 0 HA PRO A 866 9.884 -7.986 5.768 1.00 10.00 H new ATOM 0 HB2 PRO A 866 10.370 -9.839 7.888 1.00 10.00 H new ATOM 0 HB3 PRO A 866 10.941 -8.182 7.893 1.00 10.00 H new ATOM 0 HG2 PRO A 866 8.551 -9.364 9.239 1.00 10.00 H new ATOM 0 HG3 PRO A 866 9.606 -8.074 9.782 1.00 10.00 H new ATOM 0 HD2 PRO A 866 7.144 -7.547 8.792 1.00 10.00 H new ATOM 0 HD3 PRO A 866 8.478 -6.441 8.531 1.00 10.00 H new ATOM 700 N TYR A 867 8.879 -9.791 4.468 1.00 10.00 N ATOM 701 CA TYR A 867 8.582 -10.915 3.553 1.00 10.00 C ATOM 702 C TYR A 867 7.893 -12.124 4.212 1.00 10.00 C ATOM 703 O TYR A 867 6.690 -12.292 4.047 1.00 10.00 O ATOM 704 CB TYR A 867 9.813 -11.350 2.706 1.00 10.00 C ATOM 705 CG TYR A 867 11.212 -11.075 3.263 1.00 10.00 C ATOM 706 CD1 TYR A 867 11.564 -9.845 3.819 1.00 10.00 C ATOM 707 CD2 TYR A 867 12.187 -12.063 3.205 1.00 10.00 C ATOM 708 CE1 TYR A 867 12.840 -9.614 4.313 1.00 10.00 C ATOM 709 CE2 TYR A 867 13.465 -11.834 3.695 1.00 10.00 C ATOM 710 CZ TYR A 867 13.782 -10.611 4.251 1.00 10.00 C ATOM 711 OH TYR A 867 15.050 -10.390 4.747 1.00 10.00 O ATOM 0 H TYR A 867 9.020 -8.912 3.970 1.00 10.00 H new ATOM 0 HA TYR A 867 7.841 -10.500 2.869 1.00 10.00 H new ATOM 0 HB2 TYR A 867 9.731 -12.422 2.527 1.00 10.00 H new ATOM 0 HB3 TYR A 867 9.739 -10.859 1.736 1.00 10.00 H new ATOM 0 HD1 TYR A 867 10.828 -9.056 3.866 1.00 10.00 H new ATOM 0 HD2 TYR A 867 11.947 -13.023 2.772 1.00 10.00 H new ATOM 0 HE1 TYR A 867 13.091 -8.656 4.744 1.00 10.00 H new ATOM 0 HE2 TYR A 867 14.212 -12.613 3.641 1.00 10.00 H new ATOM 0 HH TYR A 867 15.593 -11.197 4.627 1.00 10.00 H new ATOM 721 N THR A 868 8.629 -12.946 4.961 1.00 10.00 N ATOM 722 CA THR A 868 8.064 -14.128 5.612 1.00 10.00 C ATOM 723 C THR A 868 7.557 -15.178 4.620 1.00 10.00 C ATOM 724 O THR A 868 6.514 -15.024 3.977 1.00 10.00 O ATOM 725 CB THR A 868 6.945 -13.750 6.605 1.00 10.00 C ATOM 726 OG1 THR A 868 7.471 -12.863 7.599 1.00 10.00 O ATOM 727 CG2 THR A 868 6.378 -14.989 7.286 1.00 10.00 C ATOM 0 H THR A 868 9.626 -12.813 5.133 1.00 10.00 H new ATOM 0 HA THR A 868 8.888 -14.579 6.165 1.00 10.00 H new ATOM 0 HB THR A 868 6.143 -13.261 6.051 1.00 10.00 H new ATOM 0 HG1 THR A 868 7.734 -12.018 7.177 1.00 10.00 H new ATOM 0 HG21 THR A 868 5.591 -14.695 7.981 1.00 10.00 H new ATOM 0 HG22 THR A 868 5.965 -15.661 6.534 1.00 10.00 H new ATOM 0 HG23 THR A 868 7.171 -15.499 7.832 1.00 10.00 H new ATOM 735 N GLY A 869 8.313 -16.257 4.512 1.00 10.00 N ATOM 736 CA GLY A 869 7.961 -17.334 3.624 1.00 10.00 C ATOM 737 C GLY A 869 8.969 -18.463 3.694 1.00 10.00 C ATOM 738 O GLY A 869 9.727 -18.560 4.663 1.00 10.00 O ATOM 0 H GLY A 869 9.177 -16.404 5.034 1.00 10.00 H new ATOM 0 HA2 GLY A 869 6.972 -17.712 3.882 1.00 10.00 H new ATOM 0 HA3 GLY A 869 7.902 -16.960 2.602 1.00 10.00 H new ATOM 742 N PRO A 870 8.983 -19.342 2.685 1.00 10.00 N ATOM 743 CA PRO A 870 9.909 -20.468 2.621 1.00 10.00 C ATOM 744 C PRO A 870 11.238 -20.080 1.973 1.00 10.00 C ATOM 745 O PRO A 870 12.119 -20.917 1.774 1.00 10.00 O ATOM 746 CB PRO A 870 9.156 -21.459 1.736 1.00 10.00 C ATOM 747 CG PRO A 870 8.373 -20.606 0.797 1.00 10.00 C ATOM 748 CD PRO A 870 8.061 -19.326 1.534 1.00 10.00 C ATOM 0 HA PRO A 870 10.174 -20.854 3.605 1.00 10.00 H new ATOM 0 HB2 PRO A 870 9.844 -22.112 1.199 1.00 10.00 H new ATOM 0 HB3 PRO A 870 8.503 -22.101 2.327 1.00 10.00 H new ATOM 0 HG2 PRO A 870 8.944 -20.402 -0.109 1.00 10.00 H new ATOM 0 HG3 PRO A 870 7.456 -21.109 0.489 1.00 10.00 H new ATOM 0 HD2 PRO A 870 8.225 -18.452 0.903 1.00 10.00 H new ATOM 0 HD3 PRO A 870 7.020 -19.295 1.857 1.00 10.00 H new ATOM 756 N ASP A 871 11.394 -18.791 1.683 1.00 10.00 N ATOM 757 CA ASP A 871 12.599 -18.287 1.040 1.00 10.00 C ATOM 758 C ASP A 871 12.779 -16.802 1.320 1.00 10.00 C ATOM 759 O ASP A 871 11.954 -15.977 0.933 1.00 10.00 O ATOM 760 CB ASP A 871 12.552 -18.510 -0.480 1.00 10.00 C ATOM 761 CG ASP A 871 13.850 -18.103 -1.162 1.00 10.00 C ATOM 762 OD1 ASP A 871 14.909 -18.672 -0.826 1.00 10.00 O ATOM 763 OD2 ASP A 871 13.816 -17.227 -2.053 1.00 10.00 O ATOM 0 H ASP A 871 10.696 -18.075 1.885 1.00 10.00 H new ATOM 0 HA ASP A 871 13.443 -18.839 1.454 1.00 10.00 H new ATOM 0 HB2 ASP A 871 12.350 -19.561 -0.685 1.00 10.00 H new ATOM 0 HB3 ASP A 871 11.726 -17.938 -0.904 1.00 10.00 H new ATOM 768 N SER A 872 13.866 -16.482 1.990 1.00 10.00 N ATOM 769 CA SER A 872 14.184 -15.107 2.346 1.00 10.00 C ATOM 770 C SER A 872 14.545 -14.306 1.107 1.00 10.00 C ATOM 771 O SER A 872 15.607 -14.496 0.524 1.00 10.00 O ATOM 772 CB SER A 872 15.342 -15.102 3.350 1.00 10.00 C ATOM 773 OG SER A 872 15.699 -13.791 3.739 1.00 10.00 O ATOM 0 H SER A 872 14.556 -17.164 2.305 1.00 10.00 H new ATOM 0 HA SER A 872 13.311 -14.640 2.803 1.00 10.00 H new ATOM 0 HB2 SER A 872 15.060 -15.678 4.232 1.00 10.00 H new ATOM 0 HB3 SER A 872 16.207 -15.598 2.909 1.00 10.00 H new ATOM 0 HG SER A 872 16.439 -13.830 4.380 1.00 10.00 H new ATOM 779 N VAL A 873 13.630 -13.446 0.674 1.00 10.00 N ATOM 780 CA VAL A 873 13.845 -12.605 -0.484 1.00 10.00 C ATOM 781 C VAL A 873 14.414 -11.237 -0.076 1.00 10.00 C ATOM 782 O VAL A 873 13.700 -10.391 0.465 1.00 10.00 O ATOM 783 CB VAL A 873 12.519 -12.430 -1.271 1.00 10.00 C ATOM 784 CG1 VAL A 873 12.203 -13.690 -2.057 1.00 10.00 C ATOM 785 CG2 VAL A 873 11.357 -12.106 -0.339 1.00 10.00 C ATOM 0 H VAL A 873 12.721 -13.317 1.119 1.00 10.00 H new ATOM 0 HA VAL A 873 14.576 -13.092 -1.129 1.00 10.00 H new ATOM 0 HB VAL A 873 12.652 -11.595 -1.958 1.00 10.00 H new ATOM 0 HG11 VAL A 873 11.270 -13.553 -2.604 1.00 10.00 H new ATOM 0 HG12 VAL A 873 13.010 -13.892 -2.761 1.00 10.00 H new ATOM 0 HG13 VAL A 873 12.101 -14.531 -1.371 1.00 10.00 H new ATOM 0 HG21 VAL A 873 10.444 -11.990 -0.923 1.00 10.00 H new ATOM 0 HG22 VAL A 873 11.229 -12.917 0.378 1.00 10.00 H new ATOM 0 HG23 VAL A 873 11.566 -11.179 0.195 1.00 10.00 H new ATOM 795 N PRO A 874 15.722 -11.005 -0.292 1.00 10.00 N ATOM 796 CA PRO A 874 16.364 -9.736 0.068 1.00 10.00 C ATOM 797 C PRO A 874 15.909 -8.580 -0.826 1.00 10.00 C ATOM 798 O PRO A 874 15.781 -8.734 -2.047 1.00 10.00 O ATOM 799 CB PRO A 874 17.870 -10.004 -0.133 1.00 10.00 C ATOM 800 CG PRO A 874 18.008 -11.469 -0.381 1.00 10.00 C ATOM 801 CD PRO A 874 16.681 -11.949 -0.898 1.00 10.00 C ATOM 0 HA PRO A 874 16.109 -9.436 1.084 1.00 10.00 H new ATOM 0 HB2 PRO A 874 18.258 -9.430 -0.974 1.00 10.00 H new ATOM 0 HB3 PRO A 874 18.439 -9.704 0.747 1.00 10.00 H new ATOM 0 HG2 PRO A 874 18.799 -11.666 -1.105 1.00 10.00 H new ATOM 0 HG3 PRO A 874 18.278 -11.993 0.536 1.00 10.00 H new ATOM 0 HD2 PRO A 874 16.639 -11.922 -1.987 1.00 10.00 H new ATOM 0 HD3 PRO A 874 16.479 -12.977 -0.597 1.00 10.00 H new ATOM 809 N GLY A 875 15.689 -7.417 -0.215 1.00 10.00 N ATOM 810 CA GLY A 875 15.256 -6.242 -0.959 1.00 10.00 C ATOM 811 C GLY A 875 13.788 -6.303 -1.330 1.00 10.00 C ATOM 812 O GLY A 875 13.265 -5.407 -1.996 1.00 10.00 O ATOM 0 H GLY A 875 15.803 -7.266 0.787 1.00 10.00 H new ATOM 0 HA2 GLY A 875 15.440 -5.349 -0.362 1.00 10.00 H new ATOM 0 HA3 GLY A 875 15.854 -6.149 -1.866 1.00 10.00 H new ATOM 816 N ALA A 876 13.126 -7.352 -0.884 1.00 10.00 N ATOM 817 CA ALA A 876 11.718 -7.544 -1.172 1.00 10.00 C ATOM 818 C ALA A 876 10.960 -7.839 0.108 1.00 10.00 C ATOM 819 O ALA A 876 11.440 -8.582 0.959 1.00 10.00 O ATOM 820 CB ALA A 876 11.543 -8.679 -2.165 1.00 10.00 C ATOM 0 H ALA A 876 13.544 -8.090 -0.317 1.00 10.00 H new ATOM 0 HA ALA A 876 11.316 -6.630 -1.610 1.00 10.00 H new ATOM 0 HB1 ALA A 876 10.483 -8.817 -2.376 1.00 10.00 H new ATOM 0 HB2 ALA A 876 12.069 -8.438 -3.089 1.00 10.00 H new ATOM 0 HB3 ALA A 876 11.952 -9.597 -1.744 1.00 10.00 H new ATOM 826 N LEU A 877 9.786 -7.248 0.256 1.00 10.00 N ATOM 827 CA LEU A 877 8.988 -7.459 1.451 1.00 10.00 C ATOM 828 C LEU A 877 7.576 -7.901 1.102 1.00 10.00 C ATOM 829 O LEU A 877 7.127 -7.740 -0.038 1.00 10.00 O ATOM 830 CB LEU A 877 8.951 -6.197 2.325 1.00 10.00 C ATOM 831 CG LEU A 877 9.952 -6.192 3.488 1.00 10.00 C ATOM 832 CD1 LEU A 877 11.365 -5.951 2.981 1.00 10.00 C ATOM 833 CD2 LEU A 877 9.573 -5.142 4.524 1.00 10.00 C ATOM 0 H LEU A 877 9.367 -6.622 -0.432 1.00 10.00 H new ATOM 0 HA LEU A 877 9.464 -8.257 2.021 1.00 10.00 H new ATOM 0 HB2 LEU A 877 9.144 -5.329 1.694 1.00 10.00 H new ATOM 0 HB3 LEU A 877 7.945 -6.081 2.729 1.00 10.00 H new ATOM 0 HG LEU A 877 9.919 -7.172 3.965 1.00 10.00 H new ATOM 0 HD11 LEU A 877 12.058 -5.951 3.822 1.00 10.00 H new ATOM 0 HD12 LEU A 877 11.641 -6.741 2.283 1.00 10.00 H new ATOM 0 HD13 LEU A 877 11.410 -4.987 2.474 1.00 10.00 H new ATOM 0 HD21 LEU A 877 10.297 -5.157 5.339 1.00 10.00 H new ATOM 0 HD22 LEU A 877 9.571 -4.156 4.059 1.00 10.00 H new ATOM 0 HD23 LEU A 877 8.580 -5.360 4.917 1.00 10.00 H new ATOM 845 N ASP A 878 6.896 -8.471 2.090 1.00 10.00 N ATOM 846 CA ASP A 878 5.529 -8.951 1.917 1.00 10.00 C ATOM 847 C ASP A 878 4.571 -7.802 1.626 1.00 10.00 C ATOM 848 O ASP A 878 4.420 -6.889 2.442 1.00 10.00 O ATOM 849 CB ASP A 878 5.058 -9.693 3.166 1.00 10.00 C ATOM 850 CG ASP A 878 3.662 -10.242 2.992 1.00 10.00 C ATOM 851 OD1 ASP A 878 3.521 -11.334 2.414 1.00 10.00 O ATOM 852 OD2 ASP A 878 2.698 -9.579 3.426 1.00 10.00 O ATOM 0 H ASP A 878 7.273 -8.613 3.027 1.00 10.00 H new ATOM 0 HA ASP A 878 5.529 -9.632 1.066 1.00 10.00 H new ATOM 0 HB2 ASP A 878 5.746 -10.509 3.386 1.00 10.00 H new ATOM 0 HB3 ASP A 878 5.080 -9.018 4.021 1.00 10.00 H new ATOM 857 N TYR A 879 3.935 -7.848 0.462 1.00 10.00 N ATOM 858 CA TYR A 879 2.995 -6.801 0.067 1.00 10.00 C ATOM 859 C TYR A 879 1.609 -7.042 0.653 1.00 10.00 C ATOM 860 O TYR A 879 0.860 -6.099 0.907 1.00 10.00 O ATOM 861 CB TYR A 879 2.895 -6.712 -1.464 1.00 10.00 C ATOM 862 CG TYR A 879 1.858 -7.635 -2.077 1.00 10.00 C ATOM 863 CD1 TYR A 879 0.591 -7.167 -2.417 1.00 10.00 C ATOM 864 CD2 TYR A 879 2.141 -8.974 -2.305 1.00 10.00 C ATOM 865 CE1 TYR A 879 -0.356 -8.007 -2.965 1.00 10.00 C ATOM 866 CE2 TYR A 879 1.194 -9.820 -2.853 1.00 10.00 C ATOM 867 CZ TYR A 879 -0.050 -9.333 -3.183 1.00 10.00 C ATOM 868 OH TYR A 879 -0.991 -10.178 -3.729 1.00 10.00 O ATOM 0 H TYR A 879 4.051 -8.594 -0.224 1.00 10.00 H new ATOM 0 HA TYR A 879 3.377 -5.859 0.461 1.00 10.00 H new ATOM 0 HB2 TYR A 879 2.659 -5.685 -1.742 1.00 10.00 H new ATOM 0 HB3 TYR A 879 3.870 -6.943 -1.894 1.00 10.00 H new ATOM 0 HD1 TYR A 879 0.346 -6.129 -2.249 1.00 10.00 H new ATOM 0 HD2 TYR A 879 3.116 -9.362 -2.051 1.00 10.00 H new ATOM 0 HE1 TYR A 879 -1.334 -7.627 -3.222 1.00 10.00 H new ATOM 0 HE2 TYR A 879 1.430 -10.860 -3.022 1.00 10.00 H new ATOM 0 HH TYR A 879 -1.408 -9.746 -4.504 1.00 10.00 H new ATOM 878 N MET A 880 1.285 -8.312 0.882 1.00 10.00 N ATOM 879 CA MET A 880 -0.019 -8.711 1.417 1.00 10.00 C ATOM 880 C MET A 880 -0.316 -8.010 2.745 1.00 10.00 C ATOM 881 O MET A 880 -1.474 -7.763 3.077 1.00 10.00 O ATOM 882 CB MET A 880 -0.057 -10.232 1.596 1.00 10.00 C ATOM 883 CG MET A 880 -1.408 -10.777 2.034 1.00 10.00 C ATOM 884 SD MET A 880 -1.412 -12.576 2.198 1.00 10.00 S ATOM 885 CE MET A 880 -0.330 -12.788 3.608 1.00 10.00 C ATOM 0 H MET A 880 1.915 -9.094 0.703 1.00 10.00 H new ATOM 0 HA MET A 880 -0.789 -8.410 0.707 1.00 10.00 H new ATOM 0 HB2 MET A 880 0.224 -10.704 0.655 1.00 10.00 H new ATOM 0 HB3 MET A 880 0.693 -10.518 2.333 1.00 10.00 H new ATOM 0 HG2 MET A 880 -1.684 -10.328 2.988 1.00 10.00 H new ATOM 0 HG3 MET A 880 -2.167 -10.480 1.310 1.00 10.00 H new ATOM 0 HE1 MET A 880 -0.450 -13.794 4.011 1.00 10.00 H new ATOM 0 HE2 MET A 880 0.705 -12.642 3.298 1.00 10.00 H new ATOM 0 HE3 MET A 880 -0.585 -12.057 4.376 1.00 10.00 H new ATOM 895 N SER A 881 0.731 -7.700 3.480 1.00 10.00 N ATOM 896 CA SER A 881 0.591 -7.033 4.753 1.00 10.00 C ATOM 897 C SER A 881 0.044 -5.617 4.570 1.00 10.00 C ATOM 898 O SER A 881 -0.702 -5.119 5.419 1.00 10.00 O ATOM 899 CB SER A 881 1.933 -7.020 5.465 1.00 10.00 C ATOM 900 OG SER A 881 2.380 -8.341 5.711 1.00 10.00 O ATOM 0 H SER A 881 1.695 -7.902 3.213 1.00 10.00 H new ATOM 0 HA SER A 881 -0.126 -7.578 5.367 1.00 10.00 H new ATOM 0 HB2 SER A 881 2.667 -6.489 4.859 1.00 10.00 H new ATOM 0 HB3 SER A 881 1.846 -6.479 6.407 1.00 10.00 H new ATOM 0 HG SER A 881 2.484 -8.815 4.860 1.00 10.00 H new ATOM 906 N PHE A 882 0.397 -4.981 3.452 1.00 10.00 N ATOM 907 CA PHE A 882 -0.072 -3.630 3.165 1.00 10.00 C ATOM 908 C PHE A 882 -1.574 -3.643 2.917 1.00 10.00 C ATOM 909 O PHE A 882 -2.314 -2.828 3.467 1.00 10.00 O ATOM 910 CB PHE A 882 0.652 -3.050 1.944 1.00 10.00 C ATOM 911 CG PHE A 882 0.173 -1.672 1.569 1.00 10.00 C ATOM 912 CD1 PHE A 882 0.738 -0.558 2.152 1.00 10.00 C ATOM 913 CD2 PHE A 882 -0.846 -1.493 0.642 1.00 10.00 C ATOM 914 CE1 PHE A 882 0.303 0.712 1.830 1.00 10.00 C ATOM 915 CE2 PHE A 882 -1.286 -0.224 0.310 1.00 10.00 C ATOM 916 CZ PHE A 882 -0.710 0.879 0.909 1.00 10.00 C ATOM 0 H PHE A 882 1.003 -5.380 2.735 1.00 10.00 H new ATOM 0 HA PHE A 882 0.146 -3.000 4.028 1.00 10.00 H new ATOM 0 HB2 PHE A 882 1.722 -3.013 2.148 1.00 10.00 H new ATOM 0 HB3 PHE A 882 0.513 -3.719 1.095 1.00 10.00 H new ATOM 0 HD1 PHE A 882 1.534 -0.681 2.872 1.00 10.00 H new ATOM 0 HD2 PHE A 882 -1.300 -2.354 0.175 1.00 10.00 H new ATOM 0 HE1 PHE A 882 0.755 1.574 2.299 1.00 10.00 H new ATOM 0 HE2 PHE A 882 -2.077 -0.097 -0.415 1.00 10.00 H new ATOM 0 HZ PHE A 882 -1.053 1.872 0.656 1.00 10.00 H new ATOM 926 N SER A 883 -2.016 -4.588 2.097 1.00 10.00 N ATOM 927 CA SER A 883 -3.425 -4.724 1.764 1.00 10.00 C ATOM 928 C SER A 883 -4.233 -5.130 2.988 1.00 10.00 C ATOM 929 O SER A 883 -5.405 -4.790 3.112 1.00 10.00 O ATOM 930 CB SER A 883 -3.590 -5.768 0.667 1.00 10.00 C ATOM 931 OG SER A 883 -2.322 -6.187 0.188 1.00 10.00 O ATOM 0 H SER A 883 -1.412 -5.276 1.648 1.00 10.00 H new ATOM 0 HA SER A 883 -3.795 -3.761 1.413 1.00 10.00 H new ATOM 0 HB2 SER A 883 -4.142 -6.625 1.052 1.00 10.00 H new ATOM 0 HB3 SER A 883 -4.177 -5.354 -0.153 1.00 10.00 H new ATOM 0 HG SER A 883 -2.412 -6.516 -0.731 1.00 10.00 H new ATOM 937 N THR A 884 -3.588 -5.845 3.899 1.00 10.00 N ATOM 938 CA THR A 884 -4.235 -6.284 5.122 1.00 10.00 C ATOM 939 C THR A 884 -4.393 -5.104 6.074 1.00 10.00 C ATOM 940 O THR A 884 -5.458 -4.905 6.671 1.00 10.00 O ATOM 941 CB THR A 884 -3.430 -7.412 5.800 1.00 10.00 C ATOM 942 OG1 THR A 884 -3.267 -8.506 4.885 1.00 10.00 O ATOM 943 CG2 THR A 884 -4.119 -7.900 7.070 1.00 10.00 C ATOM 0 H THR A 884 -2.613 -6.133 3.811 1.00 10.00 H new ATOM 0 HA THR A 884 -5.220 -6.678 4.870 1.00 10.00 H new ATOM 0 HB THR A 884 -2.454 -7.014 6.077 1.00 10.00 H new ATOM 0 HG1 THR A 884 -2.512 -8.323 4.288 1.00 10.00 H new ATOM 0 HG21 THR A 884 -3.526 -8.695 7.523 1.00 10.00 H new ATOM 0 HG22 THR A 884 -4.215 -7.073 7.773 1.00 10.00 H new ATOM 0 HG23 THR A 884 -5.109 -8.282 6.823 1.00 10.00 H new ATOM 951 N ALA A 885 -3.340 -4.305 6.188 1.00 10.00 N ATOM 952 CA ALA A 885 -3.357 -3.134 7.046 1.00 10.00 C ATOM 953 C ALA A 885 -4.370 -2.118 6.529 1.00 10.00 C ATOM 954 O ALA A 885 -5.076 -1.464 7.296 1.00 10.00 O ATOM 955 CB ALA A 885 -1.974 -2.509 7.114 1.00 10.00 C ATOM 0 H ALA A 885 -2.460 -4.450 5.693 1.00 10.00 H new ATOM 0 HA ALA A 885 -3.649 -3.441 8.050 1.00 10.00 H new ATOM 0 HB1 ALA A 885 -2.002 -1.632 7.761 1.00 10.00 H new ATOM 0 HB2 ALA A 885 -1.266 -3.234 7.516 1.00 10.00 H new ATOM 0 HB3 ALA A 885 -1.659 -2.212 6.114 1.00 10.00 H new ATOM 961 N LEU A 886 -4.438 -2.018 5.208 1.00 10.00 N ATOM 962 CA LEU A 886 -5.343 -1.094 4.537 1.00 10.00 C ATOM 963 C LEU A 886 -6.776 -1.622 4.536 1.00 10.00 C ATOM 964 O LEU A 886 -7.729 -0.860 4.380 1.00 10.00 O ATOM 965 CB LEU A 886 -4.861 -0.871 3.103 1.00 10.00 C ATOM 966 CG LEU A 886 -5.689 0.110 2.271 1.00 10.00 C ATOM 967 CD1 LEU A 886 -5.627 1.505 2.868 1.00 10.00 C ATOM 968 CD2 LEU A 886 -5.195 0.126 0.834 1.00 10.00 C ATOM 0 H LEU A 886 -3.868 -2.575 4.572 1.00 10.00 H new ATOM 0 HA LEU A 886 -5.341 -0.148 5.079 1.00 10.00 H new ATOM 0 HB2 LEU A 886 -3.832 -0.513 3.136 1.00 10.00 H new ATOM 0 HB3 LEU A 886 -4.847 -1.833 2.590 1.00 10.00 H new ATOM 0 HG LEU A 886 -6.728 -0.220 2.281 1.00 10.00 H new ATOM 0 HD11 LEU A 886 -6.222 2.187 2.261 1.00 10.00 H new ATOM 0 HD12 LEU A 886 -6.022 1.484 3.884 1.00 10.00 H new ATOM 0 HD13 LEU A 886 -4.592 1.846 2.888 1.00 10.00 H new ATOM 0 HD21 LEU A 886 -5.792 0.828 0.252 1.00 10.00 H new ATOM 0 HD22 LEU A 886 -4.150 0.434 0.812 1.00 10.00 H new ATOM 0 HD23 LEU A 886 -5.289 -0.872 0.406 1.00 10.00 H new ATOM 980 N TYR A 887 -6.923 -2.928 4.724 1.00 10.00 N ATOM 981 CA TYR A 887 -8.238 -3.556 4.736 1.00 10.00 C ATOM 982 C TYR A 887 -8.981 -3.244 6.036 1.00 10.00 C ATOM 983 O TYR A 887 -10.192 -3.028 6.033 1.00 10.00 O ATOM 984 CB TYR A 887 -8.108 -5.071 4.563 1.00 10.00 C ATOM 985 CG TYR A 887 -9.345 -5.723 3.998 1.00 10.00 C ATOM 986 CD1 TYR A 887 -10.366 -6.174 4.827 1.00 10.00 C ATOM 987 CD2 TYR A 887 -9.494 -5.880 2.628 1.00 10.00 C ATOM 988 CE1 TYR A 887 -11.500 -6.758 4.302 1.00 10.00 C ATOM 989 CE2 TYR A 887 -10.622 -6.466 2.098 1.00 10.00 C ATOM 990 CZ TYR A 887 -11.622 -6.901 2.937 1.00 10.00 C ATOM 991 OH TYR A 887 -12.752 -7.481 2.408 1.00 10.00 O ATOM 0 H TYR A 887 -6.147 -3.573 4.870 1.00 10.00 H new ATOM 0 HA TYR A 887 -8.812 -3.150 3.903 1.00 10.00 H new ATOM 0 HB2 TYR A 887 -7.264 -5.282 3.906 1.00 10.00 H new ATOM 0 HB3 TYR A 887 -7.880 -5.520 5.530 1.00 10.00 H new ATOM 0 HD1 TYR A 887 -10.270 -6.066 5.897 1.00 10.00 H new ATOM 0 HD2 TYR A 887 -8.713 -5.537 1.966 1.00 10.00 H new ATOM 0 HE1 TYR A 887 -12.287 -7.101 4.957 1.00 10.00 H new ATOM 0 HE2 TYR A 887 -10.721 -6.584 1.029 1.00 10.00 H new ATOM 0 HH TYR A 887 -12.681 -7.505 1.431 1.00 10.00 H new ATOM 1001 N GLY A 888 -8.240 -3.205 7.134 1.00 10.00 N ATOM 1002 CA GLY A 888 -8.838 -2.933 8.426 1.00 10.00 C ATOM 1003 C GLY A 888 -9.109 -1.459 8.647 1.00 10.00 C ATOM 1004 O GLY A 888 -8.184 -0.676 8.822 1.00 10.00 O ATOM 0 H GLY A 888 -7.232 -3.357 7.153 1.00 10.00 H new ATOM 0 HA2 GLY A 888 -9.773 -3.487 8.513 1.00 10.00 H new ATOM 0 HA3 GLY A 888 -8.177 -3.298 9.212 1.00 10.00 H new ATOM 1008 N GLU A 889 -10.381 -1.084 8.634 1.00 10.00 N ATOM 1009 CA GLU A 889 -10.782 0.303 8.848 1.00 10.00 C ATOM 1010 C GLU A 889 -11.113 0.520 10.318 1.00 10.00 C ATOM 1011 O GLU A 889 -11.485 -0.423 11.024 1.00 10.00 O ATOM 1012 CB GLU A 889 -12.008 0.652 7.998 1.00 10.00 C ATOM 1013 CG GLU A 889 -11.821 1.877 7.114 1.00 10.00 C ATOM 1014 CD GLU A 889 -13.065 2.738 7.052 1.00 10.00 C ATOM 1015 OE1 GLU A 889 -13.707 2.785 5.984 1.00 10.00 O ATOM 1016 OE2 GLU A 889 -13.413 3.370 8.071 1.00 10.00 O ATOM 0 H GLU A 889 -11.159 -1.725 8.476 1.00 10.00 H new ATOM 0 HA GLU A 889 -9.955 0.949 8.554 1.00 10.00 H new ATOM 0 HB2 GLU A 889 -12.256 -0.203 7.369 1.00 10.00 H new ATOM 0 HB3 GLU A 889 -12.859 0.820 8.658 1.00 10.00 H new ATOM 0 HG2 GLU A 889 -10.989 2.471 7.492 1.00 10.00 H new ATOM 0 HG3 GLU A 889 -11.553 1.558 6.107 1.00 10.00 H new ATOM 1183 N LEU B1653 -5.125 0.961 -11.321 1.00 10.00 N ATOM 1184 CA LEU B1653 -6.148 0.376 -10.459 1.00 10.00 C ATOM 1185 C LEU B1653 -5.930 0.765 -9.004 1.00 10.00 C ATOM 1186 O LEU B1653 -6.890 0.974 -8.256 1.00 10.00 O ATOM 1187 CB LEU B1653 -6.141 -1.147 -10.581 1.00 10.00 C ATOM 1188 CG LEU B1653 -6.513 -1.689 -11.960 1.00 10.00 C ATOM 1189 CD1 LEU B1653 -6.446 -3.209 -11.965 1.00 10.00 C ATOM 1190 CD2 LEU B1653 -7.900 -1.216 -12.361 1.00 10.00 C ATOM 0 HA LEU B1653 -7.113 0.763 -10.784 1.00 10.00 H new ATOM 0 HB2 LEU B1653 -5.148 -1.512 -10.320 1.00 10.00 H new ATOM 0 HB3 LEU B1653 -6.834 -1.558 -9.847 1.00 10.00 H new ATOM 0 HG LEU B1653 -5.797 -1.308 -12.688 1.00 10.00 H new ATOM 0 HD11 LEU B1653 -6.713 -3.582 -12.954 1.00 10.00 H new ATOM 0 HD12 LEU B1653 -5.434 -3.529 -11.718 1.00 10.00 H new ATOM 0 HD13 LEU B1653 -7.143 -3.606 -11.227 1.00 10.00 H new ATOM 0 HD21 LEU B1653 -8.149 -1.611 -13.346 1.00 10.00 H new ATOM 0 HD22 LEU B1653 -8.630 -1.570 -11.633 1.00 10.00 H new ATOM 0 HD23 LEU B1653 -7.918 -0.127 -12.392 1.00 10.00 H new ATOM 1202 N ILE B1654 -4.667 0.851 -8.606 1.00 10.00 N ATOM 1203 CA ILE B1654 -4.322 1.215 -7.238 1.00 10.00 C ATOM 1204 C ILE B1654 -4.788 2.630 -6.940 1.00 10.00 C ATOM 1205 O ILE B1654 -5.421 2.891 -5.913 1.00 10.00 O ATOM 1206 CB ILE B1654 -2.806 1.137 -6.990 1.00 10.00 C ATOM 1207 CG1 ILE B1654 -2.273 -0.261 -7.324 1.00 10.00 C ATOM 1208 CG2 ILE B1654 -2.492 1.513 -5.550 1.00 10.00 C ATOM 1209 CD1 ILE B1654 -0.817 -0.462 -6.964 1.00 10.00 C ATOM 0 H ILE B1654 -3.865 0.674 -9.211 1.00 10.00 H new ATOM 0 HA ILE B1654 -4.821 0.503 -6.581 1.00 10.00 H new ATOM 0 HB ILE B1654 -2.306 1.848 -7.648 1.00 10.00 H new ATOM 0 HG12 ILE B1654 -2.873 -1.004 -6.798 1.00 10.00 H new ATOM 0 HG13 ILE B1654 -2.402 -0.444 -8.391 1.00 10.00 H new ATOM 0 HG21 ILE B1654 -1.416 1.455 -5.385 1.00 10.00 H new ATOM 0 HG22 ILE B1654 -2.834 2.530 -5.357 1.00 10.00 H new ATOM 0 HG23 ILE B1654 -3.001 0.825 -4.875 1.00 10.00 H new ATOM 0 HD11 ILE B1654 -0.513 -1.474 -7.230 1.00 10.00 H new ATOM 0 HD12 ILE B1654 -0.205 0.256 -7.510 1.00 10.00 H new ATOM 0 HD13 ILE B1654 -0.683 -0.313 -5.893 1.00 10.00 H new ATOM 1221 N GLN B1655 -4.480 3.536 -7.859 1.00 10.00 N ATOM 1222 CA GLN B1655 -4.850 4.932 -7.717 1.00 10.00 C ATOM 1223 C GLN B1655 -6.359 5.096 -7.715 1.00 10.00 C ATOM 1224 O GLN B1655 -6.902 5.853 -6.919 1.00 10.00 O ATOM 1225 CB GLN B1655 -4.245 5.762 -8.835 1.00 10.00 C ATOM 1226 CG GLN B1655 -2.734 5.818 -8.810 1.00 10.00 C ATOM 1227 CD GLN B1655 -2.188 6.691 -9.909 1.00 10.00 C ATOM 1228 OE1 GLN B1655 -1.915 6.220 -11.014 1.00 10.00 O ATOM 1229 NE2 GLN B1655 -2.034 7.971 -9.629 1.00 10.00 N ATOM 0 H GLN B1655 -3.970 3.323 -8.717 1.00 10.00 H new ATOM 0 HA GLN B1655 -4.460 5.284 -6.762 1.00 10.00 H new ATOM 0 HB2 GLN B1655 -4.568 5.353 -9.793 1.00 10.00 H new ATOM 0 HB3 GLN B1655 -4.637 6.777 -8.773 1.00 10.00 H new ATOM 0 HG2 GLN B1655 -2.400 6.198 -7.844 1.00 10.00 H new ATOM 0 HG3 GLN B1655 -2.331 4.810 -8.912 1.00 10.00 H new ATOM 0 HE21 GLN B1655 -2.272 8.322 -8.701 1.00 10.00 H new ATOM 0 HE22 GLN B1655 -1.677 8.609 -10.340 1.00 10.00 H new ATOM 1238 N GLU B1656 -7.030 4.377 -8.604 1.00 10.00 N ATOM 1239 CA GLU B1656 -8.478 4.449 -8.687 1.00 10.00 C ATOM 1240 C GLU B1656 -9.115 3.973 -7.384 1.00 10.00 C ATOM 1241 O GLU B1656 -10.082 4.570 -6.910 1.00 10.00 O ATOM 1242 CB GLU B1656 -8.999 3.628 -9.861 1.00 10.00 C ATOM 1243 CG GLU B1656 -10.408 4.015 -10.283 1.00 10.00 C ATOM 1244 CD GLU B1656 -10.539 5.495 -10.619 1.00 10.00 C ATOM 1245 OE1 GLU B1656 -10.324 5.867 -11.794 1.00 10.00 O ATOM 1246 OE2 GLU B1656 -10.864 6.296 -9.718 1.00 10.00 O ATOM 0 H GLU B1656 -6.596 3.741 -9.273 1.00 10.00 H new ATOM 0 HA GLU B1656 -8.754 5.491 -8.850 1.00 10.00 H new ATOM 0 HB2 GLU B1656 -8.326 3.751 -10.709 1.00 10.00 H new ATOM 0 HB3 GLU B1656 -8.984 2.572 -9.593 1.00 10.00 H new ATOM 0 HG2 GLU B1656 -10.698 3.423 -11.151 1.00 10.00 H new ATOM 0 HG3 GLU B1656 -11.103 3.766 -9.481 1.00 10.00 H new ATOM 1253 N TYR B1657 -8.568 2.904 -6.807 1.00 10.00 N ATOM 1254 CA TYR B1657 -9.071 2.363 -5.546 1.00 10.00 C ATOM 1255 C TYR B1657 -8.931 3.402 -4.436 1.00 10.00 C ATOM 1256 O TYR B1657 -9.877 3.662 -3.703 1.00 10.00 O ATOM 1257 CB TYR B1657 -8.314 1.080 -5.183 1.00 10.00 C ATOM 1258 CG TYR B1657 -8.705 0.465 -3.846 1.00 10.00 C ATOM 1259 CD1 TYR B1657 -7.742 0.229 -2.871 1.00 10.00 C ATOM 1260 CD2 TYR B1657 -10.020 0.101 -3.568 1.00 10.00 C ATOM 1261 CE1 TYR B1657 -8.074 -0.348 -1.662 1.00 10.00 C ATOM 1262 CE2 TYR B1657 -10.358 -0.475 -2.354 1.00 10.00 C ATOM 1263 CZ TYR B1657 -9.384 -0.699 -1.408 1.00 10.00 C ATOM 1264 OH TYR B1657 -9.718 -1.276 -0.205 1.00 10.00 O ATOM 0 H TYR B1657 -7.774 2.394 -7.195 1.00 10.00 H new ATOM 0 HA TYR B1657 -10.127 2.120 -5.661 1.00 10.00 H new ATOM 0 HB2 TYR B1657 -8.479 0.343 -5.968 1.00 10.00 H new ATOM 0 HB3 TYR B1657 -7.246 1.297 -5.169 1.00 10.00 H new ATOM 0 HD1 TYR B1657 -6.715 0.502 -3.063 1.00 10.00 H new ATOM 0 HD2 TYR B1657 -10.787 0.270 -4.309 1.00 10.00 H new ATOM 0 HE1 TYR B1657 -7.311 -0.524 -0.918 1.00 10.00 H new ATOM 0 HE2 TYR B1657 -11.383 -0.747 -2.151 1.00 10.00 H new ATOM 0 HH TYR B1657 -10.680 -1.461 -0.187 1.00 10.00 H new ATOM 1274 N PHE B1658 -7.751 4.010 -4.354 1.00 10.00 N ATOM 1275 CA PHE B1658 -7.478 5.035 -3.347 1.00 10.00 C ATOM 1276 C PHE B1658 -8.415 6.217 -3.557 1.00 10.00 C ATOM 1277 O PHE B1658 -8.980 6.776 -2.610 1.00 10.00 O ATOM 1278 CB PHE B1658 -6.030 5.515 -3.448 1.00 10.00 C ATOM 1279 CG PHE B1658 -5.107 4.910 -2.432 1.00 10.00 C ATOM 1280 CD1 PHE B1658 -4.622 3.624 -2.595 1.00 10.00 C ATOM 1281 CD2 PHE B1658 -4.710 5.637 -1.322 1.00 10.00 C ATOM 1282 CE1 PHE B1658 -3.756 3.072 -1.673 1.00 10.00 C ATOM 1283 CE2 PHE B1658 -3.850 5.093 -0.392 1.00 10.00 C ATOM 1284 CZ PHE B1658 -3.369 3.808 -0.568 1.00 10.00 C ATOM 0 H PHE B1658 -6.966 3.811 -4.974 1.00 10.00 H new ATOM 0 HA PHE B1658 -7.639 4.604 -2.359 1.00 10.00 H new ATOM 0 HB2 PHE B1658 -5.653 5.288 -4.445 1.00 10.00 H new ATOM 0 HB3 PHE B1658 -6.011 6.599 -3.339 1.00 10.00 H new ATOM 0 HD1 PHE B1658 -4.925 3.045 -3.455 1.00 10.00 H new ATOM 0 HD2 PHE B1658 -5.079 6.643 -1.183 1.00 10.00 H new ATOM 0 HE1 PHE B1658 -3.382 2.069 -1.814 1.00 10.00 H new ATOM 0 HE2 PHE B1658 -3.552 5.669 0.472 1.00 10.00 H new ATOM 0 HZ PHE B1658 -2.692 3.380 0.157 1.00 10.00 H new ATOM 1294 N ARG B1659 -8.572 6.576 -4.820 1.00 10.00 N ATOM 1295 CA ARG B1659 -9.430 7.673 -5.225 1.00 10.00 C ATOM 1296 C ARG B1659 -10.877 7.431 -4.797 1.00 10.00 C ATOM 1297 O ARG B1659 -11.451 8.231 -4.057 1.00 10.00 O ATOM 1298 CB ARG B1659 -9.345 7.838 -6.745 1.00 10.00 C ATOM 1299 CG ARG B1659 -9.799 9.197 -7.244 1.00 10.00 C ATOM 1300 CD ARG B1659 -9.060 9.599 -8.513 1.00 10.00 C ATOM 1301 NE ARG B1659 -9.019 8.537 -9.523 1.00 10.00 N ATOM 1302 CZ ARG B1659 -8.066 8.440 -10.448 1.00 10.00 C ATOM 1303 NH1 ARG B1659 -7.082 9.330 -10.478 1.00 10.00 N ATOM 1304 NH2 ARG B1659 -8.099 7.461 -11.349 1.00 10.00 N ATOM 0 H ARG B1659 -8.104 6.110 -5.597 1.00 10.00 H new ATOM 0 HA ARG B1659 -9.091 8.586 -4.735 1.00 10.00 H new ATOM 0 HB2 ARG B1659 -8.315 7.672 -7.061 1.00 10.00 H new ATOM 0 HB3 ARG B1659 -9.953 7.067 -7.219 1.00 10.00 H new ATOM 0 HG2 ARG B1659 -10.872 9.175 -7.437 1.00 10.00 H new ATOM 0 HG3 ARG B1659 -9.630 9.946 -6.470 1.00 10.00 H new ATOM 0 HD2 ARG B1659 -9.540 10.479 -8.941 1.00 10.00 H new ATOM 0 HD3 ARG B1659 -8.040 9.885 -8.256 1.00 10.00 H new ATOM 0 HE ARG B1659 -9.759 7.836 -9.517 1.00 10.00 H new ATOM 0 HH11 ARG B1659 -7.057 10.086 -9.794 1.00 10.00 H new ATOM 0 HH12 ARG B1659 -6.351 9.258 -11.185 1.00 10.00 H new ATOM 0 HH21 ARG B1659 -8.857 6.779 -11.334 1.00 10.00 H new ATOM 0 HH22 ARG B1659 -7.366 7.393 -12.055 1.00 10.00 H new ATOM 1318 N LYS B1660 -11.455 6.312 -5.234 1.00 10.00 N ATOM 1319 CA LYS B1660 -12.845 5.985 -4.909 1.00 10.00 C ATOM 1320 C LYS B1660 -13.028 5.675 -3.420 1.00 10.00 C ATOM 1321 O LYS B1660 -14.129 5.834 -2.879 1.00 10.00 O ATOM 1322 CB LYS B1660 -13.350 4.806 -5.758 1.00 10.00 C ATOM 1323 CG LYS B1660 -12.789 3.452 -5.343 1.00 10.00 C ATOM 1324 CD LYS B1660 -13.607 2.289 -5.901 1.00 10.00 C ATOM 1325 CE LYS B1660 -13.634 2.283 -7.428 1.00 10.00 C ATOM 1326 NZ LYS B1660 -14.313 1.073 -7.982 1.00 10.00 N ATOM 0 H LYS B1660 -10.984 5.617 -5.813 1.00 10.00 H new ATOM 0 HA LYS B1660 -13.439 6.868 -5.144 1.00 10.00 H new ATOM 0 HB2 LYS B1660 -14.438 4.770 -5.698 1.00 10.00 H new ATOM 0 HB3 LYS B1660 -13.094 4.988 -6.802 1.00 10.00 H new ATOM 0 HG2 LYS B1660 -11.759 3.367 -5.688 1.00 10.00 H new ATOM 0 HG3 LYS B1660 -12.767 3.389 -4.255 1.00 10.00 H new ATOM 0 HD2 LYS B1660 -13.189 1.348 -5.543 1.00 10.00 H new ATOM 0 HD3 LYS B1660 -14.627 2.349 -5.521 1.00 10.00 H new ATOM 0 HE2 LYS B1660 -14.146 3.178 -7.783 1.00 10.00 H new ATOM 0 HE3 LYS B1660 -12.613 2.328 -7.807 1.00 10.00 H new ATOM 0 HZ1 LYS B1660 -14.305 1.116 -9.021 1.00 10.00 H new ATOM 0 HZ2 LYS B1660 -13.811 0.218 -7.667 1.00 10.00 H new ATOM 0 HZ3 LYS B1660 -15.296 1.041 -7.644 1.00 10.00 H new ATOM 1340 N PHE B1661 -11.954 5.243 -2.759 1.00 10.00 N ATOM 1341 CA PHE B1661 -12.013 4.923 -1.337 1.00 10.00 C ATOM 1342 C PHE B1661 -12.328 6.172 -0.527 1.00 10.00 C ATOM 1343 O PHE B1661 -13.113 6.126 0.425 1.00 10.00 O ATOM 1344 CB PHE B1661 -10.697 4.306 -0.861 1.00 10.00 C ATOM 1345 CG PHE B1661 -10.819 3.553 0.433 1.00 10.00 C ATOM 1346 CD1 PHE B1661 -11.210 2.224 0.438 1.00 10.00 C ATOM 1347 CD2 PHE B1661 -10.543 4.175 1.641 1.00 10.00 C ATOM 1348 CE1 PHE B1661 -11.323 1.529 1.628 1.00 10.00 C ATOM 1349 CE2 PHE B1661 -10.657 3.483 2.835 1.00 10.00 C ATOM 1350 CZ PHE B1661 -11.047 2.160 2.826 1.00 10.00 C ATOM 0 H PHE B1661 -11.037 5.108 -3.185 1.00 10.00 H new ATOM 0 HA PHE B1661 -12.808 4.193 -1.187 1.00 10.00 H new ATOM 0 HB2 PHE B1661 -10.323 3.631 -1.631 1.00 10.00 H new ATOM 0 HB3 PHE B1661 -9.956 5.097 -0.743 1.00 10.00 H new ATOM 0 HD1 PHE B1661 -11.428 1.727 -0.495 1.00 10.00 H new ATOM 0 HD2 PHE B1661 -10.236 5.210 1.651 1.00 10.00 H new ATOM 0 HE1 PHE B1661 -11.627 0.493 1.621 1.00 10.00 H new ATOM 0 HE2 PHE B1661 -10.441 3.978 3.770 1.00 10.00 H new ATOM 0 HZ PHE B1661 -11.137 1.617 3.755 1.00 10.00 H new ATOM 1360 N LYS B1662 -11.714 7.285 -0.910 1.00 10.00 N ATOM 1361 CA LYS B1662 -11.942 8.552 -0.224 1.00 10.00 C ATOM 1362 C LYS B1662 -13.417 8.926 -0.275 1.00 10.00 C ATOM 1363 O LYS B1662 -14.020 9.255 0.744 1.00 10.00 O ATOM 1364 CB LYS B1662 -11.109 9.664 -0.855 1.00 10.00 C ATOM 1365 CG LYS B1662 -9.623 9.539 -0.567 1.00 10.00 C ATOM 1366 CD LYS B1662 -8.833 10.642 -1.249 1.00 10.00 C ATOM 1367 CE LYS B1662 -7.337 10.464 -1.049 1.00 10.00 C ATOM 1368 NZ LYS B1662 -6.846 11.145 0.179 1.00 10.00 N ATOM 0 H LYS B1662 -11.057 7.337 -1.688 1.00 10.00 H new ATOM 0 HA LYS B1662 -11.640 8.432 0.816 1.00 10.00 H new ATOM 0 HB2 LYS B1662 -11.265 9.657 -1.934 1.00 10.00 H new ATOM 0 HB3 LYS B1662 -11.463 10.627 -0.488 1.00 10.00 H new ATOM 0 HG2 LYS B1662 -9.454 9.580 0.509 1.00 10.00 H new ATOM 0 HG3 LYS B1662 -9.265 8.568 -0.909 1.00 10.00 H new ATOM 0 HD2 LYS B1662 -9.060 10.647 -2.315 1.00 10.00 H new ATOM 0 HD3 LYS B1662 -9.141 11.610 -0.853 1.00 10.00 H new ATOM 0 HE2 LYS B1662 -7.105 9.401 -0.989 1.00 10.00 H new ATOM 0 HE3 LYS B1662 -6.807 10.858 -1.916 1.00 10.00 H new ATOM 0 HZ1 LYS B1662 -5.821 10.995 0.273 1.00 10.00 H new ATOM 0 HZ2 LYS B1662 -7.043 12.164 0.113 1.00 10.00 H new ATOM 0 HZ3 LYS B1662 -7.331 10.752 1.011 1.00 10.00 H new ATOM 1382 N LYS B1663 -13.990 8.848 -1.471 1.00 10.00 N ATOM 1383 CA LYS B1663 -15.395 9.185 -1.675 1.00 10.00 C ATOM 1384 C LYS B1663 -16.297 8.228 -0.906 1.00 10.00 C ATOM 1385 O LYS B1663 -17.298 8.632 -0.321 1.00 10.00 O ATOM 1386 CB LYS B1663 -15.745 9.138 -3.162 1.00 10.00 C ATOM 1387 CG LYS B1663 -15.262 10.345 -3.950 1.00 10.00 C ATOM 1388 CD LYS B1663 -13.876 10.125 -4.532 1.00 10.00 C ATOM 1389 CE LYS B1663 -13.487 11.238 -5.493 1.00 10.00 C ATOM 1390 NZ LYS B1663 -13.356 12.550 -4.808 1.00 10.00 N ATOM 0 H LYS B1663 -13.502 8.553 -2.317 1.00 10.00 H new ATOM 0 HA LYS B1663 -15.556 10.196 -1.302 1.00 10.00 H new ATOM 0 HB2 LYS B1663 -15.314 8.237 -3.598 1.00 10.00 H new ATOM 0 HB3 LYS B1663 -16.827 9.057 -3.268 1.00 10.00 H new ATOM 0 HG2 LYS B1663 -15.965 10.557 -4.756 1.00 10.00 H new ATOM 0 HG3 LYS B1663 -15.248 11.220 -3.301 1.00 10.00 H new ATOM 0 HD2 LYS B1663 -13.146 10.070 -3.724 1.00 10.00 H new ATOM 0 HD3 LYS B1663 -13.848 9.168 -5.053 1.00 10.00 H new ATOM 0 HE2 LYS B1663 -12.543 10.986 -5.975 1.00 10.00 H new ATOM 0 HE3 LYS B1663 -14.237 11.314 -6.281 1.00 10.00 H new ATOM 0 HZ1 LYS B1663 -13.057 13.272 -5.495 1.00 10.00 H new ATOM 0 HZ2 LYS B1663 -14.273 12.821 -4.398 1.00 10.00 H new ATOM 0 HZ3 LYS B1663 -12.646 12.477 -4.051 1.00 10.00 H new ATOM 1404 N ARG B1664 -15.920 6.959 -0.906 1.00 10.00 N ATOM 1405 CA ARG B1664 -16.680 5.927 -0.219 1.00 10.00 C ATOM 1406 C ARG B1664 -16.770 6.241 1.264 1.00 10.00 C ATOM 1407 O ARG B1664 -17.825 6.096 1.884 1.00 10.00 O ATOM 1408 CB ARG B1664 -16.016 4.571 -0.439 1.00 10.00 C ATOM 1409 CG ARG B1664 -16.971 3.392 -0.343 1.00 10.00 C ATOM 1410 CD ARG B1664 -17.210 2.984 1.095 1.00 10.00 C ATOM 1411 NE ARG B1664 -15.975 2.580 1.754 1.00 10.00 N ATOM 1412 CZ ARG B1664 -15.739 2.753 3.046 1.00 10.00 C ATOM 1413 NH1 ARG B1664 -16.660 3.315 3.825 1.00 10.00 N ATOM 1414 NH2 ARG B1664 -14.572 2.380 3.551 1.00 10.00 N ATOM 0 H ARG B1664 -15.084 6.617 -1.379 1.00 10.00 H new ATOM 0 HA ARG B1664 -17.691 5.896 -0.624 1.00 10.00 H new ATOM 0 HB2 ARG B1664 -15.544 4.564 -1.422 1.00 10.00 H new ATOM 0 HB3 ARG B1664 -15.222 4.443 0.297 1.00 10.00 H new ATOM 0 HG2 ARG B1664 -17.920 3.653 -0.810 1.00 10.00 H new ATOM 0 HG3 ARG B1664 -16.564 2.547 -0.899 1.00 10.00 H new ATOM 0 HD2 ARG B1664 -17.658 3.816 1.639 1.00 10.00 H new ATOM 0 HD3 ARG B1664 -17.925 2.161 1.126 1.00 10.00 H new ATOM 0 HE ARG B1664 -15.250 2.139 1.188 1.00 10.00 H new ATOM 0 HH11 ARG B1664 -17.551 3.614 3.428 1.00 10.00 H new ATOM 0 HH12 ARG B1664 -16.475 3.447 4.819 1.00 10.00 H new ATOM 0 HH21 ARG B1664 -13.864 1.964 2.946 1.00 10.00 H new ATOM 0 HH22 ARG B1664 -14.382 2.509 4.545 1.00 10.00 H new ATOM 1428 N LYS B1665 -15.658 6.688 1.818 1.00 10.00 N ATOM 1429 CA LYS B1665 -15.595 7.027 3.227 1.00 10.00 C ATOM 1430 C LYS B1665 -16.439 8.266 3.528 1.00 10.00 C ATOM 1431 O LYS B1665 -17.052 8.364 4.594 1.00 10.00 O ATOM 1432 CB LYS B1665 -14.143 7.257 3.648 1.00 10.00 C ATOM 1433 CG LYS B1665 -13.964 7.427 5.145 1.00 10.00 C ATOM 1434 CD LYS B1665 -14.243 6.136 5.895 1.00 10.00 C ATOM 1435 CE LYS B1665 -14.562 6.406 7.354 1.00 10.00 C ATOM 1436 NZ LYS B1665 -15.301 5.276 7.966 1.00 10.00 N ATOM 0 H LYS B1665 -14.783 6.825 1.311 1.00 10.00 H new ATOM 0 HA LYS B1665 -16.001 6.193 3.800 1.00 10.00 H new ATOM 0 HB2 LYS B1665 -13.538 6.415 3.312 1.00 10.00 H new ATOM 0 HB3 LYS B1665 -13.763 8.145 3.142 1.00 10.00 H new ATOM 0 HG2 LYS B1665 -12.946 7.757 5.355 1.00 10.00 H new ATOM 0 HG3 LYS B1665 -14.633 8.209 5.505 1.00 10.00 H new ATOM 0 HD2 LYS B1665 -15.078 5.614 5.428 1.00 10.00 H new ATOM 0 HD3 LYS B1665 -13.377 5.478 5.825 1.00 10.00 H new ATOM 0 HE2 LYS B1665 -13.637 6.578 7.904 1.00 10.00 H new ATOM 0 HE3 LYS B1665 -15.155 7.317 7.435 1.00 10.00 H new ATOM 0 HZ1 LYS B1665 -15.846 5.619 8.782 1.00 10.00 H new ATOM 0 HZ2 LYS B1665 -15.950 4.865 7.265 1.00 10.00 H new ATOM 0 HZ3 LYS B1665 -14.626 4.550 8.281 1.00 10.00 H new ATOM 1450 N GLU B1666 -16.483 9.202 2.582 1.00 10.00 N ATOM 1451 CA GLU B1666 -17.259 10.433 2.760 1.00 10.00 C ATOM 1452 C GLU B1666 -18.747 10.128 2.765 1.00 10.00 C ATOM 1453 O GLU B1666 -19.554 10.893 3.296 1.00 10.00 O ATOM 1454 CB GLU B1666 -16.938 11.437 1.651 1.00 10.00 C ATOM 1455 CG GLU B1666 -15.469 11.798 1.589 1.00 10.00 C ATOM 1456 CD GLU B1666 -15.136 12.785 0.489 1.00 10.00 C ATOM 1457 OE1 GLU B1666 -14.525 13.835 0.799 1.00 10.00 O ATOM 1458 OE2 GLU B1666 -15.470 12.521 -0.687 1.00 10.00 O ATOM 0 H GLU B1666 -15.995 9.135 1.689 1.00 10.00 H new ATOM 0 HA GLU B1666 -16.985 10.871 3.720 1.00 10.00 H new ATOM 0 HB2 GLU B1666 -17.245 11.021 0.691 1.00 10.00 H new ATOM 0 HB3 GLU B1666 -17.523 12.343 1.808 1.00 10.00 H new ATOM 0 HG2 GLU B1666 -15.165 12.218 2.548 1.00 10.00 H new ATOM 0 HG3 GLU B1666 -14.886 10.889 1.440 1.00 10.00 H new ATOM 1465 N GLN B1667 -19.101 9.007 2.156 1.00 10.00 N ATOM 1466 CA GLN B1667 -20.482 8.579 2.090 1.00 10.00 C ATOM 1467 C GLN B1667 -20.827 7.709 3.291 1.00 10.00 C ATOM 1468 O GLN B1667 -21.735 8.025 4.064 1.00 10.00 O ATOM 1469 CB GLN B1667 -20.742 7.817 0.795 1.00 10.00 C ATOM 1470 CG GLN B1667 -20.564 8.664 -0.452 1.00 10.00 C ATOM 1471 CD GLN B1667 -21.488 9.867 -0.472 1.00 10.00 C ATOM 1472 OE1 GLN B1667 -21.149 10.939 0.035 1.00 10.00 O ATOM 1473 NE2 GLN B1667 -22.664 9.702 -1.057 1.00 10.00 N ATOM 0 H GLN B1667 -18.443 8.376 1.699 1.00 10.00 H new ATOM 0 HA GLN B1667 -21.118 9.464 2.107 1.00 10.00 H new ATOM 0 HB2 GLN B1667 -20.067 6.963 0.744 1.00 10.00 H new ATOM 0 HB3 GLN B1667 -21.757 7.421 0.814 1.00 10.00 H new ATOM 0 HG2 GLN B1667 -19.530 9.003 -0.513 1.00 10.00 H new ATOM 0 HG3 GLN B1667 -20.751 8.051 -1.334 1.00 10.00 H new ATOM 0 HE21 GLN B1667 -22.908 8.800 -1.465 1.00 10.00 H new ATOM 0 HE22 GLN B1667 -23.326 10.477 -1.100 1.00 10.00 H new ATOM 1482 N GLY B1668 -20.089 6.624 3.458 1.00 10.00 N ATOM 1483 CA GLY B1668 -20.340 5.734 4.564 1.00 10.00 C ATOM 1484 C GLY B1668 -20.098 4.289 4.196 1.00 10.00 C ATOM 1485 O GLY B1668 -20.735 3.401 4.799 1.00 10.00 O ATOM 1486 OXT GLY B1668 -19.270 4.033 3.299 1.00 10.00 O ATOM 0 H GLY B1668 -19.322 6.346 2.846 1.00 10.00 H new ATOM 0 HA2 GLY B1668 -19.698 6.007 5.401 1.00 10.00 H new ATOM 0 HA3 GLY B1668 -21.370 5.855 4.900 1.00 10.00 H new