USER MOD reduce.3.24.130724 H: found=0, std=0, add=757, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 760 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 Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0.007 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot -33:sc= 0.126 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 CYS SG : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 CYS SG : rot 180:sc= -0.32 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 ASN : amide:sc= -0.0228 X(o=-0.023,f=0) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 87 CYS SG : rot 68:sc= 1.29 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 128 N SER A 9 4.787 -2.494 -12.982 1.00 1.00 N ATOM 129 CA SER A 9 3.912 -3.480 -13.661 1.00 1.00 C ATOM 130 C SER A 9 2.408 -3.195 -13.452 1.00 1.00 C ATOM 131 O SER A 9 1.595 -3.489 -14.354 1.00 1.00 O ATOM 132 CB SER A 9 4.237 -4.880 -13.205 1.00 1.00 C ATOM 133 OG SER A 9 5.379 -5.368 -13.874 1.00 1.00 O ATOM 0 HA SER A 9 4.112 -3.386 -14.728 1.00 1.00 H new ATOM 0 HB2 SER A 9 4.409 -4.887 -12.129 1.00 1.00 H new ATOM 0 HB3 SER A 9 3.388 -5.537 -13.397 1.00 1.00 H new ATOM 0 HG SER A 9 5.576 -6.277 -13.564 1.00 1.00 H new ATOM 139 N ALA A 10 2.078 -2.571 -12.275 1.00 1.00 N ATOM 140 CA ALA A 10 0.704 -2.185 -11.917 1.00 1.00 C ATOM 141 C ALA A 10 0.250 -0.865 -12.581 1.00 1.00 C ATOM 142 O ALA A 10 -0.946 -0.702 -12.877 1.00 1.00 O ATOM 143 CB ALA A 10 0.565 -2.092 -10.424 1.00 1.00 C ATOM 0 H ALA A 10 2.767 -2.330 -11.562 1.00 1.00 H new ATOM 0 HA ALA A 10 0.049 -2.967 -12.301 1.00 1.00 H new ATOM 0 HB1 ALA A 10 -0.456 -1.806 -10.171 1.00 1.00 H new ATOM 0 HB2 ALA A 10 0.792 -3.060 -9.976 1.00 1.00 H new ATOM 0 HB3 ALA A 10 1.258 -1.343 -10.040 1.00 1.00 H new ATOM 149 N THR A 11 1.247 0.013 -12.884 1.00 1.00 N ATOM 150 CA THR A 11 1.019 1.334 -13.523 1.00 1.00 C ATOM 151 C THR A 11 0.887 1.241 -15.048 1.00 1.00 C ATOM 152 O THR A 11 0.099 1.994 -15.636 1.00 1.00 O ATOM 153 CB THR A 11 2.126 2.354 -13.182 1.00 1.00 C ATOM 154 OG1 THR A 11 3.438 1.748 -13.247 1.00 1.00 O ATOM 155 CG2 THR A 11 1.899 2.951 -11.803 1.00 1.00 C ATOM 0 H THR A 11 2.230 -0.179 -12.691 1.00 1.00 H new ATOM 0 HA THR A 11 0.073 1.683 -13.109 1.00 1.00 H new ATOM 0 HB THR A 11 2.079 3.150 -13.925 1.00 1.00 H new ATOM 0 HG1 THR A 11 4.119 2.418 -13.028 1.00 1.00 H new ATOM 0 HG21 THR A 11 2.690 3.667 -11.582 1.00 1.00 H new ATOM 0 HG22 THR A 11 0.934 3.457 -11.780 1.00 1.00 H new ATOM 0 HG23 THR A 11 1.910 2.157 -11.056 1.00 1.00 H new ATOM 163 N ARG A 12 1.682 0.269 -15.626 1.00 1.00 N ATOM 164 CA ARG A 12 1.662 -0.009 -17.099 1.00 1.00 C ATOM 165 C ARG A 12 0.265 -0.424 -17.593 1.00 1.00 C ATOM 166 O ARG A 12 -0.188 0.078 -18.635 1.00 1.00 O ATOM 167 CB ARG A 12 2.655 -1.074 -17.460 1.00 1.00 C ATOM 168 CG ARG A 12 3.994 -0.520 -17.836 1.00 1.00 C ATOM 169 CD ARG A 12 4.957 -1.620 -18.119 1.00 1.00 C ATOM 170 NE ARG A 12 6.274 -1.100 -18.484 1.00 1.00 N ATOM 171 CZ ARG A 12 7.342 -1.867 -18.708 1.00 1.00 C ATOM 172 NH1 ARG A 12 7.205 -3.170 -18.867 1.00 1.00 N ATOM 173 NH2 ARG A 12 8.519 -1.320 -18.794 1.00 1.00 N ATOM 0 H ARG A 12 2.328 -0.319 -15.100 1.00 1.00 H new ATOM 0 HA ARG A 12 1.935 0.923 -17.593 1.00 1.00 H new ATOM 0 HB2 ARG A 12 2.773 -1.754 -16.617 1.00 1.00 H new ATOM 0 HB3 ARG A 12 2.264 -1.661 -18.291 1.00 1.00 H new ATOM 0 HG2 ARG A 12 3.896 0.119 -18.714 1.00 1.00 H new ATOM 0 HG3 ARG A 12 4.375 0.105 -17.028 1.00 1.00 H new ATOM 0 HD2 ARG A 12 5.048 -2.260 -17.241 1.00 1.00 H new ATOM 0 HD3 ARG A 12 4.573 -2.241 -18.928 1.00 1.00 H new ATOM 0 HE ARG A 12 6.383 -0.090 -18.573 1.00 1.00 H new ATOM 0 HH11 ARG A 12 6.279 -3.595 -18.819 1.00 1.00 H new ATOM 0 HH12 ARG A 12 8.025 -3.752 -19.038 1.00 1.00 H new ATOM 0 HH21 ARG A 12 8.621 -0.310 -18.690 1.00 1.00 H new ATOM 0 HH22 ARG A 12 9.340 -1.901 -18.965 1.00 1.00 H new ATOM 187 N ARG A 13 -0.448 -1.209 -16.719 1.00 1.00 N ATOM 188 CA ARG A 13 -1.849 -1.608 -16.944 1.00 1.00 C ATOM 189 C ARG A 13 -2.821 -0.426 -16.784 1.00 1.00 C ATOM 190 O ARG A 13 -3.774 -0.309 -17.573 1.00 1.00 O ATOM 191 CB ARG A 13 -2.238 -2.744 -16.048 1.00 1.00 C ATOM 192 CG ARG A 13 -1.829 -4.071 -16.613 1.00 1.00 C ATOM 193 CD ARG A 13 -2.128 -5.158 -15.659 1.00 1.00 C ATOM 194 NE ARG A 13 -1.267 -6.305 -15.878 1.00 1.00 N ATOM 195 CZ ARG A 13 -1.226 -7.360 -15.071 1.00 1.00 C ATOM 196 NH1 ARG A 13 -1.979 -7.405 -13.989 1.00 1.00 N ATOM 197 NH2 ARG A 13 -0.439 -8.351 -15.357 1.00 1.00 N ATOM 0 H ARG A 13 -0.055 -1.572 -15.850 1.00 1.00 H new ATOM 0 HA ARG A 13 -1.920 -1.947 -17.977 1.00 1.00 H new ATOM 0 HB2 ARG A 13 -1.776 -2.609 -15.070 1.00 1.00 H new ATOM 0 HB3 ARG A 13 -3.317 -2.732 -15.895 1.00 1.00 H new ATOM 0 HG2 ARG A 13 -2.353 -4.250 -17.552 1.00 1.00 H new ATOM 0 HG3 ARG A 13 -0.763 -4.062 -16.840 1.00 1.00 H new ATOM 0 HD2 ARG A 13 -2.001 -4.795 -14.639 1.00 1.00 H new ATOM 0 HD3 ARG A 13 -3.171 -5.459 -15.762 1.00 1.00 H new ATOM 0 HE ARG A 13 -0.659 -6.301 -16.697 1.00 1.00 H new ATOM 0 HH11 ARG A 13 -2.599 -6.626 -13.766 1.00 1.00 H new ATOM 0 HH12 ARG A 13 -1.941 -8.219 -13.375 1.00 1.00 H new ATOM 0 HH21 ARG A 13 0.141 -8.316 -16.195 1.00 1.00 H new ATOM 0 HH22 ARG A 13 -0.401 -9.165 -14.744 1.00 1.00 H new ATOM 211 N GLU A 14 -2.469 0.474 -15.813 1.00 1.00 N ATOM 212 CA GLU A 14 -3.223 1.728 -15.565 1.00 1.00 C ATOM 213 C GLU A 14 -3.132 2.713 -16.747 1.00 1.00 C ATOM 214 O GLU A 14 -4.119 3.392 -17.056 1.00 1.00 O ATOM 215 CB GLU A 14 -2.774 2.410 -14.297 1.00 1.00 C ATOM 216 CG GLU A 14 -3.512 1.948 -13.060 1.00 1.00 C ATOM 217 CD GLU A 14 -2.996 2.616 -11.808 1.00 1.00 C ATOM 218 OE1 GLU A 14 -2.038 2.085 -11.203 1.00 1.00 O ATOM 219 OE2 GLU A 14 -3.538 3.677 -11.439 1.00 1.00 O ATOM 0 H GLU A 14 -1.668 0.346 -15.195 1.00 1.00 H new ATOM 0 HA GLU A 14 -4.266 1.431 -15.453 1.00 1.00 H new ATOM 0 HB2 GLU A 14 -1.707 2.234 -14.159 1.00 1.00 H new ATOM 0 HB3 GLU A 14 -2.908 3.486 -14.408 1.00 1.00 H new ATOM 0 HG2 GLU A 14 -4.575 2.161 -13.172 1.00 1.00 H new ATOM 0 HG3 GLU A 14 -3.412 0.867 -12.961 1.00 1.00 H new ATOM 226 N LYS A 15 -1.951 2.693 -17.458 1.00 1.00 N ATOM 227 CA LYS A 15 -1.695 3.530 -18.637 1.00 1.00 C ATOM 228 C LYS A 15 -2.529 3.119 -19.855 1.00 1.00 C ATOM 229 O LYS A 15 -2.909 3.986 -20.669 1.00 1.00 O ATOM 230 CB LYS A 15 -0.234 3.517 -18.999 1.00 1.00 C ATOM 231 CG LYS A 15 0.499 4.735 -18.506 1.00 1.00 C ATOM 232 CD LYS A 15 1.981 4.611 -18.777 1.00 1.00 C ATOM 233 CE LYS A 15 2.744 5.818 -18.263 1.00 1.00 C ATOM 234 NZ LYS A 15 4.208 5.679 -18.486 1.00 1.00 N ATOM 0 H LYS A 15 -1.167 2.090 -17.211 1.00 1.00 H new ATOM 0 HA LYS A 15 -1.996 4.540 -18.360 1.00 1.00 H new ATOM 0 HB2 LYS A 15 0.231 2.624 -18.581 1.00 1.00 H new ATOM 0 HB3 LYS A 15 -0.133 3.451 -20.082 1.00 1.00 H new ATOM 0 HG2 LYS A 15 0.107 5.625 -18.998 1.00 1.00 H new ATOM 0 HG3 LYS A 15 0.329 4.860 -17.437 1.00 1.00 H new ATOM 0 HD2 LYS A 15 2.364 3.708 -18.302 1.00 1.00 H new ATOM 0 HD3 LYS A 15 2.148 4.503 -19.849 1.00 1.00 H new ATOM 0 HE2 LYS A 15 2.383 6.717 -18.763 1.00 1.00 H new ATOM 0 HE3 LYS A 15 2.549 5.946 -17.198 1.00 1.00 H new ATOM 0 HZ1 LYS A 15 4.696 6.522 -18.122 1.00 1.00 H new ATOM 0 HZ2 LYS A 15 4.556 4.835 -17.988 1.00 1.00 H new ATOM 0 HZ3 LYS A 15 4.396 5.582 -19.504 1.00 1.00 H new ATOM 248 N ILE A 16 -2.865 1.795 -19.922 1.00 1.00 N ATOM 249 CA ILE A 16 -3.714 1.233 -20.993 1.00 1.00 C ATOM 250 C ILE A 16 -5.164 1.762 -20.892 1.00 1.00 C ATOM 251 O ILE A 16 -5.729 2.177 -21.883 1.00 1.00 O ATOM 252 CB ILE A 16 -3.678 -0.332 -21.016 1.00 1.00 C ATOM 253 CG1 ILE A 16 -2.270 -0.816 -21.393 1.00 1.00 C ATOM 254 CG2 ILE A 16 -4.725 -0.888 -21.998 1.00 1.00 C ATOM 255 CD1 ILE A 16 -1.772 -1.950 -20.531 1.00 1.00 C ATOM 0 H ILE A 16 -2.554 1.104 -19.239 1.00 1.00 H new ATOM 0 HA ILE A 16 -3.298 1.572 -21.942 1.00 1.00 H new ATOM 0 HB ILE A 16 -3.923 -0.702 -20.021 1.00 1.00 H new ATOM 0 HG12 ILE A 16 -2.271 -1.136 -22.435 1.00 1.00 H new ATOM 0 HG13 ILE A 16 -1.575 0.020 -21.317 1.00 1.00 H new ATOM 0 HG21 ILE A 16 -4.682 -1.977 -21.998 1.00 1.00 H new ATOM 0 HG22 ILE A 16 -5.720 -0.564 -21.691 1.00 1.00 H new ATOM 0 HG23 ILE A 16 -4.516 -0.517 -23.001 1.00 1.00 H new ATOM 0 HD11 ILE A 16 -0.772 -2.240 -20.854 1.00 1.00 H new ATOM 0 HD12 ILE A 16 -1.738 -1.628 -19.490 1.00 1.00 H new ATOM 0 HD13 ILE A 16 -2.446 -2.802 -20.626 1.00 1.00 H new ATOM 267 N ILE A 17 -5.700 1.748 -19.672 1.00 1.00 N ATOM 268 CA ILE A 17 -7.065 2.211 -19.368 1.00 1.00 C ATOM 269 C ILE A 17 -7.180 3.765 -19.259 1.00 1.00 C ATOM 270 O ILE A 17 -8.236 4.311 -18.859 1.00 1.00 O ATOM 271 CB ILE A 17 -7.626 1.519 -18.074 1.00 1.00 C ATOM 272 CG1 ILE A 17 -6.540 1.358 -16.990 1.00 1.00 C ATOM 273 CG2 ILE A 17 -8.240 0.179 -18.418 1.00 1.00 C ATOM 274 CD1 ILE A 17 -6.805 2.176 -15.762 1.00 1.00 C ATOM 0 H ILE A 17 -5.196 1.411 -18.852 1.00 1.00 H new ATOM 0 HA ILE A 17 -7.679 1.914 -20.218 1.00 1.00 H new ATOM 0 HB ILE A 17 -8.400 2.167 -17.663 1.00 1.00 H new ATOM 0 HG12 ILE A 17 -6.468 0.307 -16.710 1.00 1.00 H new ATOM 0 HG13 ILE A 17 -5.574 1.643 -17.407 1.00 1.00 H new ATOM 0 HG21 ILE A 17 -8.624 -0.289 -17.511 1.00 1.00 H new ATOM 0 HG22 ILE A 17 -9.056 0.324 -19.126 1.00 1.00 H new ATOM 0 HG23 ILE A 17 -7.482 -0.465 -18.865 1.00 1.00 H new ATOM 0 HD11 ILE A 17 -6.004 2.017 -15.039 1.00 1.00 H new ATOM 0 HD12 ILE A 17 -6.848 3.232 -16.030 1.00 1.00 H new ATOM 0 HD13 ILE A 17 -7.756 1.875 -15.322 1.00 1.00 H new ATOM 286 N GLU A 18 -6.021 4.465 -19.517 1.00 1.00 N ATOM 287 CA GLU A 18 -5.904 5.898 -19.366 1.00 1.00 C ATOM 288 C GLU A 18 -5.795 6.631 -20.713 1.00 1.00 C ATOM 289 O GLU A 18 -6.391 7.716 -20.852 1.00 1.00 O ATOM 290 CB GLU A 18 -4.714 6.242 -18.495 1.00 1.00 C ATOM 291 CG GLU A 18 -5.080 6.439 -17.042 1.00 1.00 C ATOM 292 CD GLU A 18 -3.891 6.843 -16.207 1.00 1.00 C ATOM 293 OE1 GLU A 18 -3.185 5.944 -15.696 1.00 1.00 O ATOM 294 OE2 GLU A 18 -3.665 8.060 -16.059 1.00 1.00 O ATOM 0 H GLU A 18 -5.161 4.018 -19.834 1.00 1.00 H new ATOM 0 HA GLU A 18 -6.822 6.238 -18.886 1.00 1.00 H new ATOM 0 HB2 GLU A 18 -3.973 5.447 -18.572 1.00 1.00 H new ATOM 0 HB3 GLU A 18 -4.246 7.151 -18.872 1.00 1.00 H new ATOM 0 HG2 GLU A 18 -5.854 7.203 -16.964 1.00 1.00 H new ATOM 0 HG3 GLU A 18 -5.503 5.515 -16.647 1.00 1.00 H new ATOM 301 N LEU A 19 -5.026 6.039 -21.667 1.00 1.00 N ATOM 302 CA LEU A 19 -4.827 6.614 -23.000 1.00 1.00 C ATOM 303 C LEU A 19 -5.882 6.154 -24.015 1.00 1.00 C ATOM 304 O LEU A 19 -6.150 6.876 -25.006 1.00 1.00 O ATOM 305 CB LEU A 19 -3.442 6.297 -23.518 1.00 1.00 C ATOM 306 CG LEU A 19 -2.656 7.494 -24.058 1.00 1.00 C ATOM 307 CD1 LEU A 19 -1.405 7.727 -23.232 1.00 1.00 C ATOM 308 CD2 LEU A 19 -2.289 7.280 -25.515 1.00 1.00 C ATOM 0 H LEU A 19 -4.536 5.156 -21.522 1.00 1.00 H new ATOM 0 HA LEU A 19 -4.938 7.692 -22.887 1.00 1.00 H new ATOM 0 HB2 LEU A 19 -2.867 5.839 -22.713 1.00 1.00 H new ATOM 0 HB3 LEU A 19 -3.530 5.554 -24.310 1.00 1.00 H new ATOM 0 HG LEU A 19 -3.291 8.377 -23.986 1.00 1.00 H new ATOM 0 HD11 LEU A 19 -0.859 8.582 -23.631 1.00 1.00 H new ATOM 0 HD12 LEU A 19 -1.684 7.926 -22.197 1.00 1.00 H new ATOM 0 HD13 LEU A 19 -0.771 6.841 -23.273 1.00 1.00 H new ATOM 0 HD21 LEU A 19 -1.731 8.142 -25.880 1.00 1.00 H new ATOM 0 HD22 LEU A 19 -1.675 6.384 -25.608 1.00 1.00 H new ATOM 0 HD23 LEU A 19 -3.197 7.160 -26.105 1.00 1.00 H new ATOM 320 N LEU A 20 -6.561 5.003 -23.697 1.00 1.00 N ATOM 321 CA LEU A 20 -7.526 4.359 -24.573 1.00 1.00 C ATOM 322 C LEU A 20 -8.951 4.932 -24.465 1.00 1.00 C ATOM 323 O LEU A 20 -9.795 4.659 -25.364 1.00 1.00 O ATOM 324 CB LEU A 20 -7.572 2.878 -24.280 1.00 1.00 C ATOM 325 CG LEU A 20 -7.047 1.964 -25.378 1.00 1.00 C ATOM 326 CD1 LEU A 20 -5.796 1.247 -24.912 1.00 1.00 C ATOM 327 CD2 LEU A 20 -8.099 0.951 -25.781 1.00 1.00 C ATOM 0 H LEU A 20 -6.432 4.514 -22.811 1.00 1.00 H new ATOM 0 HA LEU A 20 -7.183 4.553 -25.589 1.00 1.00 H new ATOM 0 HB2 LEU A 20 -6.998 2.689 -23.373 1.00 1.00 H new ATOM 0 HB3 LEU A 20 -8.605 2.602 -24.068 1.00 1.00 H new ATOM 0 HG LEU A 20 -6.804 2.579 -26.245 1.00 1.00 H new ATOM 0 HD11 LEU A 20 -5.432 0.597 -25.707 1.00 1.00 H new ATOM 0 HD12 LEU A 20 -5.029 1.980 -24.662 1.00 1.00 H new ATOM 0 HD13 LEU A 20 -6.027 0.648 -24.031 1.00 1.00 H new ATOM 0 HD21 LEU A 20 -7.703 0.308 -26.567 1.00 1.00 H new ATOM 0 HD22 LEU A 20 -8.369 0.344 -24.917 1.00 1.00 H new ATOM 0 HD23 LEU A 20 -8.983 1.471 -26.149 1.00 1.00 H new ATOM 339 N LEU A 21 -9.196 5.830 -23.433 1.00 1.00 N ATOM 340 CA LEU A 21 -10.483 6.449 -23.176 1.00 1.00 C ATOM 341 C LEU A 21 -10.675 7.765 -23.975 1.00 1.00 C ATOM 342 O LEU A 21 -11.798 8.320 -24.009 1.00 1.00 O ATOM 343 CB LEU A 21 -10.636 6.697 -21.681 1.00 1.00 C ATOM 344 CG LEU A 21 -11.946 6.198 -21.076 1.00 1.00 C ATOM 345 CD1 LEU A 21 -11.668 5.201 -19.968 1.00 1.00 C ATOM 346 CD2 LEU A 21 -12.769 7.370 -20.560 1.00 1.00 C ATOM 0 H LEU A 21 -8.473 6.120 -22.774 1.00 1.00 H new ATOM 0 HA LEU A 21 -11.260 5.764 -23.515 1.00 1.00 H new ATOM 0 HB2 LEU A 21 -9.807 6.217 -21.161 1.00 1.00 H new ATOM 0 HB3 LEU A 21 -10.552 7.768 -21.495 1.00 1.00 H new ATOM 0 HG LEU A 21 -12.522 5.693 -21.851 1.00 1.00 H new ATOM 0 HD11 LEU A 21 -12.611 4.854 -19.546 1.00 1.00 H new ATOM 0 HD12 LEU A 21 -11.117 4.352 -20.372 1.00 1.00 H new ATOM 0 HD13 LEU A 21 -11.076 5.680 -19.188 1.00 1.00 H new ATOM 0 HD21 LEU A 21 -13.700 7.000 -20.131 1.00 1.00 H new ATOM 0 HD22 LEU A 21 -12.204 7.903 -19.795 1.00 1.00 H new ATOM 0 HD23 LEU A 21 -12.993 8.048 -21.384 1.00 1.00 H new ATOM 358 N GLU A 22 -9.566 8.216 -24.619 1.00 1.00 N ATOM 359 CA GLU A 22 -9.559 9.419 -25.449 1.00 1.00 C ATOM 360 C GLU A 22 -9.546 9.119 -26.958 1.00 1.00 C ATOM 361 O GLU A 22 -10.036 9.956 -27.747 1.00 1.00 O ATOM 362 CB GLU A 22 -8.385 10.306 -25.069 1.00 1.00 C ATOM 363 CG GLU A 22 -8.713 11.313 -23.979 1.00 1.00 C ATOM 364 CD GLU A 22 -7.566 12.254 -23.699 1.00 1.00 C ATOM 365 OE1 GLU A 22 -6.707 11.911 -22.858 1.00 1.00 O ATOM 366 OE2 GLU A 22 -7.526 13.330 -24.325 1.00 1.00 O ATOM 0 H GLU A 22 -8.662 7.747 -24.568 1.00 1.00 H new ATOM 0 HA GLU A 22 -10.495 9.943 -25.253 1.00 1.00 H new ATOM 0 HB2 GLU A 22 -7.559 9.678 -24.736 1.00 1.00 H new ATOM 0 HB3 GLU A 22 -8.042 10.840 -25.955 1.00 1.00 H new ATOM 0 HG2 GLU A 22 -9.589 11.891 -24.274 1.00 1.00 H new ATOM 0 HG3 GLU A 22 -8.975 10.781 -23.064 1.00 1.00 H new ATOM 373 N GLY A 23 -9.012 7.936 -27.332 1.00 1.00 N ATOM 374 CA GLY A 23 -8.959 7.526 -28.715 1.00 1.00 C ATOM 375 C GLY A 23 -8.687 6.061 -28.866 1.00 1.00 C ATOM 376 O GLY A 23 -8.658 5.311 -27.855 1.00 1.00 O ATOM 0 H GLY A 23 -8.616 7.260 -26.679 1.00 1.00 H new ATOM 0 HA2 GLY A 23 -9.905 7.769 -29.200 1.00 1.00 H new ATOM 0 HA3 GLY A 23 -8.182 8.092 -29.229 1.00 1.00 H new ATOM 380 N ASP A 24 -8.506 5.624 -30.127 1.00 1.00 N ATOM 381 CA ASP A 24 -8.224 4.237 -30.440 1.00 1.00 C ATOM 382 C ASP A 24 -6.803 4.090 -30.939 1.00 1.00 C ATOM 383 O ASP A 24 -6.336 4.885 -31.798 1.00 1.00 O ATOM 384 CB ASP A 24 -9.210 3.684 -31.462 1.00 1.00 C ATOM 385 CG ASP A 24 -9.725 2.296 -31.119 1.00 1.00 C ATOM 386 OD1 ASP A 24 -8.961 1.318 -31.291 1.00 1.00 O ATOM 387 OD2 ASP A 24 -10.878 2.190 -30.671 1.00 1.00 O ATOM 0 H ASP A 24 -8.554 6.232 -30.945 1.00 1.00 H new ATOM 0 HA ASP A 24 -8.338 3.657 -29.524 1.00 1.00 H new ATOM 0 HB2 ASP A 24 -10.056 4.366 -31.545 1.00 1.00 H new ATOM 0 HB3 ASP A 24 -8.729 3.653 -32.439 1.00 1.00 H new ATOM 392 N TYR A 25 -6.094 3.096 -30.372 1.00 1.00 N ATOM 393 CA TYR A 25 -4.728 2.810 -30.755 1.00 1.00 C ATOM 394 C TYR A 25 -4.515 1.346 -30.806 1.00 1.00 C ATOM 395 O TYR A 25 -5.052 0.588 -29.951 1.00 1.00 O ATOM 396 CB TYR A 25 -3.694 3.475 -29.791 1.00 1.00 C ATOM 397 CG TYR A 25 -3.426 4.945 -30.075 1.00 1.00 C ATOM 398 CD1 TYR A 25 -2.444 5.328 -30.983 1.00 1.00 C ATOM 399 CD2 TYR A 25 -4.149 5.941 -29.424 1.00 1.00 C ATOM 400 CE1 TYR A 25 -2.190 6.650 -31.232 1.00 1.00 C ATOM 401 CE2 TYR A 25 -3.904 7.266 -29.671 1.00 1.00 C ATOM 402 CZ TYR A 25 -2.920 7.618 -30.574 1.00 1.00 C ATOM 403 OH TYR A 25 -2.662 8.943 -30.813 1.00 1.00 O ATOM 0 H TYR A 25 -6.461 2.483 -29.644 1.00 1.00 H new ATOM 0 HA TYR A 25 -4.567 3.237 -31.745 1.00 1.00 H new ATOM 0 HB2 TYR A 25 -4.054 3.375 -28.767 1.00 1.00 H new ATOM 0 HB3 TYR A 25 -2.753 2.928 -29.853 1.00 1.00 H new ATOM 0 HD1 TYR A 25 -1.873 4.571 -31.500 1.00 1.00 H new ATOM 0 HD2 TYR A 25 -4.914 5.665 -28.714 1.00 1.00 H new ATOM 0 HE1 TYR A 25 -1.424 6.933 -31.938 1.00 1.00 H new ATOM 0 HE2 TYR A 25 -4.476 8.029 -29.164 1.00 1.00 H new ATOM 0 HH TYR A 25 -3.263 9.496 -30.272 1.00 1.00 H new ATOM 413 N SER A 26 -3.714 0.924 -31.797 1.00 1.00 N ATOM 414 CA SER A 26 -3.358 -0.463 -31.996 1.00 1.00 C ATOM 415 C SER A 26 -2.284 -0.906 -30.963 1.00 1.00 C ATOM 416 O SER A 26 -1.685 -0.015 -30.336 1.00 1.00 O ATOM 417 CB SER A 26 -2.871 -0.739 -33.414 1.00 1.00 C ATOM 418 OG SER A 26 -3.836 -1.487 -34.141 1.00 1.00 O ATOM 0 H SER A 26 -3.298 1.554 -32.483 1.00 1.00 H new ATOM 0 HA SER A 26 -4.265 -1.049 -31.844 1.00 1.00 H new ATOM 0 HB2 SER A 26 -2.673 0.203 -33.926 1.00 1.00 H new ATOM 0 HB3 SER A 26 -1.929 -1.287 -33.380 1.00 1.00 H new ATOM 0 HG SER A 26 -3.506 -1.652 -35.049 1.00 1.00 H new ATOM 424 N PRO A 27 -2.079 -2.276 -30.680 1.00 1.00 N ATOM 425 CA PRO A 27 -1.042 -2.755 -29.730 1.00 1.00 C ATOM 426 C PRO A 27 0.406 -2.233 -30.001 1.00 1.00 C ATOM 427 O PRO A 27 1.105 -1.816 -29.053 1.00 1.00 O ATOM 428 CB PRO A 27 -1.137 -4.259 -29.911 1.00 1.00 C ATOM 429 CG PRO A 27 -1.884 -4.483 -31.199 1.00 1.00 C ATOM 430 CD PRO A 27 -2.884 -3.429 -31.193 1.00 1.00 C ATOM 0 HA PRO A 27 -1.222 -2.392 -28.718 1.00 1.00 H new ATOM 0 HB2 PRO A 27 -0.145 -4.709 -29.953 1.00 1.00 H new ATOM 0 HB3 PRO A 27 -1.660 -4.719 -29.073 1.00 1.00 H new ATOM 0 HG2 PRO A 27 -1.225 -4.408 -32.064 1.00 1.00 H new ATOM 0 HG3 PRO A 27 -2.342 -5.472 -31.232 1.00 1.00 H new ATOM 0 HD2 PRO A 27 -3.289 -3.239 -32.187 1.00 1.00 H new ATOM 0 HD3 PRO A 27 -3.728 -3.664 -30.544 1.00 1.00 H new ATOM 438 N SER A 28 0.805 -2.241 -31.332 1.00 1.00 N ATOM 439 CA SER A 28 2.084 -1.671 -31.805 1.00 1.00 C ATOM 440 C SER A 28 2.158 -0.134 -31.568 1.00 1.00 C ATOM 441 O SER A 28 3.247 0.389 -31.294 1.00 1.00 O ATOM 442 CB SER A 28 2.312 -1.972 -33.260 1.00 1.00 C ATOM 443 OG SER A 28 2.625 -3.338 -33.446 1.00 1.00 O ATOM 0 H SER A 28 0.239 -2.644 -32.079 1.00 1.00 H new ATOM 0 HA SER A 28 2.871 -2.145 -31.219 1.00 1.00 H new ATOM 0 HB2 SER A 28 1.420 -1.717 -33.833 1.00 1.00 H new ATOM 0 HB3 SER A 28 3.124 -1.353 -33.641 1.00 1.00 H new ATOM 0 HG SER A 28 2.768 -3.514 -34.399 1.00 1.00 H new ATOM 449 N GLU A 29 0.940 0.519 -31.600 1.00 1.00 N ATOM 450 CA GLU A 29 0.767 1.962 -31.334 1.00 1.00 C ATOM 451 C GLU A 29 0.845 2.286 -29.811 1.00 1.00 C ATOM 452 O GLU A 29 1.504 3.271 -29.444 1.00 1.00 O ATOM 453 CB GLU A 29 -0.519 2.448 -31.914 1.00 1.00 C ATOM 454 CG GLU A 29 -0.343 3.119 -33.249 1.00 1.00 C ATOM 455 CD GLU A 29 -1.615 3.110 -34.059 1.00 1.00 C ATOM 456 OE1 GLU A 29 -2.410 4.064 -33.922 1.00 1.00 O ATOM 457 OE2 GLU A 29 -1.821 2.150 -34.833 1.00 1.00 O ATOM 0 H GLU A 29 0.064 0.041 -31.813 1.00 1.00 H new ATOM 0 HA GLU A 29 1.591 2.487 -31.818 1.00 1.00 H new ATOM 0 HB2 GLU A 29 -1.203 1.607 -32.023 1.00 1.00 H new ATOM 0 HB3 GLU A 29 -0.983 3.148 -31.220 1.00 1.00 H new ATOM 0 HG2 GLU A 29 -0.017 4.148 -33.097 1.00 1.00 H new ATOM 0 HG3 GLU A 29 0.446 2.614 -33.807 1.00 1.00 H new ATOM 464 N LEU A 30 0.270 1.336 -28.988 1.00 1.00 N ATOM 465 CA LEU A 30 0.410 1.371 -27.506 1.00 1.00 C ATOM 466 C LEU A 30 1.867 1.072 -27.058 1.00 1.00 C ATOM 467 O LEU A 30 2.201 1.197 -25.867 1.00 1.00 O ATOM 468 CB LEU A 30 -0.564 0.414 -26.858 1.00 1.00 C ATOM 469 CG LEU A 30 -1.945 0.983 -26.520 1.00 1.00 C ATOM 470 CD1 LEU A 30 -3.026 0.113 -27.123 1.00 1.00 C ATOM 471 CD2 LEU A 30 -2.132 1.076 -25.009 1.00 1.00 C ATOM 0 H LEU A 30 -0.284 0.553 -29.334 1.00 1.00 H new ATOM 0 HA LEU A 30 0.172 2.382 -27.175 1.00 1.00 H new ATOM 0 HB2 LEU A 30 -0.698 -0.440 -27.522 1.00 1.00 H new ATOM 0 HB3 LEU A 30 -0.114 0.037 -25.940 1.00 1.00 H new ATOM 0 HG LEU A 30 -2.018 1.986 -26.941 1.00 1.00 H new ATOM 0 HD11 LEU A 30 -4.004 0.526 -26.877 1.00 1.00 H new ATOM 0 HD12 LEU A 30 -2.907 0.083 -28.206 1.00 1.00 H new ATOM 0 HD13 LEU A 30 -2.947 -0.897 -26.721 1.00 1.00 H new ATOM 0 HD21 LEU A 30 -3.119 1.483 -24.789 1.00 1.00 H new ATOM 0 HD22 LEU A 30 -2.042 0.083 -24.569 1.00 1.00 H new ATOM 0 HD23 LEU A 30 -1.368 1.729 -24.587 1.00 1.00 H new ATOM 483 N ALA A 31 2.721 0.762 -28.083 1.00 1.00 N ATOM 484 CA ALA A 31 4.141 0.573 -27.902 1.00 1.00 C ATOM 485 C ALA A 31 4.927 1.795 -28.326 1.00 1.00 C ATOM 486 O ALA A 31 5.993 2.060 -27.749 1.00 1.00 O ATOM 487 CB ALA A 31 4.619 -0.655 -28.636 1.00 1.00 C ATOM 0 H ALA A 31 2.413 0.643 -29.048 1.00 1.00 H new ATOM 0 HA ALA A 31 4.317 0.425 -26.837 1.00 1.00 H new ATOM 0 HB1 ALA A 31 5.692 -0.775 -28.484 1.00 1.00 H new ATOM 0 HB2 ALA A 31 4.098 -1.533 -28.254 1.00 1.00 H new ATOM 0 HB3 ALA A 31 4.414 -0.545 -29.701 1.00 1.00 H new ATOM 493 N ARG A 32 4.352 2.576 -29.313 1.00 1.00 N ATOM 494 CA ARG A 32 4.938 3.850 -29.803 1.00 1.00 C ATOM 495 C ARG A 32 4.971 4.929 -28.706 1.00 1.00 C ATOM 496 O ARG A 32 6.020 5.545 -28.482 1.00 1.00 O ATOM 497 CB ARG A 32 4.192 4.358 -31.021 1.00 1.00 C ATOM 498 CG ARG A 32 4.748 3.854 -32.327 1.00 1.00 C ATOM 499 CD ARG A 32 3.973 4.433 -33.478 1.00 1.00 C ATOM 500 NE ARG A 32 4.482 4.009 -34.797 1.00 1.00 N ATOM 501 CZ ARG A 32 4.469 4.778 -35.905 1.00 1.00 C ATOM 502 NH1 ARG A 32 4.149 6.055 -35.845 1.00 1.00 N ATOM 503 NH2 ARG A 32 4.790 4.260 -37.064 1.00 1.00 N ATOM 0 H ARG A 32 3.478 2.328 -29.776 1.00 1.00 H new ATOM 0 HA ARG A 32 5.968 3.637 -30.088 1.00 1.00 H new ATOM 0 HB2 ARG A 32 3.146 4.063 -30.944 1.00 1.00 H new ATOM 0 HB3 ARG A 32 4.217 5.448 -31.022 1.00 1.00 H new ATOM 0 HG2 ARG A 32 5.800 4.127 -32.413 1.00 1.00 H new ATOM 0 HG3 ARG A 32 4.698 2.766 -32.356 1.00 1.00 H new ATOM 0 HD2 ARG A 32 2.928 4.138 -33.388 1.00 1.00 H new ATOM 0 HD3 ARG A 32 4.004 5.521 -33.417 1.00 1.00 H new ATOM 0 HE ARG A 32 4.871 3.069 -34.876 1.00 1.00 H new ATOM 0 HH11 ARG A 32 3.905 6.478 -34.949 1.00 1.00 H new ATOM 0 HH12 ARG A 32 4.145 6.620 -36.694 1.00 1.00 H new ATOM 0 HH21 ARG A 32 5.050 3.276 -37.128 1.00 1.00 H new ATOM 0 HH22 ARG A 32 4.780 4.841 -37.902 1.00 1.00 H new ATOM 517 N ILE A 33 3.823 5.078 -27.971 1.00 1.00 N ATOM 518 CA ILE A 33 3.690 5.973 -26.819 1.00 1.00 C ATOM 519 C ILE A 33 4.310 5.304 -25.558 1.00 1.00 C ATOM 520 O ILE A 33 3.568 4.832 -24.648 1.00 1.00 O ATOM 521 CB ILE A 33 2.162 6.394 -26.596 1.00 1.00 C ATOM 522 CG1 ILE A 33 2.067 7.456 -25.467 1.00 1.00 C ATOM 523 CG2 ILE A 33 1.286 5.151 -26.274 1.00 1.00 C ATOM 524 CD1 ILE A 33 1.427 8.739 -25.877 1.00 1.00 C ATOM 0 H ILE A 33 2.967 4.565 -28.181 1.00 1.00 H new ATOM 0 HA ILE A 33 4.241 6.894 -27.012 1.00 1.00 H new ATOM 0 HB ILE A 33 1.780 6.833 -27.517 1.00 1.00 H new ATOM 0 HG12 ILE A 33 1.504 7.034 -24.635 1.00 1.00 H new ATOM 0 HG13 ILE A 33 3.071 7.667 -25.098 1.00 1.00 H new ATOM 0 HG21 ILE A 33 0.252 5.463 -26.127 1.00 1.00 H new ATOM 0 HG22 ILE A 33 1.337 4.445 -27.103 1.00 1.00 H new ATOM 0 HG23 ILE A 33 1.653 4.672 -25.366 1.00 1.00 H new ATOM 0 HD11 ILE A 33 1.403 9.421 -25.027 1.00 1.00 H new ATOM 0 HD12 ILE A 33 2.000 9.189 -26.687 1.00 1.00 H new ATOM 0 HD13 ILE A 33 0.409 8.546 -26.216 1.00 1.00 H new ATOM 536 N LEU A 34 5.624 5.308 -25.457 1.00 1.00 N ATOM 537 CA LEU A 34 6.333 4.620 -24.359 1.00 1.00 C ATOM 538 C LEU A 34 7.831 4.531 -24.652 1.00 1.00 C ATOM 539 O LEU A 34 8.297 5.056 -25.692 1.00 1.00 O ATOM 540 CB LEU A 34 5.729 3.179 -24.140 1.00 1.00 C ATOM 541 CG LEU A 34 5.278 2.876 -22.718 1.00 1.00 C ATOM 542 CD1 LEU A 34 3.852 2.341 -22.701 1.00 1.00 C ATOM 543 CD2 LEU A 34 6.227 1.898 -22.079 1.00 1.00 C ATOM 0 H LEU A 34 6.240 5.779 -26.120 1.00 1.00 H new ATOM 0 HA LEU A 34 6.199 5.200 -23.446 1.00 1.00 H new ATOM 0 HB2 LEU A 34 4.878 3.054 -24.809 1.00 1.00 H new ATOM 0 HB3 LEU A 34 6.476 2.441 -24.433 1.00 1.00 H new ATOM 0 HG LEU A 34 5.289 3.802 -22.143 1.00 1.00 H new ATOM 0 HD11 LEU A 34 3.554 2.132 -21.674 1.00 1.00 H new ATOM 0 HD12 LEU A 34 3.180 3.084 -23.130 1.00 1.00 H new ATOM 0 HD13 LEU A 34 3.801 1.423 -23.287 1.00 1.00 H new ATOM 0 HD21 LEU A 34 5.899 1.685 -21.062 1.00 1.00 H new ATOM 0 HD22 LEU A 34 6.241 0.974 -22.657 1.00 1.00 H new ATOM 0 HD23 LEU A 34 7.229 2.326 -22.055 1.00 1.00 H new ATOM 644 N SER A 41 4.655 -8.287 -28.984 1.00 1.00 N ATOM 645 CA SER A 41 3.908 -7.450 -28.033 1.00 1.00 C ATOM 646 C SER A 41 2.405 -7.559 -28.225 1.00 1.00 C ATOM 647 O SER A 41 1.639 -7.265 -27.286 1.00 1.00 O ATOM 648 CB SER A 41 4.331 -5.975 -28.142 1.00 1.00 C ATOM 649 OG SER A 41 4.337 -5.517 -29.499 1.00 1.00 O ATOM 0 HA SER A 41 4.151 -7.825 -27.039 1.00 1.00 H new ATOM 0 HB2 SER A 41 3.651 -5.358 -27.554 1.00 1.00 H new ATOM 0 HB3 SER A 41 5.325 -5.850 -27.713 1.00 1.00 H new ATOM 0 HG SER A 41 4.586 -6.256 -30.093 1.00 1.00 H new ATOM 655 N LYS A 42 1.996 -8.077 -29.422 1.00 1.00 N ATOM 656 CA LYS A 42 0.576 -8.189 -29.845 1.00 1.00 C ATOM 657 C LYS A 42 -0.251 -9.151 -28.963 1.00 1.00 C ATOM 658 O LYS A 42 -1.348 -8.766 -28.536 1.00 1.00 O ATOM 659 CB LYS A 42 0.479 -8.607 -31.310 1.00 1.00 C ATOM 660 CG LYS A 42 0.739 -7.485 -32.296 1.00 1.00 C ATOM 661 CD LYS A 42 0.765 -8.000 -33.718 1.00 1.00 C ATOM 662 CE LYS A 42 1.207 -6.920 -34.686 1.00 1.00 C ATOM 663 NZ LYS A 42 0.049 -6.256 -35.342 1.00 1.00 N ATOM 0 H LYS A 42 2.651 -8.429 -30.120 1.00 1.00 H new ATOM 0 HA LYS A 42 0.144 -7.196 -29.719 1.00 1.00 H new ATOM 0 HB2 LYS A 42 1.192 -9.410 -31.495 1.00 1.00 H new ATOM 0 HB3 LYS A 42 -0.515 -9.015 -31.495 1.00 1.00 H new ATOM 0 HG2 LYS A 42 -0.035 -6.724 -32.197 1.00 1.00 H new ATOM 0 HG3 LYS A 42 1.690 -7.006 -32.063 1.00 1.00 H new ATOM 0 HD2 LYS A 42 1.442 -8.852 -33.786 1.00 1.00 H new ATOM 0 HD3 LYS A 42 -0.227 -8.357 -33.996 1.00 1.00 H new ATOM 0 HE2 LYS A 42 1.799 -6.175 -34.154 1.00 1.00 H new ATOM 0 HE3 LYS A 42 1.854 -7.357 -35.447 1.00 1.00 H new ATOM 0 HZ1 LYS A 42 0.393 -5.524 -35.996 1.00 1.00 H new ATOM 0 HZ2 LYS A 42 -0.502 -6.962 -35.871 1.00 1.00 H new ATOM 0 HZ3 LYS A 42 -0.555 -5.817 -34.618 1.00 1.00 H new ATOM 677 N LYS A 43 0.369 -10.318 -28.612 1.00 1.00 N ATOM 678 CA LYS A 43 -0.256 -11.340 -27.752 1.00 1.00 C ATOM 679 C LYS A 43 -0.337 -10.921 -26.271 1.00 1.00 C ATOM 680 O LYS A 43 -1.270 -11.308 -25.556 1.00 1.00 O ATOM 681 CB LYS A 43 0.494 -12.644 -27.875 1.00 1.00 C ATOM 682 CG LYS A 43 -0.175 -13.630 -28.797 1.00 1.00 C ATOM 683 CD LYS A 43 0.689 -14.856 -28.995 1.00 1.00 C ATOM 684 CE LYS A 43 0.005 -15.873 -29.889 1.00 1.00 C ATOM 685 NZ LYS A 43 0.690 -17.194 -29.848 1.00 1.00 N ATOM 0 H LYS A 43 1.309 -10.564 -28.921 1.00 1.00 H new ATOM 0 HA LYS A 43 -1.281 -11.459 -28.102 1.00 1.00 H new ATOM 0 HB2 LYS A 43 1.502 -12.443 -28.238 1.00 1.00 H new ATOM 0 HB3 LYS A 43 0.595 -13.092 -26.886 1.00 1.00 H new ATOM 0 HG2 LYS A 43 -1.140 -13.923 -28.384 1.00 1.00 H new ATOM 0 HG3 LYS A 43 -0.370 -13.159 -29.760 1.00 1.00 H new ATOM 0 HD2 LYS A 43 1.643 -14.564 -29.435 1.00 1.00 H new ATOM 0 HD3 LYS A 43 0.909 -15.308 -28.028 1.00 1.00 H new ATOM 0 HE2 LYS A 43 -1.033 -15.992 -29.577 1.00 1.00 H new ATOM 0 HE3 LYS A 43 -0.011 -15.503 -30.914 1.00 1.00 H new ATOM 0 HZ1 LYS A 43 0.193 -17.862 -30.471 1.00 1.00 H new ATOM 0 HZ2 LYS A 43 1.673 -17.085 -30.170 1.00 1.00 H new ATOM 0 HZ3 LYS A 43 0.683 -17.559 -28.874 1.00 1.00 H new ATOM 699 N VAL A 44 0.637 -10.057 -25.882 1.00 1.00 N ATOM 700 CA VAL A 44 0.746 -9.518 -24.503 1.00 1.00 C ATOM 701 C VAL A 44 -0.427 -8.561 -24.170 1.00 1.00 C ATOM 702 O VAL A 44 -0.999 -8.644 -23.076 1.00 1.00 O ATOM 703 CB VAL A 44 2.108 -8.804 -24.244 1.00 1.00 C ATOM 704 CG1 VAL A 44 2.435 -8.824 -22.756 1.00 1.00 C ATOM 705 CG2 VAL A 44 3.230 -9.426 -25.061 1.00 1.00 C ATOM 0 H VAL A 44 1.364 -9.717 -26.512 1.00 1.00 H new ATOM 0 HA VAL A 44 0.694 -10.381 -23.839 1.00 1.00 H new ATOM 0 HB VAL A 44 2.015 -7.767 -24.566 1.00 1.00 H new ATOM 0 HG11 VAL A 44 3.388 -8.323 -22.586 1.00 1.00 H new ATOM 0 HG12 VAL A 44 1.650 -8.307 -22.204 1.00 1.00 H new ATOM 0 HG13 VAL A 44 2.501 -9.856 -22.412 1.00 1.00 H new ATOM 0 HG21 VAL A 44 4.164 -8.903 -24.855 1.00 1.00 H new ATOM 0 HG22 VAL A 44 3.336 -10.477 -24.792 1.00 1.00 H new ATOM 0 HG23 VAL A 44 2.995 -9.345 -26.122 1.00 1.00 H new ATOM 715 N ILE A 45 -0.752 -7.701 -25.158 1.00 1.00 N ATOM 716 CA ILE A 45 -1.835 -6.714 -25.027 1.00 1.00 C ATOM 717 C ILE A 45 -3.214 -7.355 -25.112 1.00 1.00 C ATOM 718 O ILE A 45 -4.132 -6.898 -24.420 1.00 1.00 O ATOM 719 CB ILE A 45 -1.693 -5.532 -26.048 1.00 1.00 C ATOM 720 CG1 ILE A 45 -0.215 -5.005 -26.122 1.00 1.00 C ATOM 721 CG2 ILE A 45 -2.644 -4.388 -25.668 1.00 1.00 C ATOM 722 CD1 ILE A 45 0.382 -4.512 -24.795 1.00 1.00 C ATOM 0 H ILE A 45 -0.274 -7.674 -26.059 1.00 1.00 H new ATOM 0 HA ILE A 45 -1.736 -6.290 -24.028 1.00 1.00 H new ATOM 0 HB ILE A 45 -1.961 -5.911 -27.034 1.00 1.00 H new ATOM 0 HG12 ILE A 45 0.417 -5.804 -26.510 1.00 1.00 H new ATOM 0 HG13 ILE A 45 -0.175 -4.189 -26.843 1.00 1.00 H new ATOM 0 HG21 ILE A 45 -2.537 -3.573 -26.384 1.00 1.00 H new ATOM 0 HG22 ILE A 45 -3.672 -4.750 -25.681 1.00 1.00 H new ATOM 0 HG23 ILE A 45 -2.399 -4.028 -24.669 1.00 1.00 H new ATOM 0 HD11 ILE A 45 1.404 -4.171 -24.960 1.00 1.00 H new ATOM 0 HD12 ILE A 45 -0.218 -3.687 -24.410 1.00 1.00 H new ATOM 0 HD13 ILE A 45 0.384 -5.327 -24.072 1.00 1.00 H new ATOM 734 N LEU A 46 -3.334 -8.342 -26.015 1.00 1.00 N ATOM 735 CA LEU A 46 -4.571 -9.087 -26.236 1.00 1.00 C ATOM 736 C LEU A 46 -4.994 -9.905 -25.000 1.00 1.00 C ATOM 737 O LEU A 46 -6.199 -9.989 -24.710 1.00 1.00 O ATOM 738 CB LEU A 46 -4.443 -9.982 -27.460 1.00 1.00 C ATOM 739 CG LEU A 46 -4.543 -9.278 -28.826 1.00 1.00 C ATOM 740 CD1 LEU A 46 -3.886 -10.127 -29.887 1.00 1.00 C ATOM 741 CD2 LEU A 46 -5.989 -8.987 -29.200 1.00 1.00 C ATOM 0 H LEU A 46 -2.565 -8.643 -26.614 1.00 1.00 H new ATOM 0 HA LEU A 46 -5.359 -8.356 -26.415 1.00 1.00 H new ATOM 0 HB2 LEU A 46 -3.484 -10.498 -27.409 1.00 1.00 H new ATOM 0 HB3 LEU A 46 -5.219 -10.746 -27.410 1.00 1.00 H new ATOM 0 HG LEU A 46 -4.024 -8.322 -28.755 1.00 1.00 H new ATOM 0 HD11 LEU A 46 -3.959 -9.625 -30.852 1.00 1.00 H new ATOM 0 HD12 LEU A 46 -2.836 -10.277 -29.635 1.00 1.00 H new ATOM 0 HD13 LEU A 46 -4.387 -11.093 -29.942 1.00 1.00 H new ATOM 0 HD21 LEU A 46 -6.021 -8.490 -30.170 1.00 1.00 H new ATOM 0 HD22 LEU A 46 -6.546 -9.922 -29.253 1.00 1.00 H new ATOM 0 HD23 LEU A 46 -6.437 -8.340 -28.446 1.00 1.00 H new ATOM 753 N GLU A 47 -3.956 -10.426 -24.271 1.00 1.00 N ATOM 754 CA GLU A 47 -4.144 -11.122 -22.988 1.00 1.00 C ATOM 755 C GLU A 47 -4.433 -10.124 -21.845 1.00 1.00 C ATOM 756 O GLU A 47 -5.144 -10.463 -20.880 1.00 1.00 O ATOM 757 CB GLU A 47 -2.963 -11.990 -22.664 1.00 1.00 C ATOM 758 CG GLU A 47 -3.176 -13.436 -23.057 1.00 1.00 C ATOM 759 CD GLU A 47 -2.037 -14.325 -22.616 1.00 1.00 C ATOM 760 OE1 GLU A 47 -1.065 -14.474 -23.387 1.00 1.00 O ATOM 761 OE2 GLU A 47 -2.118 -14.876 -21.499 1.00 1.00 O ATOM 0 H GLU A 47 -2.982 -10.368 -24.567 1.00 1.00 H new ATOM 0 HA GLU A 47 -5.015 -11.770 -23.089 1.00 1.00 H new ATOM 0 HB2 GLU A 47 -2.082 -11.604 -23.177 1.00 1.00 H new ATOM 0 HB3 GLU A 47 -2.759 -11.935 -21.595 1.00 1.00 H new ATOM 0 HG2 GLU A 47 -4.106 -13.796 -22.617 1.00 1.00 H new ATOM 0 HG3 GLU A 47 -3.288 -13.503 -24.139 1.00 1.00 H new ATOM 768 N ASP A 48 -3.910 -8.844 -22.034 1.00 1.00 N ATOM 769 CA ASP A 48 -4.193 -7.698 -21.135 1.00 1.00 C ATOM 770 C ASP A 48 -5.661 -7.260 -21.218 1.00 1.00 C ATOM 771 O ASP A 48 -6.259 -6.920 -20.193 1.00 1.00 O ATOM 772 CB ASP A 48 -3.276 -6.545 -21.419 1.00 1.00 C ATOM 773 CG ASP A 48 -2.431 -6.181 -20.234 1.00 1.00 C ATOM 774 OD1 ASP A 48 -2.921 -5.429 -19.366 1.00 1.00 O ATOM 775 OD2 ASP A 48 -1.276 -6.642 -20.179 1.00 1.00 O ATOM 0 H ASP A 48 -3.292 -8.607 -22.810 1.00 1.00 H new ATOM 0 HA ASP A 48 -4.007 -8.036 -20.116 1.00 1.00 H new ATOM 0 HB2 ASP A 48 -2.629 -6.797 -22.259 1.00 1.00 H new ATOM 0 HB3 ASP A 48 -3.867 -5.680 -21.720 1.00 1.00 H new ATOM 780 N LEU A 49 -6.266 -7.483 -22.435 1.00 1.00 N ATOM 781 CA LEU A 49 -7.696 -7.236 -22.688 1.00 1.00 C ATOM 782 C LEU A 49 -8.625 -8.159 -21.931 1.00 1.00 C ATOM 783 O LEU A 49 -9.707 -7.715 -21.515 1.00 1.00 O ATOM 784 CB LEU A 49 -7.997 -7.292 -24.189 1.00 1.00 C ATOM 785 CG LEU A 49 -8.246 -5.936 -24.894 1.00 1.00 C ATOM 786 CD1 LEU A 49 -9.639 -5.408 -24.552 1.00 1.00 C ATOM 787 CD2 LEU A 49 -7.172 -4.905 -24.537 1.00 1.00 C ATOM 0 H LEU A 49 -5.763 -7.836 -23.249 1.00 1.00 H new ATOM 0 HA LEU A 49 -7.893 -6.233 -22.309 1.00 1.00 H new ATOM 0 HB2 LEU A 49 -7.163 -7.787 -24.686 1.00 1.00 H new ATOM 0 HB3 LEU A 49 -8.875 -7.920 -24.338 1.00 1.00 H new ATOM 0 HG LEU A 49 -8.188 -6.105 -25.969 1.00 1.00 H new ATOM 0 HD11 LEU A 49 -9.800 -4.454 -25.055 1.00 1.00 H new ATOM 0 HD12 LEU A 49 -10.391 -6.124 -24.883 1.00 1.00 H new ATOM 0 HD13 LEU A 49 -9.721 -5.268 -23.474 1.00 1.00 H new ATOM 0 HD21 LEU A 49 -7.382 -3.967 -25.052 1.00 1.00 H new ATOM 0 HD22 LEU A 49 -7.173 -4.736 -23.460 1.00 1.00 H new ATOM 0 HD23 LEU A 49 -6.195 -5.276 -24.845 1.00 1.00 H new ATOM 799 N LYS A 50 -8.131 -9.404 -21.733 1.00 1.00 N ATOM 800 CA LYS A 50 -8.839 -10.458 -20.984 1.00 1.00 C ATOM 801 C LYS A 50 -9.058 -10.089 -19.506 1.00 1.00 C ATOM 802 O LYS A 50 -10.144 -10.305 -18.966 1.00 1.00 O ATOM 803 CB LYS A 50 -8.111 -11.784 -21.075 1.00 1.00 C ATOM 804 CG LYS A 50 -8.300 -12.503 -22.392 1.00 1.00 C ATOM 805 CD LYS A 50 -7.541 -13.806 -22.420 1.00 1.00 C ATOM 806 CE LYS A 50 -7.627 -14.458 -23.785 1.00 1.00 C ATOM 807 NZ LYS A 50 -7.235 -15.891 -23.734 1.00 1.00 N ATOM 0 H LYS A 50 -7.224 -9.703 -22.092 1.00 1.00 H new ATOM 0 HA LYS A 50 -9.818 -10.553 -21.453 1.00 1.00 H new ATOM 0 HB2 LYS A 50 -7.046 -11.613 -20.916 1.00 1.00 H new ATOM 0 HB3 LYS A 50 -8.454 -12.431 -20.268 1.00 1.00 H new ATOM 0 HG2 LYS A 50 -9.361 -12.694 -22.555 1.00 1.00 H new ATOM 0 HG3 LYS A 50 -7.962 -11.865 -23.209 1.00 1.00 H new ATOM 0 HD2 LYS A 50 -6.497 -13.628 -22.164 1.00 1.00 H new ATOM 0 HD3 LYS A 50 -7.944 -14.481 -21.665 1.00 1.00 H new ATOM 0 HE2 LYS A 50 -8.645 -14.372 -24.166 1.00 1.00 H new ATOM 0 HE3 LYS A 50 -6.979 -13.928 -24.483 1.00 1.00 H new ATOM 0 HZ1 LYS A 50 -7.306 -16.304 -24.686 1.00 1.00 H new ATOM 0 HZ2 LYS A 50 -6.255 -15.971 -23.394 1.00 1.00 H new ATOM 0 HZ3 LYS A 50 -7.869 -16.402 -23.087 1.00 1.00 H new ATOM 821 N VAL A 51 -8.045 -9.387 -18.928 1.00 1.00 N ATOM 822 CA VAL A 51 -8.039 -8.911 -17.535 1.00 1.00 C ATOM 823 C VAL A 51 -8.960 -7.695 -17.335 1.00 1.00 C ATOM 824 O VAL A 51 -9.803 -7.731 -16.437 1.00 1.00 O ATOM 825 CB VAL A 51 -6.609 -8.545 -17.033 1.00 1.00 C ATOM 826 CG1 VAL A 51 -6.408 -9.034 -15.608 1.00 1.00 C ATOM 827 CG2 VAL A 51 -5.523 -9.090 -17.955 1.00 1.00 C ATOM 0 H VAL A 51 -7.197 -9.136 -19.436 1.00 1.00 H new ATOM 0 HA VAL A 51 -8.414 -9.748 -16.946 1.00 1.00 H new ATOM 0 HB VAL A 51 -6.522 -7.459 -17.046 1.00 1.00 H new ATOM 0 HG11 VAL A 51 -5.405 -8.771 -15.271 1.00 1.00 H new ATOM 0 HG12 VAL A 51 -7.144 -8.565 -14.955 1.00 1.00 H new ATOM 0 HG13 VAL A 51 -6.530 -10.117 -15.574 1.00 1.00 H new ATOM 0 HG21 VAL A 51 -4.543 -8.812 -17.567 1.00 1.00 H new ATOM 0 HG22 VAL A 51 -5.599 -10.176 -18.004 1.00 1.00 H new ATOM 0 HG23 VAL A 51 -5.650 -8.672 -18.954 1.00 1.00 H new ATOM 837 N ILE A 52 -8.876 -6.739 -18.291 1.00 1.00 N ATOM 838 CA ILE A 52 -9.640 -5.483 -18.253 1.00 1.00 C ATOM 839 C ILE A 52 -11.137 -5.715 -18.558 1.00 1.00 C ATOM 840 O ILE A 52 -11.966 -4.999 -17.994 1.00 1.00 O ATOM 841 CB ILE A 52 -9.066 -4.393 -19.206 1.00 1.00 C ATOM 842 CG1 ILE A 52 -7.539 -4.247 -19.010 1.00 1.00 C ATOM 843 CG2 ILE A 52 -9.767 -3.046 -18.962 1.00 1.00 C ATOM 844 CD1 ILE A 52 -6.794 -3.868 -20.272 1.00 1.00 C ATOM 0 H ILE A 52 -8.273 -6.824 -19.109 1.00 1.00 H new ATOM 0 HA ILE A 52 -9.541 -5.111 -17.233 1.00 1.00 H new ATOM 0 HB ILE A 52 -9.253 -4.703 -20.234 1.00 1.00 H new ATOM 0 HG12 ILE A 52 -7.351 -3.491 -18.247 1.00 1.00 H new ATOM 0 HG13 ILE A 52 -7.139 -5.188 -18.632 1.00 1.00 H new ATOM 0 HG21 ILE A 52 -9.355 -2.294 -19.635 1.00 1.00 H new ATOM 0 HG22 ILE A 52 -10.836 -3.153 -19.148 1.00 1.00 H new ATOM 0 HG23 ILE A 52 -9.608 -2.735 -17.930 1.00 1.00 H new ATOM 0 HD11 ILE A 52 -5.729 -3.784 -20.055 1.00 1.00 H new ATOM 0 HD12 ILE A 52 -6.950 -4.635 -21.031 1.00 1.00 H new ATOM 0 HD13 ILE A 52 -7.165 -2.912 -20.640 1.00 1.00 H new ATOM 856 N SER A 53 -11.431 -6.713 -19.426 1.00 1.00 N ATOM 857 CA SER A 53 -12.815 -7.063 -19.815 1.00 1.00 C ATOM 858 C SER A 53 -13.658 -7.589 -18.626 1.00 1.00 C ATOM 859 O SER A 53 -14.865 -7.289 -18.551 1.00 1.00 O ATOM 860 CB SER A 53 -12.832 -8.077 -20.926 1.00 1.00 C ATOM 861 OG SER A 53 -13.998 -7.928 -21.712 1.00 1.00 O ATOM 0 H SER A 53 -10.720 -7.293 -19.872 1.00 1.00 H new ATOM 0 HA SER A 53 -13.269 -6.135 -20.163 1.00 1.00 H new ATOM 0 HB2 SER A 53 -11.947 -7.956 -21.551 1.00 1.00 H new ATOM 0 HB3 SER A 53 -12.793 -9.083 -20.509 1.00 1.00 H new ATOM 0 HG SER A 53 -13.995 -8.593 -22.432 1.00 1.00 H new ATOM 867 N LYS A 54 -12.958 -8.280 -17.665 1.00 1.00 N ATOM 868 CA LYS A 54 -13.580 -8.815 -16.438 1.00 1.00 C ATOM 869 C LYS A 54 -13.975 -7.721 -15.444 1.00 1.00 C ATOM 870 O LYS A 54 -15.027 -7.819 -14.797 1.00 1.00 O ATOM 871 CB LYS A 54 -12.667 -9.816 -15.767 1.00 1.00 C ATOM 872 CG LYS A 54 -12.844 -11.229 -16.274 1.00 1.00 C ATOM 873 CD LYS A 54 -11.861 -12.165 -15.612 1.00 1.00 C ATOM 874 CE LYS A 54 -12.036 -13.582 -16.118 1.00 1.00 C ATOM 875 NZ LYS A 54 -11.071 -14.518 -15.487 1.00 1.00 N ATOM 0 H LYS A 54 -11.958 -8.471 -17.733 1.00 1.00 H new ATOM 0 HA LYS A 54 -14.498 -9.312 -16.752 1.00 1.00 H new ATOM 0 HB2 LYS A 54 -11.632 -9.511 -15.920 1.00 1.00 H new ATOM 0 HB3 LYS A 54 -12.849 -9.799 -14.692 1.00 1.00 H new ATOM 0 HG2 LYS A 54 -13.862 -11.566 -16.077 1.00 1.00 H new ATOM 0 HG3 LYS A 54 -12.704 -11.252 -17.355 1.00 1.00 H new ATOM 0 HD2 LYS A 54 -10.843 -11.828 -15.809 1.00 1.00 H new ATOM 0 HD3 LYS A 54 -12.002 -12.141 -14.531 1.00 1.00 H new ATOM 0 HE2 LYS A 54 -13.053 -13.917 -15.915 1.00 1.00 H new ATOM 0 HE3 LYS A 54 -11.905 -13.600 -17.200 1.00 1.00 H new ATOM 0 HZ1 LYS A 54 -11.223 -15.477 -15.860 1.00 1.00 H new ATOM 0 HZ2 LYS A 54 -10.100 -14.213 -15.702 1.00 1.00 H new ATOM 0 HZ3 LYS A 54 -11.213 -14.520 -14.457 1.00 1.00 H new ATOM 889 N ILE A 55 -13.144 -6.648 -15.422 1.00 1.00 N ATOM 890 CA ILE A 55 -13.352 -5.487 -14.547 1.00 1.00 C ATOM 891 C ILE A 55 -14.321 -4.485 -15.167 1.00 1.00 C ATOM 892 O ILE A 55 -15.173 -3.988 -14.432 1.00 1.00 O ATOM 893 CB ILE A 55 -12.027 -4.763 -14.144 1.00 1.00 C ATOM 894 CG1 ILE A 55 -10.938 -5.781 -13.755 1.00 1.00 C ATOM 895 CG2 ILE A 55 -12.278 -3.787 -12.983 1.00 1.00 C ATOM 896 CD1 ILE A 55 -9.568 -5.446 -14.299 1.00 1.00 C ATOM 0 H ILE A 55 -12.316 -6.572 -16.012 1.00 1.00 H new ATOM 0 HA ILE A 55 -13.787 -5.892 -13.633 1.00 1.00 H new ATOM 0 HB ILE A 55 -11.676 -4.199 -15.008 1.00 1.00 H new ATOM 0 HG12 ILE A 55 -10.882 -5.842 -12.668 1.00 1.00 H new ATOM 0 HG13 ILE A 55 -11.230 -6.767 -14.115 1.00 1.00 H new ATOM 0 HG21 ILE A 55 -11.344 -3.292 -12.716 1.00 1.00 H new ATOM 0 HG22 ILE A 55 -13.011 -3.040 -13.288 1.00 1.00 H new ATOM 0 HG23 ILE A 55 -12.657 -4.336 -12.121 1.00 1.00 H new ATOM 0 HD11 ILE A 55 -8.855 -6.208 -13.983 1.00 1.00 H new ATOM 0 HD12 ILE A 55 -9.607 -5.414 -15.388 1.00 1.00 H new ATOM 0 HD13 ILE A 55 -9.253 -4.474 -13.919 1.00 1.00 H new ATOM 908 N ALA A 56 -14.202 -4.274 -16.517 1.00 1.00 N ATOM 909 CA ALA A 56 -15.042 -3.342 -17.270 1.00 1.00 C ATOM 910 C ALA A 56 -16.572 -3.670 -17.187 1.00 1.00 C ATOM 911 O ALA A 56 -17.389 -2.764 -17.328 1.00 1.00 O ATOM 912 CB ALA A 56 -14.572 -3.272 -18.697 1.00 1.00 C ATOM 0 H ALA A 56 -13.513 -4.757 -17.094 1.00 1.00 H new ATOM 0 HA ALA A 56 -14.932 -2.363 -16.803 1.00 1.00 H new ATOM 0 HB1 ALA A 56 -15.201 -2.577 -19.253 1.00 1.00 H new ATOM 0 HB2 ALA A 56 -13.538 -2.927 -18.723 1.00 1.00 H new ATOM 0 HB3 ALA A 56 -14.636 -4.261 -19.150 1.00 1.00 H new ATOM 918 N LYS A 57 -16.861 -4.967 -16.961 1.00 1.00 N ATOM 919 CA LYS A 57 -18.263 -5.479 -16.874 1.00 1.00 C ATOM 920 C LYS A 57 -18.884 -5.433 -15.480 1.00 1.00 C ATOM 921 O LYS A 57 -20.098 -5.185 -15.323 1.00 1.00 O ATOM 922 CB LYS A 57 -18.300 -6.848 -17.496 1.00 1.00 C ATOM 923 CG LYS A 57 -18.636 -6.824 -18.964 1.00 1.00 C ATOM 924 CD LYS A 57 -18.803 -8.223 -19.493 1.00 1.00 C ATOM 925 CE LYS A 57 -18.069 -8.415 -20.807 1.00 1.00 C ATOM 926 NZ LYS A 57 -18.662 -9.518 -21.610 1.00 1.00 N ATOM 0 H LYS A 57 -16.150 -5.687 -16.834 1.00 1.00 H new ATOM 0 HA LYS A 57 -18.905 -4.798 -17.433 1.00 1.00 H new ATOM 0 HB2 LYS A 57 -17.331 -7.328 -17.359 1.00 1.00 H new ATOM 0 HB3 LYS A 57 -19.035 -7.459 -16.972 1.00 1.00 H new ATOM 0 HG2 LYS A 57 -19.554 -6.257 -19.123 1.00 1.00 H new ATOM 0 HG3 LYS A 57 -17.846 -6.313 -19.515 1.00 1.00 H new ATOM 0 HD2 LYS A 57 -18.429 -8.937 -18.759 1.00 1.00 H new ATOM 0 HD3 LYS A 57 -19.863 -8.435 -19.633 1.00 1.00 H new ATOM 0 HE2 LYS A 57 -18.101 -7.489 -21.381 1.00 1.00 H new ATOM 0 HE3 LYS A 57 -17.019 -8.632 -20.610 1.00 1.00 H new ATOM 0 HZ1 LYS A 57 -18.135 -9.621 -22.501 1.00 1.00 H new ATOM 0 HZ2 LYS A 57 -18.609 -10.406 -21.072 1.00 1.00 H new ATOM 0 HZ3 LYS A 57 -19.657 -9.299 -21.819 1.00 1.00 H new ATOM 940 N ARG A 58 -18.013 -5.685 -14.479 1.00 1.00 N ATOM 941 CA ARG A 58 -18.342 -5.422 -13.040 1.00 1.00 C ATOM 942 C ARG A 58 -18.417 -3.890 -12.732 1.00 1.00 C ATOM 943 O ARG A 58 -19.106 -3.466 -11.796 1.00 1.00 O ATOM 944 CB ARG A 58 -17.321 -6.051 -12.140 1.00 1.00 C ATOM 945 CG ARG A 58 -17.686 -7.441 -11.731 1.00 1.00 C ATOM 946 CD ARG A 58 -16.573 -8.031 -10.970 1.00 1.00 C ATOM 947 NE ARG A 58 -16.834 -9.408 -10.607 1.00 1.00 N ATOM 948 CZ ARG A 58 -15.862 -10.223 -10.240 1.00 1.00 C ATOM 949 NH1 ARG A 58 -14.756 -9.746 -9.706 1.00 1.00 N ATOM 950 NH2 ARG A 58 -15.993 -11.503 -10.422 1.00 1.00 N ATOM 0 H ARG A 58 -17.079 -6.068 -14.628 1.00 1.00 H new ATOM 0 HA ARG A 58 -19.321 -5.863 -12.853 1.00 1.00 H new ATOM 0 HB2 ARG A 58 -16.357 -6.068 -12.648 1.00 1.00 H new ATOM 0 HB3 ARG A 58 -17.200 -5.435 -11.249 1.00 1.00 H new ATOM 0 HG2 ARG A 58 -18.591 -7.428 -11.123 1.00 1.00 H new ATOM 0 HG3 ARG A 58 -17.902 -8.047 -12.611 1.00 1.00 H new ATOM 0 HD2 ARG A 58 -15.660 -7.979 -11.564 1.00 1.00 H new ATOM 0 HD3 ARG A 58 -16.400 -7.445 -10.068 1.00 1.00 H new ATOM 0 HE ARG A 58 -17.792 -9.757 -10.635 1.00 1.00 H new ATOM 0 HH11 ARG A 58 -14.646 -8.741 -9.573 1.00 1.00 H new ATOM 0 HH12 ARG A 58 -14.010 -10.382 -9.425 1.00 1.00 H new ATOM 0 HH21 ARG A 58 -16.843 -11.873 -10.846 1.00 1.00 H new ATOM 0 HH22 ARG A 58 -15.245 -12.137 -10.140 1.00 1.00 H new ATOM 964 N GLU A 59 -17.766 -3.101 -13.653 1.00 1.00 N ATOM 965 CA GLU A 59 -17.745 -1.647 -13.583 1.00 1.00 C ATOM 966 C GLU A 59 -18.667 -0.985 -14.619 1.00 1.00 C ATOM 967 O GLU A 59 -18.700 0.275 -14.739 1.00 1.00 O ATOM 968 CB GLU A 59 -16.325 -1.144 -13.730 1.00 1.00 C ATOM 969 CG GLU A 59 -15.740 -0.604 -12.446 1.00 1.00 C ATOM 970 CD GLU A 59 -15.311 0.842 -12.581 1.00 1.00 C ATOM 971 OE1 GLU A 59 -14.142 1.082 -12.954 1.00 1.00 O ATOM 972 OE2 GLU A 59 -16.143 1.739 -12.315 1.00 1.00 O ATOM 0 H GLU A 59 -17.253 -3.480 -14.449 1.00 1.00 H new ATOM 0 HA GLU A 59 -18.132 -1.365 -12.604 1.00 1.00 H new ATOM 0 HB2 GLU A 59 -15.696 -1.957 -14.093 1.00 1.00 H new ATOM 0 HB3 GLU A 59 -16.302 -0.361 -14.488 1.00 1.00 H new ATOM 0 HG2 GLU A 59 -16.477 -0.690 -11.648 1.00 1.00 H new ATOM 0 HG3 GLU A 59 -14.882 -1.211 -12.155 1.00 1.00 H new ATOM 979 N GLY A 60 -19.533 -1.831 -15.270 1.00 1.00 N ATOM 980 CA GLY A 60 -20.490 -1.332 -16.274 1.00 1.00 C ATOM 981 C GLY A 60 -19.885 -0.956 -17.618 1.00 1.00 C ATOM 982 O GLY A 60 -20.253 -1.568 -18.625 1.00 1.00 O ATOM 0 H GLY A 60 -19.575 -2.838 -15.110 1.00 1.00 H new ATOM 0 HA2 GLY A 60 -21.251 -2.095 -16.437 1.00 1.00 H new ATOM 0 HA3 GLY A 60 -20.998 -0.458 -15.865 1.00 1.00 H new ATOM 986 N MET A 61 -18.934 0.056 -17.542 1.00 1.00 N ATOM 987 CA MET A 61 -18.225 0.581 -18.753 1.00 1.00 C ATOM 988 C MET A 61 -17.865 -0.568 -19.738 1.00 1.00 C ATOM 989 O MET A 61 -17.226 -1.558 -19.385 1.00 1.00 O ATOM 990 CB MET A 61 -16.965 1.326 -18.399 1.00 1.00 C ATOM 991 CG MET A 61 -17.179 2.789 -18.076 1.00 1.00 C ATOM 992 SD MET A 61 -15.666 3.756 -18.213 1.00 1.00 S ATOM 993 CE MET A 61 -15.058 3.717 -16.529 1.00 1.00 C ATOM 0 H MET A 61 -18.656 0.505 -16.669 1.00 1.00 H new ATOM 0 HA MET A 61 -18.918 1.273 -19.231 1.00 1.00 H new ATOM 0 HB2 MET A 61 -16.498 0.841 -17.542 1.00 1.00 H new ATOM 0 HB3 MET A 61 -16.264 1.248 -19.230 1.00 1.00 H new ATOM 0 HG2 MET A 61 -17.931 3.200 -18.750 1.00 1.00 H new ATOM 0 HG3 MET A 61 -17.574 2.880 -17.064 1.00 1.00 H new ATOM 0 HE1 MET A 61 -14.125 4.277 -16.466 1.00 1.00 H new ATOM 0 HE2 MET A 61 -15.797 4.166 -15.865 1.00 1.00 H new ATOM 0 HE3 MET A 61 -14.882 2.684 -16.230 1.00 1.00 H new ATOM 1003 N VAL A 62 -18.470 -0.496 -20.908 1.00 1.00 N ATOM 1004 CA VAL A 62 -18.410 -1.580 -21.898 1.00 1.00 C ATOM 1005 C VAL A 62 -17.429 -1.253 -23.011 1.00 1.00 C ATOM 1006 O VAL A 62 -17.432 -0.111 -23.522 1.00 1.00 O ATOM 1007 CB VAL A 62 -19.823 -1.916 -22.499 1.00 1.00 C ATOM 1008 CG1 VAL A 62 -20.488 -3.043 -21.710 1.00 1.00 C ATOM 1009 CG2 VAL A 62 -20.741 -0.682 -22.551 1.00 1.00 C ATOM 0 H VAL A 62 -19.019 0.310 -21.209 1.00 1.00 H new ATOM 0 HA VAL A 62 -18.058 -2.466 -21.369 1.00 1.00 H new ATOM 0 HB VAL A 62 -19.665 -2.246 -23.526 1.00 1.00 H new ATOM 0 HG11 VAL A 62 -21.465 -3.261 -22.141 1.00 1.00 H new ATOM 0 HG12 VAL A 62 -19.864 -3.936 -21.754 1.00 1.00 H new ATOM 0 HG13 VAL A 62 -20.610 -2.737 -20.671 1.00 1.00 H new ATOM 0 HG21 VAL A 62 -21.706 -0.964 -22.973 1.00 1.00 H new ATOM 0 HG22 VAL A 62 -20.886 -0.294 -21.543 1.00 1.00 H new ATOM 0 HG23 VAL A 62 -20.283 0.086 -23.174 1.00 1.00 H new ATOM 1019 N LEU A 63 -16.600 -2.254 -23.363 1.00 1.00 N ATOM 1020 CA LEU A 63 -15.642 -2.115 -24.454 1.00 1.00 C ATOM 1021 C LEU A 63 -16.244 -2.641 -25.765 1.00 1.00 C ATOM 1022 O LEU A 63 -16.818 -3.761 -25.794 1.00 1.00 O ATOM 1023 CB LEU A 63 -14.349 -2.845 -24.134 1.00 1.00 C ATOM 1024 CG LEU A 63 -13.217 -1.976 -23.587 1.00 1.00 C ATOM 1025 CD1 LEU A 63 -12.760 -2.475 -22.229 1.00 1.00 C ATOM 1026 CD2 LEU A 63 -12.055 -1.959 -24.566 1.00 1.00 C ATOM 0 H LEU A 63 -16.581 -3.164 -22.902 1.00 1.00 H new ATOM 0 HA LEU A 63 -15.414 -1.056 -24.575 1.00 1.00 H new ATOM 0 HB2 LEU A 63 -14.565 -3.628 -23.407 1.00 1.00 H new ATOM 0 HB3 LEU A 63 -13.998 -3.339 -25.040 1.00 1.00 H new ATOM 0 HG LEU A 63 -13.590 -0.959 -23.464 1.00 1.00 H new ATOM 0 HD11 LEU A 63 -11.954 -1.840 -21.861 1.00 1.00 H new ATOM 0 HD12 LEU A 63 -13.595 -2.443 -21.530 1.00 1.00 H new ATOM 0 HD13 LEU A 63 -12.402 -3.500 -22.320 1.00 1.00 H new ATOM 0 HD21 LEU A 63 -11.253 -1.337 -24.168 1.00 1.00 H new ATOM 0 HD22 LEU A 63 -11.688 -2.975 -24.713 1.00 1.00 H new ATOM 0 HD23 LEU A 63 -12.389 -1.553 -25.521 1.00 1.00 H new ATOM 1038 N LEU A 64 -16.201 -1.778 -26.811 1.00 1.00 N ATOM 1039 CA LEU A 64 -16.734 -2.129 -28.138 1.00 1.00 C ATOM 1040 C LEU A 64 -15.608 -2.505 -29.099 1.00 1.00 C ATOM 1041 O LEU A 64 -14.593 -1.768 -29.215 1.00 1.00 O ATOM 1042 CB LEU A 64 -17.560 -0.998 -28.725 1.00 1.00 C ATOM 1043 CG LEU A 64 -19.026 -0.964 -28.295 1.00 1.00 C ATOM 1044 CD1 LEU A 64 -19.339 0.340 -27.583 1.00 1.00 C ATOM 1045 CD2 LEU A 64 -19.932 -1.151 -29.503 1.00 1.00 C ATOM 0 H LEU A 64 -15.803 -0.840 -26.755 1.00 1.00 H new ATOM 0 HA LEU A 64 -17.385 -2.993 -28.004 1.00 1.00 H new ATOM 0 HB2 LEU A 64 -17.096 -0.051 -28.449 1.00 1.00 H new ATOM 0 HB3 LEU A 64 -17.520 -1.068 -29.812 1.00 1.00 H new ATOM 0 HG LEU A 64 -19.207 -1.783 -27.599 1.00 1.00 H new ATOM 0 HD11 LEU A 64 -20.387 0.348 -27.283 1.00 1.00 H new ATOM 0 HD12 LEU A 64 -18.708 0.432 -26.699 1.00 1.00 H new ATOM 0 HD13 LEU A 64 -19.147 1.177 -28.255 1.00 1.00 H new ATOM 0 HD21 LEU A 64 -20.974 -1.125 -29.184 1.00 1.00 H new ATOM 0 HD22 LEU A 64 -19.752 -0.350 -30.220 1.00 1.00 H new ATOM 0 HD23 LEU A 64 -19.720 -2.112 -29.972 1.00 1.00 H new ATOM 1057 N ILE A 65 -15.775 -3.676 -29.736 1.00 1.00 N ATOM 1058 CA ILE A 65 -14.772 -4.212 -30.663 1.00 1.00 C ATOM 1059 C ILE A 65 -15.331 -4.178 -32.087 1.00 1.00 C ATOM 1060 O ILE A 65 -16.441 -4.707 -32.337 1.00 1.00 O ATOM 1061 CB ILE A 65 -14.303 -5.670 -30.266 1.00 1.00 C ATOM 1062 CG1 ILE A 65 -14.209 -5.823 -28.732 1.00 1.00 C ATOM 1063 CG2 ILE A 65 -12.944 -5.997 -30.900 1.00 1.00 C ATOM 1064 CD1 ILE A 65 -15.190 -6.819 -28.160 1.00 1.00 C ATOM 0 H ILE A 65 -16.598 -4.268 -29.624 1.00 1.00 H new ATOM 0 HA ILE A 65 -13.884 -3.582 -30.607 1.00 1.00 H new ATOM 0 HB ILE A 65 -15.049 -6.369 -30.644 1.00 1.00 H new ATOM 0 HG12 ILE A 65 -13.197 -6.130 -28.468 1.00 1.00 H new ATOM 0 HG13 ILE A 65 -14.379 -4.852 -28.268 1.00 1.00 H new ATOM 0 HG21 ILE A 65 -12.642 -7.004 -30.613 1.00 1.00 H new ATOM 0 HG22 ILE A 65 -13.025 -5.938 -31.985 1.00 1.00 H new ATOM 0 HG23 ILE A 65 -12.199 -5.282 -30.552 1.00 1.00 H new ATOM 0 HD11 ILE A 65 -15.065 -6.873 -27.079 1.00 1.00 H new ATOM 0 HD12 ILE A 65 -16.207 -6.503 -28.393 1.00 1.00 H new ATOM 0 HD13 ILE A 65 -15.007 -7.801 -28.596 1.00 1.00 H new ATOM 1076 N LYS A 66 -14.525 -3.563 -33.002 1.00 1.00 N ATOM 1077 CA LYS A 66 -14.873 -3.481 -34.402 1.00 1.00 C ATOM 1078 C LYS A 66 -14.479 -4.775 -35.134 1.00 1.00 C ATOM 1079 O LYS A 66 -13.389 -5.337 -34.881 1.00 1.00 O ATOM 1080 CB LYS A 66 -14.255 -2.298 -35.083 1.00 1.00 C ATOM 1081 CG LYS A 66 -15.270 -1.253 -35.452 1.00 1.00 C ATOM 1082 CD LYS A 66 -15.120 -0.850 -36.898 1.00 1.00 C ATOM 1083 CE LYS A 66 -16.078 0.264 -37.256 1.00 1.00 C ATOM 1084 NZ LYS A 66 -15.359 1.522 -37.588 1.00 1.00 N ATOM 0 H LYS A 66 -13.634 -3.125 -32.767 1.00 1.00 H new ATOM 0 HA LYS A 66 -15.954 -3.352 -34.448 1.00 1.00 H new ATOM 0 HB2 LYS A 66 -13.505 -1.856 -34.427 1.00 1.00 H new ATOM 0 HB3 LYS A 66 -13.736 -2.630 -35.982 1.00 1.00 H new ATOM 0 HG2 LYS A 66 -16.275 -1.638 -35.279 1.00 1.00 H new ATOM 0 HG3 LYS A 66 -15.149 -0.379 -34.812 1.00 1.00 H new ATOM 0 HD2 LYS A 66 -14.096 -0.527 -37.084 1.00 1.00 H new ATOM 0 HD3 LYS A 66 -15.304 -1.712 -37.540 1.00 1.00 H new ATOM 0 HE2 LYS A 66 -16.689 -0.041 -38.105 1.00 1.00 H new ATOM 0 HE3 LYS A 66 -16.757 0.442 -36.422 1.00 1.00 H new ATOM 0 HZ1 LYS A 66 -16.048 2.263 -37.828 1.00 1.00 H new ATOM 0 HZ2 LYS A 66 -14.795 1.826 -36.769 1.00 1.00 H new ATOM 0 HZ3 LYS A 66 -14.730 1.358 -38.400 1.00 1.00 H new ATOM 1098 N PRO A 67 -15.400 -5.335 -36.033 1.00 1.00 N ATOM 1099 CA PRO A 67 -15.150 -6.613 -36.720 1.00 1.00 C ATOM 1100 C PRO A 67 -14.020 -6.608 -37.773 1.00 1.00 C ATOM 1101 O PRO A 67 -13.940 -5.763 -38.712 1.00 1.00 O ATOM 1102 CB PRO A 67 -16.481 -6.927 -37.364 1.00 1.00 C ATOM 1103 CG PRO A 67 -17.472 -6.100 -36.625 1.00 1.00 C ATOM 1104 CD PRO A 67 -16.752 -4.831 -36.409 1.00 1.00 C ATOM 0 HA PRO A 67 -14.794 -7.354 -36.004 1.00 1.00 H new ATOM 0 HB2 PRO A 67 -16.474 -6.679 -38.425 1.00 1.00 H new ATOM 0 HB3 PRO A 67 -16.716 -7.988 -37.286 1.00 1.00 H new ATOM 0 HG2 PRO A 67 -18.385 -5.953 -37.202 1.00 1.00 H new ATOM 0 HG3 PRO A 67 -17.762 -6.565 -35.683 1.00 1.00 H new ATOM 0 HD2 PRO A 67 -16.727 -4.212 -37.306 1.00 1.00 H new ATOM 0 HD3 PRO A 67 -17.203 -4.230 -35.620 1.00 1.00 H new ATOM 1112 N ALA A 68 -13.095 -7.572 -37.505 1.00 1.00 N ATOM 1113 CA ALA A 68 -11.948 -7.842 -38.378 1.00 1.00 C ATOM 1114 C ALA A 68 -12.423 -8.473 -39.684 1.00 1.00 C ATOM 1115 O ALA A 68 -13.377 -9.272 -39.701 1.00 1.00 O ATOM 1116 CB ALA A 68 -10.949 -8.728 -37.713 1.00 1.00 C ATOM 0 H ALA A 68 -13.135 -8.172 -36.681 1.00 1.00 H new ATOM 0 HA ALA A 68 -11.459 -6.892 -38.592 1.00 1.00 H new ATOM 0 HB1 ALA A 68 -10.113 -8.906 -38.390 1.00 1.00 H new ATOM 0 HB2 ALA A 68 -10.585 -8.248 -36.805 1.00 1.00 H new ATOM 0 HB3 ALA A 68 -11.418 -9.678 -37.458 1.00 1.00 H new ATOM 1122 N GLN A 69 -11.783 -8.060 -40.774 1.00 1.00 N ATOM 1123 CA GLN A 69 -12.199 -8.457 -42.120 1.00 1.00 C ATOM 1124 C GLN A 69 -10.985 -8.759 -43.014 1.00 1.00 C ATOM 1125 O GLN A 69 -9.872 -8.262 -42.745 1.00 1.00 O ATOM 1126 CB GLN A 69 -13.134 -7.315 -42.712 1.00 1.00 C ATOM 1127 CG GLN A 69 -12.429 -5.965 -42.926 1.00 1.00 C ATOM 1128 CD GLN A 69 -13.344 -4.832 -43.289 1.00 1.00 C ATOM 1129 OE1 GLN A 69 -13.964 -4.236 -42.408 1.00 1.00 O ATOM 1130 NE2 GLN A 69 -13.474 -4.565 -44.566 1.00 1.00 N ATOM 0 H GLN A 69 -10.969 -7.446 -40.753 1.00 1.00 H new ATOM 0 HA GLN A 69 -12.768 -9.386 -42.080 1.00 1.00 H new ATOM 0 HB2 GLN A 69 -13.542 -7.653 -43.665 1.00 1.00 H new ATOM 0 HB3 GLN A 69 -13.978 -7.168 -42.038 1.00 1.00 H new ATOM 0 HG2 GLN A 69 -11.891 -5.703 -42.015 1.00 1.00 H new ATOM 0 HG3 GLN A 69 -11.684 -6.080 -43.714 1.00 1.00 H new ATOM 0 HE21 GLN A 69 -12.935 -5.091 -45.254 1.00 1.00 H new ATOM 0 HE22 GLN A 69 -14.114 -3.832 -44.871 1.00 1.00 H new ATOM 1139 N CYS A 70 -11.247 -9.549 -44.072 1.00 1.00 N ATOM 1140 CA CYS A 70 -10.263 -9.803 -45.133 1.00 1.00 C ATOM 1141 C CYS A 70 -10.416 -8.729 -46.219 1.00 1.00 C ATOM 1142 O CYS A 70 -11.545 -8.504 -46.743 1.00 1.00 O ATOM 1143 CB CYS A 70 -10.415 -11.190 -45.728 1.00 1.00 C ATOM 1144 SG CYS A 70 -10.029 -12.529 -44.585 1.00 1.00 S ATOM 0 H CYS A 70 -12.139 -10.024 -44.212 1.00 1.00 H new ATOM 0 HA CYS A 70 -9.264 -9.755 -44.699 1.00 1.00 H new ATOM 0 HB2 CYS A 70 -11.439 -11.312 -46.081 1.00 1.00 H new ATOM 0 HB3 CYS A 70 -9.766 -11.273 -46.600 1.00 1.00 H new ATOM 0 HG CYS A 70 -10.191 -13.671 -45.184 1.00 1.00 H new ATOM 1150 N ARG A 71 -9.295 -8.052 -46.519 1.00 1.00 N ATOM 1151 CA ARG A 71 -9.292 -6.899 -47.456 1.00 1.00 C ATOM 1152 C ARG A 71 -9.020 -7.288 -48.925 1.00 1.00 C ATOM 1153 O ARG A 71 -9.165 -6.437 -49.842 1.00 1.00 O ATOM 1154 CB ARG A 71 -8.287 -5.867 -47.002 1.00 1.00 C ATOM 1155 CG ARG A 71 -8.883 -4.807 -46.110 1.00 1.00 C ATOM 1156 CD ARG A 71 -8.459 -3.457 -46.563 1.00 1.00 C ATOM 1157 NE ARG A 71 -7.423 -2.878 -45.705 1.00 1.00 N ATOM 1158 CZ ARG A 71 -6.926 -1.671 -45.931 1.00 1.00 C ATOM 1159 NH1 ARG A 71 -6.895 -1.192 -47.157 1.00 1.00 N ATOM 1160 NH2 ARG A 71 -6.412 -0.977 -44.956 1.00 1.00 N ATOM 0 H ARG A 71 -8.379 -8.277 -46.132 1.00 1.00 H new ATOM 0 HA ARG A 71 -10.300 -6.485 -47.432 1.00 1.00 H new ATOM 0 HB2 ARG A 71 -7.478 -6.367 -46.470 1.00 1.00 H new ATOM 0 HB3 ARG A 71 -7.846 -5.390 -47.877 1.00 1.00 H new ATOM 0 HG2 ARG A 71 -9.971 -4.879 -46.125 1.00 1.00 H new ATOM 0 HG3 ARG A 71 -8.567 -4.969 -45.079 1.00 1.00 H new ATOM 0 HD2 ARG A 71 -8.086 -3.521 -47.585 1.00 1.00 H new ATOM 0 HD3 ARG A 71 -9.324 -2.794 -46.580 1.00 1.00 H new ATOM 0 HE ARG A 71 -7.075 -3.418 -44.913 1.00 1.00 H new ATOM 0 HH11 ARG A 71 -7.253 -1.750 -47.932 1.00 1.00 H new ATOM 0 HH12 ARG A 71 -6.513 -0.263 -47.332 1.00 1.00 H new ATOM 0 HH21 ARG A 71 -6.390 -1.362 -44.012 1.00 1.00 H new ATOM 0 HH22 ARG A 71 -6.031 -0.048 -45.137 1.00 1.00 H new ATOM 1174 N LYS A 72 -8.732 -8.600 -49.147 1.00 1.00 N ATOM 1175 CA LYS A 72 -8.421 -9.140 -50.469 1.00 1.00 C ATOM 1176 C LYS A 72 -9.640 -9.753 -51.180 1.00 1.00 C ATOM 1177 O LYS A 72 -9.950 -9.346 -52.316 1.00 1.00 O ATOM 1178 CB LYS A 72 -7.323 -10.179 -50.370 1.00 1.00 C ATOM 1179 CG LYS A 72 -5.993 -9.702 -50.883 1.00 1.00 C ATOM 1180 CD LYS A 72 -4.952 -10.795 -50.782 1.00 1.00 C ATOM 1181 CE LYS A 72 -3.649 -10.371 -51.431 1.00 1.00 C ATOM 1182 NZ LYS A 72 -2.790 -11.540 -51.760 1.00 1.00 N ATOM 0 H LYS A 72 -8.713 -9.299 -48.405 1.00 1.00 H new ATOM 0 HA LYS A 72 -8.089 -8.294 -51.070 1.00 1.00 H new ATOM 0 HB2 LYS A 72 -7.214 -10.481 -49.329 1.00 1.00 H new ATOM 0 HB3 LYS A 72 -7.622 -11.065 -50.930 1.00 1.00 H new ATOM 0 HG2 LYS A 72 -6.092 -9.383 -51.921 1.00 1.00 H new ATOM 0 HG3 LYS A 72 -5.669 -8.832 -50.312 1.00 1.00 H new ATOM 0 HD2 LYS A 72 -4.777 -11.039 -49.734 1.00 1.00 H new ATOM 0 HD3 LYS A 72 -5.323 -11.700 -51.262 1.00 1.00 H new ATOM 0 HE2 LYS A 72 -3.862 -9.809 -52.340 1.00 1.00 H new ATOM 0 HE3 LYS A 72 -3.110 -9.701 -50.761 1.00 1.00 H new ATOM 0 HZ1 LYS A 72 -1.909 -11.210 -52.202 1.00 1.00 H new ATOM 0 HZ2 LYS A 72 -2.566 -12.062 -50.889 1.00 1.00 H new ATOM 0 HZ3 LYS A 72 -3.294 -12.167 -52.419 1.00 1.00 H new ATOM 1196 N CYS A 73 -10.364 -10.621 -50.433 1.00 1.00 N ATOM 1197 CA CYS A 73 -11.535 -11.321 -50.978 1.00 1.00 C ATOM 1198 C CYS A 73 -12.859 -10.609 -50.655 1.00 1.00 C ATOM 1199 O CYS A 73 -13.868 -10.833 -51.367 1.00 1.00 O ATOM 1200 CB CYS A 73 -11.571 -12.754 -50.454 1.00 1.00 C ATOM 1201 SG CYS A 73 -11.370 -12.922 -48.653 1.00 1.00 S ATOM 0 H CYS A 73 -10.154 -10.847 -49.461 1.00 1.00 H new ATOM 0 HA CYS A 73 -11.432 -11.322 -52.063 1.00 1.00 H new ATOM 0 HB2 CYS A 73 -12.520 -13.206 -50.742 1.00 1.00 H new ATOM 0 HB3 CYS A 73 -10.784 -13.325 -50.947 1.00 1.00 H new ATOM 0 HG CYS A 73 -11.420 -14.179 -48.326 1.00 1.00 H new ATOM 1207 N GLY A 74 -12.822 -9.741 -49.590 1.00 1.00 N ATOM 1208 CA GLY A 74 -14.008 -9.043 -49.139 1.00 1.00 C ATOM 1209 C GLY A 74 -14.694 -9.709 -47.983 1.00 1.00 C ATOM 1210 O GLY A 74 -15.516 -9.056 -47.322 1.00 1.00 O ATOM 0 H GLY A 74 -11.980 -9.531 -49.055 1.00 1.00 H new ATOM 0 HA2 GLY A 74 -13.735 -8.027 -48.852 1.00 1.00 H new ATOM 0 HA3 GLY A 74 -14.710 -8.962 -49.969 1.00 1.00 H new ATOM 1214 N PHE A 75 -14.362 -11.048 -47.773 1.00 1.00 N ATOM 1215 CA PHE A 75 -14.908 -11.862 -46.680 1.00 1.00 C ATOM 1216 C PHE A 75 -14.724 -11.177 -45.305 1.00 1.00 C ATOM 1217 O PHE A 75 -13.637 -10.668 -44.996 1.00 1.00 O ATOM 1218 CB PHE A 75 -14.248 -13.246 -46.644 1.00 1.00 C ATOM 1219 CG PHE A 75 -15.170 -14.368 -46.189 1.00 1.00 C ATOM 1220 CD1 PHE A 75 -16.047 -14.967 -47.077 1.00 1.00 C ATOM 1221 CD2 PHE A 75 -15.149 -14.790 -44.866 1.00 1.00 C ATOM 1222 CE1 PHE A 75 -16.881 -15.964 -46.665 1.00 1.00 C ATOM 1223 CE2 PHE A 75 -15.983 -15.791 -44.444 1.00 1.00 C ATOM 1224 CZ PHE A 75 -16.851 -16.382 -45.346 1.00 1.00 C ATOM 0 H PHE A 75 -13.711 -11.557 -48.371 1.00 1.00 H new ATOM 0 HA PHE A 75 -15.975 -11.972 -46.874 1.00 1.00 H new ATOM 0 HB2 PHE A 75 -13.872 -13.482 -47.639 1.00 1.00 H new ATOM 0 HB3 PHE A 75 -13.386 -13.207 -45.978 1.00 1.00 H new ATOM 0 HD1 PHE A 75 -16.071 -14.641 -48.106 1.00 1.00 H new ATOM 0 HD2 PHE A 75 -14.471 -14.326 -44.165 1.00 1.00 H new ATOM 0 HE1 PHE A 75 -17.562 -16.425 -47.365 1.00 1.00 H new ATOM 0 HE2 PHE A 75 -15.964 -16.117 -43.415 1.00 1.00 H new ATOM 0 HZ PHE A 75 -17.509 -17.174 -45.019 1.00 1.00 H new ATOM 1234 N VAL A 76 -15.827 -11.149 -44.563 1.00 1.00 N ATOM 1235 CA VAL A 76 -15.877 -10.458 -43.277 1.00 1.00 C ATOM 1236 C VAL A 76 -15.904 -11.463 -42.146 1.00 1.00 C ATOM 1237 O VAL A 76 -16.704 -12.431 -42.179 1.00 1.00 O ATOM 1238 CB VAL A 76 -17.098 -9.492 -43.150 1.00 1.00 C ATOM 1239 CG1 VAL A 76 -16.680 -8.164 -42.515 1.00 1.00 C ATOM 1240 CG2 VAL A 76 -17.768 -9.248 -44.499 1.00 1.00 C ATOM 0 H VAL A 76 -16.702 -11.599 -44.831 1.00 1.00 H new ATOM 0 HA VAL A 76 -14.976 -9.847 -43.216 1.00 1.00 H new ATOM 0 HB VAL A 76 -17.826 -9.976 -42.499 1.00 1.00 H new ATOM 0 HG11 VAL A 76 -17.548 -7.509 -42.438 1.00 1.00 H new ATOM 0 HG12 VAL A 76 -16.274 -8.348 -41.520 1.00 1.00 H new ATOM 0 HG13 VAL A 76 -15.920 -7.688 -43.134 1.00 1.00 H new ATOM 0 HG21 VAL A 76 -18.613 -8.571 -44.369 1.00 1.00 H new ATOM 0 HG22 VAL A 76 -17.049 -8.803 -45.187 1.00 1.00 H new ATOM 0 HG23 VAL A 76 -18.122 -10.195 -44.906 1.00 1.00 H new ATOM 1250 N PHE A 77 -14.968 -11.260 -41.216 1.00 1.00 N ATOM 1251 CA PHE A 77 -14.885 -12.121 -40.031 1.00 1.00 C ATOM 1252 C PHE A 77 -15.602 -11.502 -38.854 1.00 1.00 C ATOM 1253 O PHE A 77 -15.674 -10.256 -38.742 1.00 1.00 O ATOM 1254 CB PHE A 77 -13.413 -12.416 -39.682 1.00 1.00 C ATOM 1255 CG PHE A 77 -12.875 -13.696 -40.271 1.00 1.00 C ATOM 1256 CD1 PHE A 77 -12.329 -13.710 -41.549 1.00 1.00 C ATOM 1257 CD2 PHE A 77 -12.924 -14.883 -39.545 1.00 1.00 C ATOM 1258 CE1 PHE A 77 -11.854 -14.874 -42.085 1.00 1.00 C ATOM 1259 CE2 PHE A 77 -12.448 -16.047 -40.079 1.00 1.00 C ATOM 1260 CZ PHE A 77 -11.913 -16.047 -41.351 1.00 1.00 C ATOM 0 H PHE A 77 -14.267 -10.520 -41.257 1.00 1.00 H new ATOM 0 HA PHE A 77 -15.381 -13.064 -40.263 1.00 1.00 H new ATOM 0 HB2 PHE A 77 -12.797 -11.585 -40.027 1.00 1.00 H new ATOM 0 HB3 PHE A 77 -13.311 -12.459 -38.598 1.00 1.00 H new ATOM 0 HD1 PHE A 77 -12.280 -12.796 -42.122 1.00 1.00 H new ATOM 0 HD2 PHE A 77 -13.343 -14.884 -38.549 1.00 1.00 H new ATOM 0 HE1 PHE A 77 -11.433 -14.879 -43.080 1.00 1.00 H new ATOM 0 HE2 PHE A 77 -12.490 -16.963 -39.508 1.00 1.00 H new ATOM 0 HZ PHE A 77 -11.538 -16.966 -41.776 1.00 1.00 H new ATOM 1270 N LYS A 78 -16.143 -12.385 -37.972 1.00 1.00 N ATOM 1271 CA LYS A 78 -16.827 -11.943 -36.736 1.00 1.00 C ATOM 1272 C LYS A 78 -15.825 -11.283 -35.770 1.00 1.00 C ATOM 1273 O LYS A 78 -14.621 -11.655 -35.787 1.00 1.00 O ATOM 1274 CB LYS A 78 -17.524 -13.110 -36.058 1.00 1.00 C ATOM 1275 CG LYS A 78 -18.983 -13.249 -36.450 1.00 1.00 C ATOM 1276 CD LYS A 78 -19.776 -13.925 -35.351 1.00 1.00 C ATOM 1277 CE LYS A 78 -21.206 -13.413 -35.301 1.00 1.00 C ATOM 1278 NZ LYS A 78 -21.983 -14.046 -34.199 1.00 1.00 N ATOM 0 H LYS A 78 -16.117 -13.397 -38.096 1.00 1.00 H new ATOM 0 HA LYS A 78 -17.582 -11.206 -37.011 1.00 1.00 H new ATOM 0 HB2 LYS A 78 -16.999 -14.032 -36.307 1.00 1.00 H new ATOM 0 HB3 LYS A 78 -17.456 -12.986 -34.977 1.00 1.00 H new ATOM 0 HG2 LYS A 78 -19.404 -12.265 -36.655 1.00 1.00 H new ATOM 0 HG3 LYS A 78 -19.063 -13.828 -37.370 1.00 1.00 H new ATOM 0 HD2 LYS A 78 -19.780 -15.003 -35.514 1.00 1.00 H new ATOM 0 HD3 LYS A 78 -19.292 -13.749 -34.390 1.00 1.00 H new ATOM 0 HE2 LYS A 78 -21.200 -12.331 -35.167 1.00 1.00 H new ATOM 0 HE3 LYS A 78 -21.697 -13.613 -36.253 1.00 1.00 H new ATOM 0 HZ1 LYS A 78 -22.953 -13.671 -34.198 1.00 1.00 H new ATOM 0 HZ2 LYS A 78 -22.010 -15.076 -34.341 1.00 1.00 H new ATOM 0 HZ3 LYS A 78 -21.529 -13.834 -33.288 1.00 1.00 H new ATOM 1292 N ALA A 79 -16.316 -10.282 -34.976 1.00 1.00 N ATOM 1293 CA ALA A 79 -15.472 -9.504 -34.041 1.00 1.00 C ATOM 1294 C ALA A 79 -14.897 -10.413 -32.925 1.00 1.00 C ATOM 1295 O ALA A 79 -15.651 -10.986 -32.094 1.00 1.00 O ATOM 1296 CB ALA A 79 -16.247 -8.367 -33.455 1.00 1.00 C ATOM 0 H ALA A 79 -17.297 -10.002 -34.973 1.00 1.00 H new ATOM 0 HA ALA A 79 -14.633 -9.093 -34.603 1.00 1.00 H new ATOM 0 HB1 ALA A 79 -15.610 -7.807 -32.770 1.00 1.00 H new ATOM 0 HB2 ALA A 79 -16.588 -7.709 -34.254 1.00 1.00 H new ATOM 0 HB3 ALA A 79 -17.109 -8.755 -32.913 1.00 1.00 H new ATOM 1302 N GLU A 80 -13.561 -10.613 -33.017 1.00 1.00 N ATOM 1303 CA GLU A 80 -12.837 -11.531 -32.144 1.00 1.00 C ATOM 1304 C GLU A 80 -11.713 -10.772 -31.391 1.00 1.00 C ATOM 1305 O GLU A 80 -11.589 -9.543 -31.496 1.00 1.00 O ATOM 1306 CB GLU A 80 -12.283 -12.702 -32.955 1.00 1.00 C ATOM 1307 CG GLU A 80 -12.974 -14.026 -32.683 1.00 1.00 C ATOM 1308 CD GLU A 80 -12.048 -15.206 -32.893 1.00 1.00 C ATOM 1309 OE1 GLU A 80 -11.979 -15.711 -34.033 1.00 1.00 O ATOM 1310 OE2 GLU A 80 -11.388 -15.624 -31.917 1.00 1.00 O ATOM 0 H GLU A 80 -12.969 -10.139 -33.699 1.00 1.00 H new ATOM 0 HA GLU A 80 -13.521 -11.939 -31.399 1.00 1.00 H new ATOM 0 HB2 GLU A 80 -12.372 -12.469 -34.016 1.00 1.00 H new ATOM 0 HB3 GLU A 80 -11.220 -12.808 -32.740 1.00 1.00 H new ATOM 0 HG2 GLU A 80 -13.347 -14.036 -31.659 1.00 1.00 H new ATOM 0 HG3 GLU A 80 -13.840 -14.124 -33.338 1.00 1.00 H new ATOM 1317 N ILE A 81 -11.030 -11.532 -30.525 1.00 1.00 N ATOM 1318 CA ILE A 81 -9.942 -11.013 -29.697 1.00 1.00 C ATOM 1319 C ILE A 81 -8.577 -11.507 -30.253 1.00 1.00 C ATOM 1320 O ILE A 81 -7.889 -10.731 -30.947 1.00 1.00 O ATOM 1321 CB ILE A 81 -10.130 -11.390 -28.195 1.00 1.00 C ATOM 1322 CG1 ILE A 81 -10.995 -12.670 -28.049 1.00 1.00 C ATOM 1323 CG2 ILE A 81 -10.737 -10.224 -27.458 1.00 1.00 C ATOM 1324 CD1 ILE A 81 -10.288 -13.807 -27.371 1.00 1.00 C ATOM 0 H ILE A 81 -11.219 -12.524 -30.381 1.00 1.00 H new ATOM 0 HA ILE A 81 -9.958 -9.924 -29.743 1.00 1.00 H new ATOM 0 HB ILE A 81 -9.157 -11.611 -27.755 1.00 1.00 H new ATOM 0 HG12 ILE A 81 -11.895 -12.426 -27.484 1.00 1.00 H new ATOM 0 HG13 ILE A 81 -11.317 -12.994 -29.039 1.00 1.00 H new ATOM 0 HG21 ILE A 81 -10.869 -10.486 -26.408 1.00 1.00 H new ATOM 0 HG22 ILE A 81 -10.076 -9.360 -27.536 1.00 1.00 H new ATOM 0 HG23 ILE A 81 -11.705 -9.981 -27.896 1.00 1.00 H new ATOM 0 HD11 ILE A 81 -10.957 -14.665 -27.306 1.00 1.00 H new ATOM 0 HD12 ILE A 81 -9.403 -14.080 -27.946 1.00 1.00 H new ATOM 0 HD13 ILE A 81 -9.990 -13.503 -26.368 1.00 1.00 H new ATOM 1336 N ASN A 82 -8.189 -12.771 -29.879 1.00 1.00 N ATOM 1337 CA ASN A 82 -7.002 -13.444 -30.458 1.00 1.00 C ATOM 1338 C ASN A 82 -7.246 -13.685 -31.964 1.00 1.00 C ATOM 1339 O ASN A 82 -8.426 -13.903 -32.381 1.00 1.00 O ATOM 1340 CB ASN A 82 -6.722 -14.762 -29.733 1.00 1.00 C ATOM 1341 CG ASN A 82 -5.823 -14.593 -28.534 1.00 1.00 C ATOM 1342 OD1 ASN A 82 -4.602 -14.507 -28.662 1.00 1.00 O ATOM 1343 ND2 ASN A 82 -6.434 -14.498 -27.366 1.00 1.00 N ATOM 0 H ASN A 82 -8.685 -13.330 -29.184 1.00 1.00 H new ATOM 0 HA ASN A 82 -6.126 -12.808 -30.333 1.00 1.00 H new ATOM 0 HB2 ASN A 82 -7.666 -15.203 -29.413 1.00 1.00 H new ATOM 0 HB3 ASN A 82 -6.262 -15.463 -30.429 1.00 1.00 H new ATOM 0 HD21 ASN A 82 -5.890 -14.346 -26.517 1.00 1.00 H new ATOM 0 HD22 ASN A 82 -7.450 -14.576 -27.314 1.00 1.00 H new ATOM 1350 N ILE A 83 -6.171 -13.620 -32.749 1.00 1.00 N ATOM 1351 CA ILE A 83 -6.253 -13.682 -34.196 1.00 1.00 C ATOM 1352 C ILE A 83 -5.617 -14.991 -34.719 1.00 1.00 C ATOM 1353 O ILE A 83 -4.522 -15.360 -34.266 1.00 1.00 O ATOM 1354 CB ILE A 83 -5.559 -12.454 -34.881 1.00 1.00 C ATOM 1355 CG1 ILE A 83 -6.084 -11.151 -34.267 1.00 1.00 C ATOM 1356 CG2 ILE A 83 -5.749 -12.441 -36.416 1.00 1.00 C ATOM 1357 CD1 ILE A 83 -4.985 -10.263 -33.746 1.00 1.00 C ATOM 0 H ILE A 83 -5.220 -13.523 -32.393 1.00 1.00 H new ATOM 0 HA ILE A 83 -7.312 -13.658 -34.455 1.00 1.00 H new ATOM 0 HB ILE A 83 -4.488 -12.543 -34.698 1.00 1.00 H new ATOM 0 HG12 ILE A 83 -6.658 -10.607 -35.017 1.00 1.00 H new ATOM 0 HG13 ILE A 83 -6.768 -11.389 -33.453 1.00 1.00 H new ATOM 0 HG21 ILE A 83 -5.248 -11.569 -36.837 1.00 1.00 H new ATOM 0 HG22 ILE A 83 -5.321 -13.348 -36.843 1.00 1.00 H new ATOM 0 HG23 ILE A 83 -6.813 -12.397 -36.651 1.00 1.00 H new ATOM 0 HD11 ILE A 83 -5.419 -9.357 -33.324 1.00 1.00 H new ATOM 0 HD12 ILE A 83 -4.426 -10.791 -32.974 1.00 1.00 H new ATOM 0 HD13 ILE A 83 -4.314 -9.997 -34.563 1.00 1.00 H new ATOM 1369 N PRO A 84 -6.297 -15.683 -35.743 1.00 1.00 N ATOM 1370 CA PRO A 84 -5.697 -16.834 -36.432 1.00 1.00 C ATOM 1371 C PRO A 84 -4.560 -16.462 -37.425 1.00 1.00 C ATOM 1372 O PRO A 84 -4.531 -15.330 -37.983 1.00 1.00 O ATOM 1373 CB PRO A 84 -6.888 -17.450 -37.160 1.00 1.00 C ATOM 1374 CG PRO A 84 -8.098 -16.898 -36.482 1.00 1.00 C ATOM 1375 CD PRO A 84 -7.722 -15.505 -36.195 1.00 1.00 C ATOM 0 HA PRO A 84 -5.201 -17.505 -35.731 1.00 1.00 H new ATOM 0 HB2 PRO A 84 -6.878 -17.190 -38.219 1.00 1.00 H new ATOM 0 HB3 PRO A 84 -6.866 -18.538 -37.099 1.00 1.00 H new ATOM 0 HG2 PRO A 84 -8.978 -16.953 -37.123 1.00 1.00 H new ATOM 0 HG3 PRO A 84 -8.333 -17.447 -35.570 1.00 1.00 H new ATOM 0 HD2 PRO A 84 -7.799 -14.867 -37.075 1.00 1.00 H new ATOM 0 HD3 PRO A 84 -8.348 -15.059 -35.422 1.00 1.00 H new ATOM 1383 N SER A 85 -3.642 -17.435 -37.608 1.00 1.00 N ATOM 1384 CA SER A 85 -2.485 -17.291 -38.515 1.00 1.00 C ATOM 1385 C SER A 85 -2.841 -17.628 -39.977 1.00 1.00 C ATOM 1386 O SER A 85 -2.125 -17.207 -40.913 1.00 1.00 O ATOM 1387 CB SER A 85 -1.330 -18.158 -38.040 1.00 1.00 C ATOM 1388 OG SER A 85 -0.804 -17.671 -36.820 1.00 1.00 O ATOM 0 H SER A 85 -3.682 -18.337 -37.134 1.00 1.00 H new ATOM 0 HA SER A 85 -2.184 -16.244 -38.489 1.00 1.00 H new ATOM 0 HB2 SER A 85 -1.670 -19.185 -37.910 1.00 1.00 H new ATOM 0 HB3 SER A 85 -0.547 -18.175 -38.798 1.00 1.00 H new ATOM 0 HG SER A 85 -0.063 -18.244 -36.531 1.00 1.00 H new ATOM 1394 N ARG A 86 -3.960 -18.390 -40.148 1.00 1.00 N ATOM 1395 CA ARG A 86 -4.462 -18.790 -41.452 1.00 1.00 C ATOM 1396 C ARG A 86 -5.973 -18.800 -41.465 1.00 1.00 C ATOM 1397 O ARG A 86 -6.614 -19.237 -40.471 1.00 1.00 O ATOM 1398 CB ARG A 86 -3.884 -20.170 -41.857 1.00 1.00 C ATOM 1399 CG ARG A 86 -2.581 -20.050 -42.630 1.00 1.00 C ATOM 1400 CD ARG A 86 -2.052 -21.401 -42.970 1.00 1.00 C ATOM 1401 NE ARG A 86 -0.845 -21.348 -43.800 1.00 1.00 N ATOM 1402 CZ ARG A 86 -0.141 -22.436 -44.124 1.00 1.00 C ATOM 1403 NH1 ARG A 86 -0.685 -23.635 -44.032 1.00 1.00 N ATOM 1404 NH2 ARG A 86 1.089 -22.335 -44.536 1.00 1.00 N ATOM 0 H ARG A 86 -4.524 -18.733 -39.370 1.00 1.00 H new ATOM 0 HA ARG A 86 -4.131 -18.059 -42.190 1.00 1.00 H new ATOM 0 HB2 ARG A 86 -3.718 -20.768 -40.961 1.00 1.00 H new ATOM 0 HB3 ARG A 86 -4.616 -20.703 -42.464 1.00 1.00 H new ATOM 0 HG2 ARG A 86 -2.744 -19.476 -43.542 1.00 1.00 H new ATOM 0 HG3 ARG A 86 -1.848 -19.504 -42.036 1.00 1.00 H new ATOM 0 HD2 ARG A 86 -1.831 -21.941 -42.050 1.00 1.00 H new ATOM 0 HD3 ARG A 86 -2.823 -21.966 -43.494 1.00 1.00 H new ATOM 0 HE ARG A 86 -0.529 -20.442 -44.145 1.00 1.00 H new ATOM 0 HH11 ARG A 86 -1.648 -23.735 -43.712 1.00 1.00 H new ATOM 0 HH12 ARG A 86 -0.142 -24.462 -44.281 1.00 1.00 H new ATOM 0 HH21 ARG A 86 1.527 -21.417 -44.615 1.00 1.00 H new ATOM 0 HH22 ARG A 86 1.616 -23.174 -44.780 1.00 1.00 H new ATOM 1418 N CYS A 87 -6.548 -18.406 -42.640 1.00 1.00 N ATOM 1419 CA CYS A 87 -7.993 -18.420 -42.857 1.00 1.00 C ATOM 1420 C CYS A 87 -8.479 -19.861 -43.131 1.00 1.00 C ATOM 1421 O CYS A 87 -7.735 -20.650 -43.762 1.00 1.00 O ATOM 1422 CB CYS A 87 -8.418 -17.510 -44.002 1.00 1.00 C ATOM 1423 SG CYS A 87 -10.190 -17.124 -44.061 1.00 1.00 S ATOM 0 H CYS A 87 -6.013 -18.076 -43.444 1.00 1.00 H new ATOM 0 HA CYS A 87 -8.455 -18.040 -41.946 1.00 1.00 H new ATOM 0 HB2 CYS A 87 -7.861 -16.576 -43.929 1.00 1.00 H new ATOM 0 HB3 CYS A 87 -8.133 -17.979 -44.944 1.00 1.00 H new ATOM 0 HG CYS A 87 -10.505 -16.373 -43.047 1.00 1.00 H new ATOM 1509 N GLU A 93 -3.663 -13.894 -46.292 1.00 1.00 N ATOM 1510 CA GLU A 93 -3.051 -13.368 -45.051 1.00 1.00 C ATOM 1511 C GLU A 93 -3.333 -11.861 -44.803 1.00 1.00 C ATOM 1512 O GLU A 93 -2.759 -11.238 -43.871 1.00 1.00 O ATOM 1513 CB GLU A 93 -1.561 -13.645 -45.082 1.00 1.00 C ATOM 1514 CG GLU A 93 -1.081 -14.581 -43.987 1.00 1.00 C ATOM 1515 CD GLU A 93 0.422 -14.776 -44.028 1.00 1.00 C ATOM 1516 OE1 GLU A 93 0.885 -15.685 -44.750 1.00 1.00 O ATOM 1517 OE2 GLU A 93 1.139 -14.008 -43.351 1.00 1.00 O ATOM 0 HA GLU A 93 -3.516 -13.886 -44.213 1.00 1.00 H new ATOM 0 HB2 GLU A 93 -1.302 -14.073 -46.050 1.00 1.00 H new ATOM 0 HB3 GLU A 93 -1.025 -12.700 -44.998 1.00 1.00 H new ATOM 0 HG2 GLU A 93 -1.369 -14.180 -43.015 1.00 1.00 H new ATOM 0 HG3 GLU A 93 -1.575 -15.547 -44.092 1.00 1.00 H new ATOM 1524 N TRP A 94 -4.299 -11.302 -45.604 1.00 1.00 N ATOM 1525 CA TRP A 94 -4.691 -9.902 -45.511 1.00 1.00 C ATOM 1526 C TRP A 94 -5.865 -9.690 -44.551 1.00 1.00 C ATOM 1527 O TRP A 94 -7.063 -9.769 -44.934 1.00 1.00 O ATOM 1528 CB TRP A 94 -5.047 -9.356 -46.890 1.00 1.00 C ATOM 1529 CG TRP A 94 -4.191 -8.195 -47.317 1.00 1.00 C ATOM 1530 CD1 TRP A 94 -4.481 -6.867 -47.161 1.00 1.00 C ATOM 1531 CD2 TRP A 94 -2.915 -8.256 -47.992 1.00 1.00 C ATOM 1532 NE1 TRP A 94 -3.468 -6.106 -47.682 1.00 1.00 N ATOM 1533 CE2 TRP A 94 -2.492 -6.935 -48.179 1.00 1.00 C ATOM 1534 CE3 TRP A 94 -2.074 -9.309 -48.399 1.00 1.00 C ATOM 1535 CZ2 TRP A 94 -1.301 -6.635 -48.824 1.00 1.00 C ATOM 1536 CZ3 TRP A 94 -0.903 -9.013 -49.034 1.00 1.00 C ATOM 1537 CH2 TRP A 94 -0.505 -7.685 -49.215 1.00 1.00 C ATOM 0 H TRP A 94 -4.807 -11.825 -46.317 1.00 1.00 H new ATOM 0 HA TRP A 94 -3.835 -9.358 -45.112 1.00 1.00 H new ATOM 0 HB2 TRP A 94 -4.952 -10.156 -47.624 1.00 1.00 H new ATOM 0 HB3 TRP A 94 -6.092 -9.046 -46.890 1.00 1.00 H new ATOM 0 HD1 TRP A 94 -5.375 -6.477 -46.697 1.00 1.00 H new ATOM 0 HE1 TRP A 94 -3.443 -5.086 -47.698 1.00 1.00 H new ATOM 0 HE3 TRP A 94 -2.351 -10.336 -48.211 1.00 1.00 H new ATOM 0 HZ2 TRP A 94 -1.010 -5.612 -49.012 1.00 1.00 H new ATOM 0 HZ3 TRP A 94 -0.277 -9.813 -49.401 1.00 1.00 H new ATOM 0 HH2 TRP A 94 0.451 -7.479 -49.673 1.00 1.00 H new ATOM 1548 N ILE A 95 -5.502 -9.497 -43.276 1.00 1.00 N ATOM 1549 CA ILE A 95 -6.498 -9.293 -42.222 1.00 1.00 C ATOM 1550 C ILE A 95 -6.350 -7.882 -41.648 1.00 1.00 C ATOM 1551 O ILE A 95 -5.217 -7.426 -41.400 1.00 1.00 O ATOM 1552 CB ILE A 95 -6.402 -10.374 -41.058 1.00 1.00 C ATOM 1553 CG1 ILE A 95 -6.178 -11.800 -41.600 1.00 1.00 C ATOM 1554 CG2 ILE A 95 -7.672 -10.378 -40.188 1.00 1.00 C ATOM 1555 CD1 ILE A 95 -4.790 -12.337 -41.351 1.00 1.00 C ATOM 0 H ILE A 95 -4.534 -9.478 -42.954 1.00 1.00 H new ATOM 0 HA ILE A 95 -7.481 -9.414 -42.676 1.00 1.00 H new ATOM 0 HB ILE A 95 -5.541 -10.085 -40.455 1.00 1.00 H new ATOM 0 HG12 ILE A 95 -6.904 -12.471 -41.141 1.00 1.00 H new ATOM 0 HG13 ILE A 95 -6.372 -11.805 -42.673 1.00 1.00 H new ATOM 0 HG21 ILE A 95 -7.573 -11.128 -39.403 1.00 1.00 H new ATOM 0 HG22 ILE A 95 -7.807 -9.395 -39.736 1.00 1.00 H new ATOM 0 HG23 ILE A 95 -8.537 -10.614 -40.808 1.00 1.00 H new ATOM 0 HD11 ILE A 95 -4.710 -13.344 -41.761 1.00 1.00 H new ATOM 0 HD12 ILE A 95 -4.058 -11.690 -41.833 1.00 1.00 H new ATOM 0 HD13 ILE A 95 -4.598 -12.366 -40.278 1.00 1.00 H new ATOM 1567 N GLU A 96 -7.524 -7.249 -41.410 1.00 1.00 N ATOM 1568 CA GLU A 96 -7.581 -5.943 -40.758 1.00 1.00 C ATOM 1569 C GLU A 96 -7.784 -6.139 -39.255 1.00 1.00 C ATOM 1570 O GLU A 96 -8.611 -6.984 -38.837 1.00 1.00 O ATOM 1571 CB GLU A 96 -8.661 -5.078 -41.371 1.00 1.00 C ATOM 1572 CG GLU A 96 -8.119 -3.841 -42.057 1.00 1.00 C ATOM 1573 CD GLU A 96 -8.696 -2.568 -41.478 1.00 1.00 C ATOM 1574 OE1 GLU A 96 -8.114 -2.034 -40.507 1.00 1.00 O ATOM 1575 OE2 GLU A 96 -9.734 -2.104 -41.992 1.00 1.00 O ATOM 0 H GLU A 96 -8.435 -7.631 -41.664 1.00 1.00 H new ATOM 0 HA GLU A 96 -6.639 -5.417 -40.911 1.00 1.00 H new ATOM 0 HB2 GLU A 96 -9.224 -5.669 -42.094 1.00 1.00 H new ATOM 0 HB3 GLU A 96 -9.361 -4.776 -40.592 1.00 1.00 H new ATOM 0 HG2 GLU A 96 -7.033 -3.822 -41.963 1.00 1.00 H new ATOM 0 HG3 GLU A 96 -8.346 -3.889 -43.122 1.00 1.00 H new ATOM 1582 N GLU A 97 -6.971 -5.408 -38.438 1.00 1.00 N ATOM 1583 CA GLU A 97 -6.998 -5.536 -36.984 1.00 1.00 C ATOM 1584 C GLU A 97 -8.171 -4.756 -36.356 1.00 1.00 C ATOM 1585 O GLU A 97 -8.557 -3.685 -36.875 1.00 1.00 O ATOM 1586 CB GLU A 97 -5.706 -5.078 -36.346 1.00 1.00 C ATOM 1587 CG GLU A 97 -4.791 -6.220 -35.963 1.00 1.00 C ATOM 1588 CD GLU A 97 -3.386 -5.738 -35.684 1.00 1.00 C ATOM 1589 OE1 GLU A 97 -3.095 -5.392 -34.517 1.00 1.00 O ATOM 1590 OE2 GLU A 97 -2.577 -5.692 -36.636 1.00 1.00 O ATOM 0 H GLU A 97 -6.294 -4.727 -38.782 1.00 1.00 H new ATOM 0 HA GLU A 97 -7.131 -6.600 -36.786 1.00 1.00 H new ATOM 0 HB2 GLU A 97 -5.182 -4.417 -37.037 1.00 1.00 H new ATOM 0 HB3 GLU A 97 -5.936 -4.492 -35.456 1.00 1.00 H new ATOM 0 HG2 GLU A 97 -5.186 -6.723 -35.080 1.00 1.00 H new ATOM 0 HG3 GLU A 97 -4.771 -6.956 -36.767 1.00 1.00 H new ATOM 1597 N PRO A 98 -8.835 -5.331 -35.252 1.00 1.00 N ATOM 1598 CA PRO A 98 -9.952 -4.653 -34.578 1.00 1.00 C ATOM 1599 C PRO A 98 -9.560 -3.411 -33.738 1.00 1.00 C ATOM 1600 O PRO A 98 -8.351 -3.170 -33.449 1.00 1.00 O ATOM 1601 CB PRO A 98 -10.523 -5.756 -33.696 1.00 1.00 C ATOM 1602 CG PRO A 98 -10.024 -7.024 -34.281 1.00 1.00 C ATOM 1603 CD PRO A 98 -8.640 -6.690 -34.657 1.00 1.00 C ATOM 0 HA PRO A 98 -10.650 -4.233 -35.303 1.00 1.00 H new ATOM 0 HB2 PRO A 98 -10.194 -5.643 -32.663 1.00 1.00 H new ATOM 0 HB3 PRO A 98 -11.613 -5.729 -33.688 1.00 1.00 H new ATOM 0 HG2 PRO A 98 -10.061 -7.843 -33.562 1.00 1.00 H new ATOM 0 HG3 PRO A 98 -10.614 -7.331 -35.144 1.00 1.00 H new ATOM 0 HD2 PRO A 98 -7.970 -6.673 -33.797 1.00 1.00 H new ATOM 0 HD3 PRO A 98 -8.223 -7.399 -35.372 1.00 1.00 H new ATOM 1611 N ARG A 99 -10.607 -2.601 -33.425 1.00 1.00 N ATOM 1612 CA ARG A 99 -10.453 -1.388 -32.652 1.00 1.00 C ATOM 1613 C ARG A 99 -11.090 -1.562 -31.281 1.00 1.00 C ATOM 1614 O ARG A 99 -12.216 -2.112 -31.159 1.00 1.00 O ATOM 1615 CB ARG A 99 -11.032 -0.193 -33.375 1.00 1.00 C ATOM 1616 CG ARG A 99 -10.009 0.501 -34.254 1.00 1.00 C ATOM 1617 CD ARG A 99 -10.669 1.228 -35.377 1.00 1.00 C ATOM 1618 NE ARG A 99 -10.737 2.665 -35.141 1.00 1.00 N ATOM 1619 CZ ARG A 99 -11.411 3.511 -35.926 1.00 1.00 C ATOM 1620 NH1 ARG A 99 -12.241 3.056 -36.841 1.00 1.00 N ATOM 1621 NH2 ARG A 99 -11.241 4.794 -35.793 1.00 1.00 N ATOM 0 H ARG A 99 -11.568 -2.790 -33.711 1.00 1.00 H new ATOM 0 HA ARG A 99 -9.388 -1.197 -32.521 1.00 1.00 H new ATOM 0 HB2 ARG A 99 -11.874 -0.515 -33.987 1.00 1.00 H new ATOM 0 HB3 ARG A 99 -11.421 0.517 -32.645 1.00 1.00 H new ATOM 0 HG2 ARG A 99 -9.427 1.202 -33.656 1.00 1.00 H new ATOM 0 HG3 ARG A 99 -9.310 -0.234 -34.654 1.00 1.00 H new ATOM 0 HD2 ARG A 99 -10.122 1.039 -36.301 1.00 1.00 H new ATOM 0 HD3 ARG A 99 -11.677 0.837 -35.518 1.00 1.00 H new ATOM 0 HE ARG A 99 -10.244 3.045 -34.333 1.00 1.00 H new ATOM 0 HH11 ARG A 99 -12.374 2.051 -36.955 1.00 1.00 H new ATOM 0 HH12 ARG A 99 -12.752 3.708 -37.436 1.00 1.00 H new ATOM 0 HH21 ARG A 99 -10.594 5.153 -35.091 1.00 1.00 H new ATOM 0 HH22 ARG A 99 -11.754 5.441 -36.391 1.00 1.00 H new ATOM 1635 N PHE A 100 -10.325 -1.131 -30.256 1.00 1.00 N ATOM 1636 CA PHE A 100 -10.758 -1.245 -28.860 1.00 1.00 C ATOM 1637 C PHE A 100 -10.913 0.125 -28.250 1.00 1.00 C ATOM 1638 O PHE A 100 -9.988 0.961 -28.344 1.00 1.00 O ATOM 1639 CB PHE A 100 -9.777 -2.104 -28.044 1.00 1.00 C ATOM 1640 CG PHE A 100 -9.788 -3.579 -28.408 1.00 1.00 C ATOM 1641 CD1 PHE A 100 -10.660 -4.448 -27.786 1.00 1.00 C ATOM 1642 CD2 PHE A 100 -8.931 -4.064 -29.390 1.00 1.00 C ATOM 1643 CE1 PHE A 100 -10.681 -5.771 -28.125 1.00 1.00 C ATOM 1644 CE2 PHE A 100 -8.951 -5.386 -29.735 1.00 1.00 C ATOM 1645 CZ PHE A 100 -9.826 -6.243 -29.102 1.00 1.00 C ATOM 0 H PHE A 100 -9.407 -0.703 -30.376 1.00 1.00 H new ATOM 0 HA PHE A 100 -11.727 -1.744 -28.840 1.00 1.00 H new ATOM 0 HB2 PHE A 100 -8.768 -1.715 -28.183 1.00 1.00 H new ATOM 0 HB3 PHE A 100 -10.015 -2.001 -26.985 1.00 1.00 H new ATOM 0 HD1 PHE A 100 -11.332 -4.079 -27.025 1.00 1.00 H new ATOM 0 HD2 PHE A 100 -8.245 -3.391 -29.883 1.00 1.00 H new ATOM 0 HE1 PHE A 100 -11.364 -6.446 -27.631 1.00 1.00 H new ATOM 0 HE2 PHE A 100 -8.285 -5.758 -30.500 1.00 1.00 H new ATOM 0 HZ PHE A 100 -9.843 -7.289 -29.371 1.00 1.00 H new ATOM 1655 N LYS A 101 -12.108 0.368 -27.679 1.00 1.00 N ATOM 1656 CA LYS A 101 -12.440 1.669 -27.073 1.00 1.00 C ATOM 1657 C LYS A 101 -13.233 1.488 -25.783 1.00 1.00 C ATOM 1658 O LYS A 101 -13.902 0.444 -25.603 1.00 1.00 O ATOM 1659 CB LYS A 101 -13.225 2.542 -28.075 1.00 1.00 C ATOM 1660 CG LYS A 101 -12.507 3.829 -28.442 1.00 1.00 C ATOM 1661 CD LYS A 101 -13.482 4.985 -28.557 1.00 1.00 C ATOM 1662 CE LYS A 101 -12.773 6.277 -28.929 1.00 1.00 C ATOM 1663 NZ LYS A 101 -13.692 7.452 -28.917 1.00 1.00 N ATOM 0 H LYS A 101 -12.859 -0.320 -27.625 1.00 1.00 H new ATOM 0 HA LYS A 101 -11.508 2.175 -26.824 1.00 1.00 H new ATOM 0 HB2 LYS A 101 -13.409 1.966 -28.982 1.00 1.00 H new ATOM 0 HB3 LYS A 101 -14.198 2.786 -27.649 1.00 1.00 H new ATOM 0 HG2 LYS A 101 -11.755 4.057 -27.687 1.00 1.00 H new ATOM 0 HG3 LYS A 101 -11.980 3.698 -29.387 1.00 1.00 H new ATOM 0 HD2 LYS A 101 -14.236 4.753 -29.309 1.00 1.00 H new ATOM 0 HD3 LYS A 101 -14.006 5.116 -27.610 1.00 1.00 H new ATOM 0 HE2 LYS A 101 -11.954 6.453 -28.232 1.00 1.00 H new ATOM 0 HE3 LYS A 101 -12.332 6.174 -29.920 1.00 1.00 H new ATOM 0 HZ1 LYS A 101 -13.163 8.309 -29.177 1.00 1.00 H new ATOM 0 HZ2 LYS A 101 -14.460 7.299 -29.601 1.00 1.00 H new ATOM 0 HZ3 LYS A 101 -14.094 7.569 -27.965 1.00 1.00 H new ATOM 1677 N LEU A 102 -13.176 2.519 -24.903 1.00 1.00 N ATOM 1678 CA LEU A 102 -13.912 2.526 -23.646 1.00 1.00 C ATOM 1679 C LEU A 102 -14.825 3.733 -23.587 1.00 1.00 C ATOM 1680 O LEU A 102 -14.395 4.878 -23.894 1.00 1.00 O ATOM 1681 CB LEU A 102 -12.970 2.519 -22.441 1.00 1.00 C ATOM 1682 CG LEU A 102 -12.497 1.137 -21.983 1.00 1.00 C ATOM 1683 CD1 LEU A 102 -10.999 0.988 -22.177 1.00 1.00 C ATOM 1684 CD2 LEU A 102 -12.855 0.915 -20.530 1.00 1.00 C ATOM 0 H LEU A 102 -12.617 3.358 -25.058 1.00 1.00 H new ATOM 0 HA LEU A 102 -14.511 1.616 -23.604 1.00 1.00 H new ATOM 0 HB2 LEU A 102 -12.095 3.122 -22.683 1.00 1.00 H new ATOM 0 HB3 LEU A 102 -13.473 3.007 -21.606 1.00 1.00 H new ATOM 0 HG LEU A 102 -13.001 0.386 -22.592 1.00 1.00 H new ATOM 0 HD11 LEU A 102 -10.686 -0.002 -21.845 1.00 1.00 H new ATOM 0 HD12 LEU A 102 -10.755 1.111 -23.232 1.00 1.00 H new ATOM 0 HD13 LEU A 102 -10.479 1.748 -21.594 1.00 1.00 H new ATOM 0 HD21 LEU A 102 -12.513 -0.072 -20.218 1.00 1.00 H new ATOM 0 HD22 LEU A 102 -12.374 1.677 -19.916 1.00 1.00 H new ATOM 0 HD23 LEU A 102 -13.936 0.980 -20.408 1.00 1.00 H new ATOM 1696 N GLU A 103 -16.096 3.467 -23.229 1.00 1.00 N ATOM 1697 CA GLU A 103 -17.106 4.518 -23.135 1.00 1.00 C ATOM 1698 C GLU A 103 -17.695 4.564 -21.730 1.00 1.00 C ATOM 1699 O GLU A 103 -17.937 3.500 -21.114 1.00 1.00 O ATOM 1700 CB GLU A 103 -18.201 4.316 -24.189 1.00 1.00 C ATOM 1701 CG GLU A 103 -18.322 5.474 -25.166 1.00 1.00 C ATOM 1702 CD GLU A 103 -19.327 5.273 -26.359 1.00 1.00 C ATOM 1703 OE1 GLU A 103 -20.525 5.656 -26.222 1.00 1.00 O ATOM 1704 OE2 GLU A 103 -18.897 4.797 -27.450 1.00 1.00 O ATOM 0 H GLU A 103 -16.439 2.533 -23.002 1.00 1.00 H new ATOM 0 HA GLU A 103 -16.628 5.477 -23.334 1.00 1.00 H new ATOM 0 HB2 GLU A 103 -17.995 3.402 -24.745 1.00 1.00 H new ATOM 0 HB3 GLU A 103 -19.157 4.174 -23.686 1.00 1.00 H new ATOM 0 HG2 GLU A 103 -18.623 6.362 -24.610 1.00 1.00 H new ATOM 0 HG3 GLU A 103 -17.335 5.678 -25.580 1.00 1.00 H new ATOM 1711 N ARG A 104 -17.937 5.809 -21.259 1.00 1.00 N ATOM 1712 CA ARG A 104 -18.516 6.031 -19.921 1.00 1.00 C ATOM 1713 C ARG A 104 -20.049 6.182 -19.987 1.00 1.00 C ATOM 1714 O ARG A 104 -20.556 7.099 -20.682 1.00 1.00 O ATOM 1715 CB ARG A 104 -17.937 7.291 -19.289 1.00 1.00 C ATOM 1716 CG ARG A 104 -16.728 7.073 -18.425 1.00 1.00 C ATOM 1717 CD ARG A 104 -16.216 8.378 -17.922 1.00 1.00 C ATOM 1718 NE ARG A 104 -15.078 8.217 -17.026 1.00 1.00 N ATOM 1719 CZ ARG A 104 -14.679 9.151 -16.162 1.00 1.00 C ATOM 1720 NH1 ARG A 104 -15.453 10.188 -15.891 1.00 1.00 N ATOM 1721 NH2 ARG A 104 -13.530 9.029 -15.573 1.00 1.00 N ATOM 0 H ARG A 104 -17.742 6.663 -21.781 1.00 1.00 H new ATOM 0 HA ARG A 104 -18.266 5.158 -19.318 1.00 1.00 H new ATOM 0 HB2 ARG A 104 -17.675 7.990 -20.083 1.00 1.00 H new ATOM 0 HB3 ARG A 104 -18.712 7.767 -18.689 1.00 1.00 H new ATOM 0 HG2 ARG A 104 -16.983 6.426 -17.586 1.00 1.00 H new ATOM 0 HG3 ARG A 104 -15.951 6.564 -18.995 1.00 1.00 H new ATOM 0 HD2 ARG A 104 -15.925 9.002 -18.767 1.00 1.00 H new ATOM 0 HD3 ARG A 104 -17.016 8.903 -17.399 1.00 1.00 H new ATOM 0 HE ARG A 104 -14.557 7.341 -17.062 1.00 1.00 H new ATOM 0 HH11 ARG A 104 -16.362 10.278 -16.344 1.00 1.00 H new ATOM 0 HH12 ARG A 104 -15.141 10.898 -15.229 1.00 1.00 H new ATOM 0 HH21 ARG A 104 -12.938 8.223 -15.772 1.00 1.00 H new ATOM 0 HH22 ARG A 104 -13.218 9.740 -14.911 1.00 1.00 H new ATOM 1735 N LYS A 105 -20.822 5.187 -19.282 1.00 1.00 N ATOM 1736 CA LYS A 105 -22.376 5.104 -19.184 1.00 1.00 C ATOM 1737 C LYS A 105 -22.901 5.386 -17.687 1.00 1.00 C ATOM 1738 O LYS A 105 -22.580 4.614 -16.726 1.00 1.00 O ATOM 1739 CB LYS A 105 -22.951 3.705 -19.789 1.00 1.00 C ATOM 1740 CG LYS A 105 -23.561 3.753 -21.253 1.00 1.00 C ATOM 1741 CD LYS A 105 -24.088 2.376 -21.753 1.00 1.00 C ATOM 1742 CE LYS A 105 -24.681 2.435 -23.181 1.00 1.00 C ATOM 1743 NZ LYS A 105 -25.181 1.103 -23.641 1.00 1.00 N ATOM 1744 OXT LYS A 105 -23.606 6.414 -17.505 1.00 1.00 O ATOM 0 H LYS A 105 -20.368 4.429 -18.772 1.00 1.00 H new ATOM 0 HA LYS A 105 -22.778 5.901 -19.810 1.00 1.00 H new ATOM 0 HB2 LYS A 105 -22.142 2.975 -19.782 1.00 1.00 H new ATOM 0 HB3 LYS A 105 -23.721 3.334 -19.113 1.00 1.00 H new ATOM 0 HG2 LYS A 105 -24.378 4.475 -21.274 1.00 1.00 H new ATOM 0 HG3 LYS A 105 -22.799 4.114 -21.944 1.00 1.00 H new ATOM 0 HD2 LYS A 105 -23.272 1.653 -21.734 1.00 1.00 H new ATOM 0 HD3 LYS A 105 -24.851 2.014 -21.064 1.00 1.00 H new ATOM 0 HE2 LYS A 105 -25.499 3.155 -23.203 1.00 1.00 H new ATOM 0 HE3 LYS A 105 -23.920 2.795 -23.874 1.00 1.00 H new ATOM 0 HZ1 LYS A 105 -25.569 1.191 -24.602 1.00 1.00 H new ATOM 0 HZ2 LYS A 105 -24.396 0.420 -23.645 1.00 1.00 H new ATOM 0 HZ3 LYS A 105 -25.926 0.770 -22.996 1.00 1.00 H new