USER MOD reduce.3.24.130724 H: found=0, std=0, add=393, rem=0, adj=5 USER MOD reduce.3.24.130724 removed 396 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 NoAdj-H: A 335 HIS HD1 : A 335 HIS ND1 : A 401 ZNZN :(H bumps) USER MOD Set 1.1: A 317 SER OG : rot -112:sc= 1.13 USER MOD Set 1.2: A 319 ASN : amide:sc= 1.13 K(o=2.3,f=-1.8) USER MOD Single : A 310 TYR OH : rot 180:sc= 0 USER MOD Single : A 333 SER OG : rot -176:sc= -0.884! USER MOD Single : A 334 TYR OH : rot -82:sc= 0.238 USER MOD Single : A 336 THR OG1 : rot -175:sc= 1.08 USER MOD Single : A 344 HIS : no HD1:sc= -0.0454 X(o=-0.045,f=-0.016) USER MOD Single : A 348 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 355 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 359 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 306 0.387 18.188 -0.987 1.00 0.00 N ATOM 2 CA ALA A 306 1.600 17.453 -0.532 1.00 0.00 C ATOM 3 C ALA A 306 1.688 17.509 0.995 1.00 0.00 C ATOM 4 O ALA A 306 2.711 17.207 1.578 1.00 0.00 O ATOM 5 CB ALA A 306 2.846 18.101 -1.138 1.00 0.00 C ATOM 0 HA ALA A 306 1.537 16.414 -0.855 1.00 0.00 H new ATOM 0 HB1 ALA A 306 3.734 17.564 -0.805 1.00 0.00 H new ATOM 0 HB2 ALA A 306 2.784 18.062 -2.226 1.00 0.00 H new ATOM 0 HB3 ALA A 306 2.909 19.140 -0.816 1.00 0.00 H new ATOM 13 N VAL A 307 0.626 17.894 1.648 1.00 0.00 N ATOM 14 CA VAL A 307 0.653 17.969 3.136 1.00 0.00 C ATOM 15 C VAL A 307 0.947 16.583 3.711 1.00 0.00 C ATOM 16 O VAL A 307 1.715 16.437 4.643 1.00 0.00 O ATOM 17 CB VAL A 307 -0.702 18.457 3.647 1.00 0.00 C ATOM 18 CG1 VAL A 307 -0.732 18.376 5.174 1.00 0.00 C ATOM 19 CG2 VAL A 307 -0.920 19.907 3.208 1.00 0.00 C ATOM 0 H VAL A 307 -0.259 18.160 1.216 1.00 0.00 H new ATOM 0 HA VAL A 307 1.431 18.665 3.451 1.00 0.00 H new ATOM 0 HB VAL A 307 -1.493 17.830 3.235 1.00 0.00 H new ATOM 0 HG11 VAL A 307 -1.699 18.724 5.538 1.00 0.00 H new ATOM 0 HG12 VAL A 307 -0.577 17.343 5.487 1.00 0.00 H new ATOM 0 HG13 VAL A 307 0.058 19.003 5.587 1.00 0.00 H new ATOM 0 HG21 VAL A 307 -1.886 20.256 3.572 1.00 0.00 H new ATOM 0 HG22 VAL A 307 -0.129 20.534 3.619 1.00 0.00 H new ATOM 0 HG23 VAL A 307 -0.900 19.965 2.120 1.00 0.00 H new ATOM 29 N ASP A 308 0.345 15.561 3.165 1.00 0.00 N ATOM 30 CA ASP A 308 0.596 14.187 3.682 1.00 0.00 C ATOM 31 C ASP A 308 1.941 13.684 3.154 1.00 0.00 C ATOM 32 O ASP A 308 2.228 13.774 1.976 1.00 0.00 O ATOM 33 CB ASP A 308 -0.520 13.252 3.212 1.00 0.00 C ATOM 34 CG ASP A 308 -1.838 13.655 3.875 1.00 0.00 C ATOM 35 OD1 ASP A 308 -1.795 14.449 4.800 1.00 0.00 O ATOM 36 OD2 ASP A 308 -2.870 13.163 3.447 1.00 0.00 O ATOM 0 H ASP A 308 -0.309 15.619 2.384 1.00 0.00 H new ATOM 0 HA ASP A 308 0.617 14.206 4.772 1.00 0.00 H new ATOM 0 HB2 ASP A 308 -0.617 13.301 2.127 1.00 0.00 H new ATOM 0 HB3 ASP A 308 -0.275 12.220 3.464 1.00 0.00 H new ATOM 41 N LEU A 309 2.770 13.156 4.013 1.00 0.00 N ATOM 42 CA LEU A 309 4.095 12.650 3.554 1.00 0.00 C ATOM 43 C LEU A 309 3.893 11.531 2.529 1.00 0.00 C ATOM 44 O LEU A 309 4.612 11.436 1.554 1.00 0.00 O ATOM 45 CB LEU A 309 4.877 12.110 4.754 1.00 0.00 C ATOM 46 CG LEU A 309 6.281 11.690 4.309 1.00 0.00 C ATOM 47 CD1 LEU A 309 7.093 12.927 3.918 1.00 0.00 C ATOM 48 CD2 LEU A 309 6.982 10.967 5.461 1.00 0.00 C ATOM 0 H LEU A 309 2.587 13.053 5.011 1.00 0.00 H new ATOM 0 HA LEU A 309 4.653 13.464 3.092 1.00 0.00 H new ATOM 0 HB2 LEU A 309 4.944 12.873 5.530 1.00 0.00 H new ATOM 0 HB3 LEU A 309 4.353 11.259 5.189 1.00 0.00 H new ATOM 0 HG LEU A 309 6.202 11.025 3.449 1.00 0.00 H new ATOM 0 HD11 LEU A 309 8.091 12.622 3.602 1.00 0.00 H new ATOM 0 HD12 LEU A 309 6.595 13.445 3.098 1.00 0.00 H new ATOM 0 HD13 LEU A 309 7.172 13.596 4.775 1.00 0.00 H new ATOM 0 HD21 LEU A 309 7.982 10.667 5.147 1.00 0.00 H new ATOM 0 HD22 LEU A 309 7.056 11.636 6.319 1.00 0.00 H new ATOM 0 HD23 LEU A 309 6.408 10.083 5.739 1.00 0.00 H new ATOM 60 N TYR A 310 2.922 10.682 2.746 1.00 0.00 N ATOM 61 CA TYR A 310 2.672 9.566 1.789 1.00 0.00 C ATOM 62 C TYR A 310 1.214 9.589 1.328 1.00 0.00 C ATOM 63 O TYR A 310 0.305 9.779 2.112 1.00 0.00 O ATOM 64 CB TYR A 310 2.965 8.229 2.475 1.00 0.00 C ATOM 65 CG TYR A 310 4.235 7.640 1.908 1.00 0.00 C ATOM 66 CD1 TYR A 310 4.307 7.312 0.549 1.00 0.00 C ATOM 67 CD2 TYR A 310 5.339 7.420 2.741 1.00 0.00 C ATOM 68 CE1 TYR A 310 5.482 6.764 0.021 1.00 0.00 C ATOM 69 CE2 TYR A 310 6.515 6.872 2.213 1.00 0.00 C ATOM 70 CZ TYR A 310 6.586 6.543 0.854 1.00 0.00 C ATOM 71 OH TYR A 310 7.745 6.003 0.335 1.00 0.00 O ATOM 0 H TYR A 310 2.291 10.715 3.547 1.00 0.00 H new ATOM 0 HA TYR A 310 3.324 9.687 0.924 1.00 0.00 H new ATOM 0 HB2 TYR A 310 3.067 8.375 3.550 1.00 0.00 H new ATOM 0 HB3 TYR A 310 2.133 7.541 2.324 1.00 0.00 H new ATOM 0 HD1 TYR A 310 3.455 7.482 -0.093 1.00 0.00 H new ATOM 0 HD2 TYR A 310 5.284 7.673 3.790 1.00 0.00 H new ATOM 0 HE1 TYR A 310 5.537 6.512 -1.028 1.00 0.00 H new ATOM 0 HE2 TYR A 310 7.367 6.703 2.854 1.00 0.00 H new ATOM 0 HH TYR A 310 8.413 5.916 1.047 1.00 0.00 H new ATOM 81 N VAL A 311 0.988 9.386 0.058 1.00 0.00 N ATOM 82 CA VAL A 311 -0.407 9.382 -0.469 1.00 0.00 C ATOM 83 C VAL A 311 -0.614 8.123 -1.310 1.00 0.00 C ATOM 84 O VAL A 311 0.331 7.514 -1.770 1.00 0.00 O ATOM 85 CB VAL A 311 -0.632 10.619 -1.340 1.00 0.00 C ATOM 86 CG1 VAL A 311 -0.331 11.879 -0.527 1.00 0.00 C ATOM 87 CG2 VAL A 311 0.297 10.564 -2.555 1.00 0.00 C ATOM 0 H VAL A 311 1.713 9.222 -0.640 1.00 0.00 H new ATOM 0 HA VAL A 311 -1.114 9.395 0.361 1.00 0.00 H new ATOM 0 HB VAL A 311 -1.669 10.642 -1.675 1.00 0.00 H new ATOM 0 HG11 VAL A 311 -0.492 12.760 -1.148 1.00 0.00 H new ATOM 0 HG12 VAL A 311 -0.992 11.920 0.339 1.00 0.00 H new ATOM 0 HG13 VAL A 311 0.706 11.856 -0.191 1.00 0.00 H new ATOM 0 HG21 VAL A 311 0.137 11.445 -3.176 1.00 0.00 H new ATOM 0 HG22 VAL A 311 1.334 10.540 -2.219 1.00 0.00 H new ATOM 0 HG23 VAL A 311 0.083 9.667 -3.136 1.00 0.00 H new ATOM 97 N CYS A 312 -1.838 7.723 -1.520 1.00 0.00 N ATOM 98 CA CYS A 312 -2.084 6.504 -2.334 1.00 0.00 C ATOM 99 C CYS A 312 -2.003 6.875 -3.814 1.00 0.00 C ATOM 100 O CYS A 312 -2.853 7.561 -4.343 1.00 0.00 O ATOM 101 CB CYS A 312 -3.469 5.958 -1.991 1.00 0.00 C ATOM 102 SG CYS A 312 -4.004 4.740 -3.215 1.00 0.00 S ATOM 0 H CYS A 312 -2.674 8.187 -1.164 1.00 0.00 H new ATOM 0 HA CYS A 312 -1.338 5.739 -2.121 1.00 0.00 H new ATOM 0 HB2 CYS A 312 -3.449 5.501 -1.002 1.00 0.00 H new ATOM 0 HB3 CYS A 312 -4.187 6.777 -1.949 1.00 0.00 H new ATOM 107 N LEU A 313 -0.971 6.440 -4.481 1.00 0.00 N ATOM 108 CA LEU A 313 -0.813 6.780 -5.922 1.00 0.00 C ATOM 109 C LEU A 313 -2.042 6.313 -6.702 1.00 0.00 C ATOM 110 O LEU A 313 -2.485 6.965 -7.627 1.00 0.00 O ATOM 111 CB LEU A 313 0.434 6.084 -6.469 1.00 0.00 C ATOM 112 CG LEU A 313 0.669 6.522 -7.916 1.00 0.00 C ATOM 113 CD1 LEU A 313 1.020 8.012 -7.953 1.00 0.00 C ATOM 114 CD2 LEU A 313 1.826 5.714 -8.507 1.00 0.00 C ATOM 0 H LEU A 313 -0.228 5.862 -4.089 1.00 0.00 H new ATOM 0 HA LEU A 313 -0.710 7.860 -6.031 1.00 0.00 H new ATOM 0 HB2 LEU A 313 1.301 6.333 -5.857 1.00 0.00 H new ATOM 0 HB3 LEU A 313 0.310 5.002 -6.421 1.00 0.00 H new ATOM 0 HG LEU A 313 -0.236 6.349 -8.498 1.00 0.00 H new ATOM 0 HD11 LEU A 313 1.187 8.321 -8.985 1.00 0.00 H new ATOM 0 HD12 LEU A 313 0.199 8.590 -7.529 1.00 0.00 H new ATOM 0 HD13 LEU A 313 1.925 8.187 -7.371 1.00 0.00 H new ATOM 0 HD21 LEU A 313 1.996 6.023 -9.538 1.00 0.00 H new ATOM 0 HD22 LEU A 313 2.729 5.889 -7.922 1.00 0.00 H new ATOM 0 HD23 LEU A 313 1.578 4.653 -8.483 1.00 0.00 H new ATOM 126 N LEU A 314 -2.589 5.187 -6.346 1.00 0.00 N ATOM 127 CA LEU A 314 -3.779 4.677 -7.074 1.00 0.00 C ATOM 128 C LEU A 314 -4.949 5.656 -6.935 1.00 0.00 C ATOM 129 O LEU A 314 -5.754 5.795 -7.834 1.00 0.00 O ATOM 130 CB LEU A 314 -4.162 3.303 -6.515 1.00 0.00 C ATOM 131 CG LEU A 314 -2.990 2.325 -6.695 1.00 0.00 C ATOM 132 CD1 LEU A 314 -3.423 0.926 -6.263 1.00 0.00 C ATOM 133 CD2 LEU A 314 -2.565 2.277 -8.165 1.00 0.00 C ATOM 0 H LEU A 314 -2.262 4.597 -5.581 1.00 0.00 H new ATOM 0 HA LEU A 314 -3.541 4.581 -8.133 1.00 0.00 H new ATOM 0 HB2 LEU A 314 -4.418 3.388 -5.459 1.00 0.00 H new ATOM 0 HB3 LEU A 314 -5.046 2.925 -7.028 1.00 0.00 H new ATOM 0 HG LEU A 314 -2.153 2.664 -6.085 1.00 0.00 H new ATOM 0 HD11 LEU A 314 -2.592 0.232 -6.391 1.00 0.00 H new ATOM 0 HD12 LEU A 314 -3.722 0.945 -5.215 1.00 0.00 H new ATOM 0 HD13 LEU A 314 -4.264 0.600 -6.875 1.00 0.00 H new ATOM 0 HD21 LEU A 314 -1.734 1.581 -8.281 1.00 0.00 H new ATOM 0 HD22 LEU A 314 -3.404 1.945 -8.776 1.00 0.00 H new ATOM 0 HD23 LEU A 314 -2.253 3.271 -8.486 1.00 0.00 H new ATOM 145 N CYS A 315 -5.056 6.342 -5.830 1.00 0.00 N ATOM 146 CA CYS A 315 -6.183 7.307 -5.678 1.00 0.00 C ATOM 147 C CYS A 315 -5.743 8.501 -4.821 1.00 0.00 C ATOM 148 O CYS A 315 -6.048 9.637 -5.126 1.00 0.00 O ATOM 149 CB CYS A 315 -7.383 6.602 -5.037 1.00 0.00 C ATOM 150 SG CYS A 315 -7.197 6.569 -3.239 1.00 0.00 S ATOM 0 H CYS A 315 -4.421 6.278 -5.035 1.00 0.00 H new ATOM 0 HA CYS A 315 -6.474 7.676 -6.661 1.00 0.00 H new ATOM 0 HB2 CYS A 315 -8.304 7.119 -5.306 1.00 0.00 H new ATOM 0 HB3 CYS A 315 -7.465 5.585 -5.421 1.00 0.00 H new ATOM 155 N GLY A 316 -5.020 8.262 -3.762 1.00 0.00 N ATOM 156 CA GLY A 316 -4.555 9.397 -2.906 1.00 0.00 C ATOM 157 C GLY A 316 -5.756 10.072 -2.245 1.00 0.00 C ATOM 158 O GLY A 316 -6.026 11.236 -2.464 1.00 0.00 O ATOM 0 H GLY A 316 -4.730 7.335 -3.451 1.00 0.00 H new ATOM 0 HA2 GLY A 316 -3.867 9.032 -2.144 1.00 0.00 H new ATOM 0 HA3 GLY A 316 -4.007 10.120 -3.510 1.00 0.00 H new ATOM 162 N SER A 317 -6.483 9.350 -1.442 1.00 0.00 N ATOM 163 CA SER A 317 -7.676 9.948 -0.771 1.00 0.00 C ATOM 164 C SER A 317 -7.239 11.097 0.143 1.00 0.00 C ATOM 165 O SER A 317 -7.892 12.118 0.228 1.00 0.00 O ATOM 166 CB SER A 317 -8.386 8.882 0.062 1.00 0.00 C ATOM 167 OG SER A 317 -9.669 9.362 0.442 1.00 0.00 O ATOM 0 H SER A 317 -6.305 8.371 -1.219 1.00 0.00 H new ATOM 0 HA SER A 317 -8.356 10.330 -1.532 1.00 0.00 H new ATOM 0 HB2 SER A 317 -8.485 7.961 -0.512 1.00 0.00 H new ATOM 0 HB3 SER A 317 -7.797 8.644 0.948 1.00 0.00 H new ATOM 0 HG SER A 317 -9.688 9.513 1.410 1.00 0.00 H new ATOM 173 N GLY A 318 -6.141 10.937 0.827 1.00 0.00 N ATOM 174 CA GLY A 318 -5.660 12.016 1.737 1.00 0.00 C ATOM 175 C GLY A 318 -5.999 11.660 3.187 1.00 0.00 C ATOM 176 O GLY A 318 -5.238 11.931 4.095 1.00 0.00 O ATOM 0 H GLY A 318 -5.554 10.104 0.796 1.00 0.00 H new ATOM 0 HA2 GLY A 318 -4.583 12.145 1.627 1.00 0.00 H new ATOM 0 HA3 GLY A 318 -6.124 12.965 1.468 1.00 0.00 H new ATOM 180 N ASN A 319 -7.131 11.047 3.414 1.00 0.00 N ATOM 181 CA ASN A 319 -7.510 10.668 4.805 1.00 0.00 C ATOM 182 C ASN A 319 -7.295 9.167 4.986 1.00 0.00 C ATOM 183 O ASN A 319 -7.278 8.654 6.088 1.00 0.00 O ATOM 184 CB ASN A 319 -8.983 11.000 5.045 1.00 0.00 C ATOM 185 CG ASN A 319 -9.855 10.039 4.234 1.00 0.00 C ATOM 186 OD1 ASN A 319 -9.954 10.162 3.030 1.00 0.00 O ATOM 187 ND2 ASN A 319 -10.487 9.076 4.846 1.00 0.00 N ATOM 0 H ASN A 319 -7.809 10.793 2.695 1.00 0.00 H new ATOM 0 HA ASN A 319 -6.896 11.221 5.516 1.00 0.00 H new ATOM 0 HB2 ASN A 319 -9.219 10.916 6.106 1.00 0.00 H new ATOM 0 HB3 ASN A 319 -9.188 12.030 4.753 1.00 0.00 H new ATOM 0 HD21 ASN A 319 -11.065 8.426 4.313 1.00 0.00 H new ATOM 0 HD22 ASN A 319 -10.403 8.973 5.857 1.00 0.00 H new ATOM 194 N ASP A 320 -7.119 8.465 3.904 1.00 0.00 N ATOM 195 CA ASP A 320 -6.891 7.002 3.977 1.00 0.00 C ATOM 196 C ASP A 320 -5.421 6.755 4.312 1.00 0.00 C ATOM 197 O ASP A 320 -4.985 5.633 4.479 1.00 0.00 O ATOM 198 CB ASP A 320 -7.235 6.372 2.630 1.00 0.00 C ATOM 199 CG ASP A 320 -8.742 6.476 2.387 1.00 0.00 C ATOM 200 OD1 ASP A 320 -9.453 6.796 3.325 1.00 0.00 O ATOM 201 OD2 ASP A 320 -9.158 6.234 1.266 1.00 0.00 O ATOM 0 H ASP A 320 -7.124 8.851 2.960 1.00 0.00 H new ATOM 0 HA ASP A 320 -7.521 6.556 4.747 1.00 0.00 H new ATOM 0 HB2 ASP A 320 -6.692 6.877 1.831 1.00 0.00 H new ATOM 0 HB3 ASP A 320 -6.925 5.327 2.616 1.00 0.00 H new ATOM 206 N GLU A 321 -4.652 7.807 4.392 1.00 0.00 N ATOM 207 CA GLU A 321 -3.202 7.665 4.693 1.00 0.00 C ATOM 208 C GLU A 321 -3.010 6.788 5.932 1.00 0.00 C ATOM 209 O GLU A 321 -1.982 6.165 6.108 1.00 0.00 O ATOM 210 CB GLU A 321 -2.608 9.050 4.957 1.00 0.00 C ATOM 211 CG GLU A 321 -1.096 8.930 5.146 1.00 0.00 C ATOM 212 CD GLU A 321 -0.515 10.298 5.510 1.00 0.00 C ATOM 213 OE1 GLU A 321 -1.287 11.237 5.622 1.00 0.00 O ATOM 214 OE2 GLU A 321 0.691 10.383 5.673 1.00 0.00 O ATOM 0 H GLU A 321 -4.971 8.767 4.260 1.00 0.00 H new ATOM 0 HA GLU A 321 -2.701 7.200 3.844 1.00 0.00 H new ATOM 0 HB2 GLU A 321 -2.829 9.717 4.124 1.00 0.00 H new ATOM 0 HB3 GLU A 321 -3.062 9.489 5.845 1.00 0.00 H new ATOM 0 HG2 GLU A 321 -0.874 8.208 5.932 1.00 0.00 H new ATOM 0 HG3 GLU A 321 -0.633 8.558 4.232 1.00 0.00 H new ATOM 221 N ASP A 322 -3.985 6.735 6.794 1.00 0.00 N ATOM 222 CA ASP A 322 -3.851 5.902 8.017 1.00 0.00 C ATOM 223 C ASP A 322 -3.583 4.440 7.635 1.00 0.00 C ATOM 224 O ASP A 322 -2.836 3.749 8.299 1.00 0.00 O ATOM 225 CB ASP A 322 -5.145 5.988 8.824 1.00 0.00 C ATOM 226 CG ASP A 322 -5.311 7.404 9.376 1.00 0.00 C ATOM 227 OD1 ASP A 322 -4.353 8.156 9.317 1.00 0.00 O ATOM 228 OD2 ASP A 322 -6.392 7.712 9.848 1.00 0.00 O ATOM 0 H ASP A 322 -4.870 7.234 6.703 1.00 0.00 H new ATOM 0 HA ASP A 322 -3.015 6.270 8.613 1.00 0.00 H new ATOM 0 HB2 ASP A 322 -5.996 5.730 8.194 1.00 0.00 H new ATOM 0 HB3 ASP A 322 -5.124 5.268 9.642 1.00 0.00 H new ATOM 233 N ARG A 323 -4.193 3.960 6.581 1.00 0.00 N ATOM 234 CA ARG A 323 -3.979 2.538 6.174 1.00 0.00 C ATOM 235 C ARG A 323 -3.136 2.449 4.899 1.00 0.00 C ATOM 236 O ARG A 323 -3.047 1.404 4.286 1.00 0.00 O ATOM 237 CB ARG A 323 -5.327 1.855 5.936 1.00 0.00 C ATOM 238 CG ARG A 323 -6.101 1.792 7.252 1.00 0.00 C ATOM 239 CD ARG A 323 -7.315 0.876 7.091 1.00 0.00 C ATOM 240 NE ARG A 323 -8.201 1.013 8.282 1.00 0.00 N ATOM 241 CZ ARG A 323 -7.792 0.606 9.455 1.00 0.00 C ATOM 242 NH1 ARG A 323 -6.614 0.059 9.585 1.00 0.00 N ATOM 243 NH2 ARG A 323 -8.565 0.742 10.497 1.00 0.00 N ATOM 0 H ARG A 323 -4.829 4.490 5.986 1.00 0.00 H new ATOM 0 HA ARG A 323 -3.445 2.035 6.980 1.00 0.00 H new ATOM 0 HB2 ARG A 323 -5.900 2.406 5.190 1.00 0.00 H new ATOM 0 HB3 ARG A 323 -5.174 0.850 5.542 1.00 0.00 H new ATOM 0 HG2 ARG A 323 -5.455 1.420 8.048 1.00 0.00 H new ATOM 0 HG3 ARG A 323 -6.423 2.791 7.544 1.00 0.00 H new ATOM 0 HD2 ARG A 323 -7.863 1.136 6.185 1.00 0.00 H new ATOM 0 HD3 ARG A 323 -6.991 -0.159 6.982 1.00 0.00 H new ATOM 0 HE ARG A 323 -9.129 1.425 8.181 1.00 0.00 H new ATOM 0 HH11 ARG A 323 -6.010 -0.052 8.770 1.00 0.00 H new ATOM 0 HH12 ARG A 323 -6.297 -0.258 10.501 1.00 0.00 H new ATOM 0 HH21 ARG A 323 -9.487 1.165 10.396 1.00 0.00 H new ATOM 0 HH22 ARG A 323 -8.247 0.425 11.413 1.00 0.00 H new ATOM 257 N LEU A 324 -2.512 3.517 4.487 1.00 0.00 N ATOM 258 CA LEU A 324 -1.684 3.443 3.251 1.00 0.00 C ATOM 259 C LEU A 324 -0.510 2.497 3.489 1.00 0.00 C ATOM 260 O LEU A 324 0.225 2.624 4.449 1.00 0.00 O ATOM 261 CB LEU A 324 -1.172 4.837 2.885 1.00 0.00 C ATOM 262 CG LEU A 324 -0.284 4.756 1.639 1.00 0.00 C ATOM 263 CD1 LEU A 324 -0.345 6.090 0.895 1.00 0.00 C ATOM 264 CD2 LEU A 324 1.174 4.460 2.028 1.00 0.00 C ATOM 0 H LEU A 324 -2.538 4.428 4.946 1.00 0.00 H new ATOM 0 HA LEU A 324 -2.289 3.066 2.427 1.00 0.00 H new ATOM 0 HB2 LEU A 324 -2.013 5.506 2.700 1.00 0.00 H new ATOM 0 HB3 LEU A 324 -0.608 5.257 3.718 1.00 0.00 H new ATOM 0 HG LEU A 324 -0.646 3.949 1.001 1.00 0.00 H new ATOM 0 HD11 LEU A 324 0.285 6.040 0.007 1.00 0.00 H new ATOM 0 HD12 LEU A 324 -1.374 6.295 0.599 1.00 0.00 H new ATOM 0 HD13 LEU A 324 0.011 6.887 1.548 1.00 0.00 H new ATOM 0 HD21 LEU A 324 1.787 4.407 1.128 1.00 0.00 H new ATOM 0 HD22 LEU A 324 1.547 5.255 2.674 1.00 0.00 H new ATOM 0 HD23 LEU A 324 1.223 3.509 2.557 1.00 0.00 H new ATOM 276 N LEU A 325 -0.344 1.536 2.625 1.00 0.00 N ATOM 277 CA LEU A 325 0.760 0.558 2.794 1.00 0.00 C ATOM 278 C LEU A 325 1.877 0.852 1.789 1.00 0.00 C ATOM 279 O LEU A 325 1.642 0.983 0.605 1.00 0.00 O ATOM 280 CB LEU A 325 0.210 -0.847 2.544 1.00 0.00 C ATOM 281 CG LEU A 325 1.266 -1.893 2.897 1.00 0.00 C ATOM 282 CD1 LEU A 325 1.159 -2.247 4.381 1.00 0.00 C ATOM 283 CD2 LEU A 325 1.033 -3.148 2.054 1.00 0.00 C ATOM 0 H LEU A 325 -0.931 1.387 1.804 1.00 0.00 H new ATOM 0 HA LEU A 325 1.164 0.631 3.804 1.00 0.00 H new ATOM 0 HB2 LEU A 325 -0.687 -1.007 3.143 1.00 0.00 H new ATOM 0 HB3 LEU A 325 -0.082 -0.951 1.499 1.00 0.00 H new ATOM 0 HG LEU A 325 2.259 -1.494 2.692 1.00 0.00 H new ATOM 0 HD11 LEU A 325 1.913 -2.993 4.632 1.00 0.00 H new ATOM 0 HD12 LEU A 325 1.321 -1.352 4.981 1.00 0.00 H new ATOM 0 HD13 LEU A 325 0.167 -2.649 4.589 1.00 0.00 H new ATOM 0 HD21 LEU A 325 1.784 -3.898 2.302 1.00 0.00 H new ATOM 0 HD22 LEU A 325 0.040 -3.547 2.262 1.00 0.00 H new ATOM 0 HD23 LEU A 325 1.108 -2.895 0.996 1.00 0.00 H new ATOM 295 N LEU A 326 3.095 0.939 2.251 1.00 0.00 N ATOM 296 CA LEU A 326 4.229 1.203 1.323 1.00 0.00 C ATOM 297 C LEU A 326 4.878 -0.132 0.955 1.00 0.00 C ATOM 298 O LEU A 326 5.087 -0.984 1.797 1.00 0.00 O ATOM 299 CB LEU A 326 5.253 2.114 2.006 1.00 0.00 C ATOM 300 CG LEU A 326 6.405 2.437 1.044 1.00 0.00 C ATOM 301 CD1 LEU A 326 5.944 3.457 -0.001 1.00 0.00 C ATOM 302 CD2 LEU A 326 7.575 3.019 1.837 1.00 0.00 C ATOM 0 H LEU A 326 3.353 0.838 3.233 1.00 0.00 H new ATOM 0 HA LEU A 326 3.868 1.698 0.421 1.00 0.00 H new ATOM 0 HB2 LEU A 326 4.771 3.037 2.329 1.00 0.00 H new ATOM 0 HB3 LEU A 326 5.643 1.628 2.900 1.00 0.00 H new ATOM 0 HG LEU A 326 6.717 1.523 0.538 1.00 0.00 H new ATOM 0 HD11 LEU A 326 6.767 3.680 -0.679 1.00 0.00 H new ATOM 0 HD12 LEU A 326 5.109 3.045 -0.567 1.00 0.00 H new ATOM 0 HD13 LEU A 326 5.627 4.372 0.499 1.00 0.00 H new ATOM 0 HD21 LEU A 326 8.396 3.250 1.158 1.00 0.00 H new ATOM 0 HD22 LEU A 326 7.255 3.930 2.342 1.00 0.00 H new ATOM 0 HD23 LEU A 326 7.910 2.292 2.577 1.00 0.00 H new ATOM 314 N CYS A 327 5.178 -0.331 -0.296 1.00 0.00 N ATOM 315 CA CYS A 327 5.789 -1.621 -0.717 1.00 0.00 C ATOM 316 C CYS A 327 7.307 -1.577 -0.542 1.00 0.00 C ATOM 317 O CYS A 327 8.000 -0.855 -1.231 1.00 0.00 O ATOM 318 CB CYS A 327 5.467 -1.871 -2.188 1.00 0.00 C ATOM 319 SG CYS A 327 6.316 -3.367 -2.739 1.00 0.00 S ATOM 0 H CYS A 327 5.027 0.344 -1.046 1.00 0.00 H new ATOM 0 HA CYS A 327 5.383 -2.421 -0.098 1.00 0.00 H new ATOM 0 HB2 CYS A 327 4.391 -1.979 -2.323 1.00 0.00 H new ATOM 0 HB3 CYS A 327 5.780 -1.018 -2.791 1.00 0.00 H new ATOM 324 N ASP A 328 7.832 -2.356 0.364 1.00 0.00 N ATOM 325 CA ASP A 328 9.307 -2.373 0.565 1.00 0.00 C ATOM 326 C ASP A 328 9.977 -3.032 -0.643 1.00 0.00 C ATOM 327 O ASP A 328 11.046 -2.636 -1.065 1.00 0.00 O ATOM 328 CB ASP A 328 9.645 -3.161 1.832 1.00 0.00 C ATOM 329 CG ASP A 328 9.127 -2.404 3.057 1.00 0.00 C ATOM 330 OD1 ASP A 328 8.723 -1.264 2.896 1.00 0.00 O ATOM 331 OD2 ASP A 328 9.144 -2.977 4.133 1.00 0.00 O ATOM 0 H ASP A 328 7.303 -2.981 0.973 1.00 0.00 H new ATOM 0 HA ASP A 328 9.670 -1.351 0.670 1.00 0.00 H new ATOM 0 HB2 ASP A 328 9.195 -4.153 1.787 1.00 0.00 H new ATOM 0 HB3 ASP A 328 10.723 -3.303 1.908 1.00 0.00 H new ATOM 336 N GLY A 329 9.359 -4.040 -1.201 1.00 0.00 N ATOM 337 CA GLY A 329 9.964 -4.728 -2.379 1.00 0.00 C ATOM 338 C GLY A 329 10.218 -3.713 -3.492 1.00 0.00 C ATOM 339 O GLY A 329 11.230 -3.750 -4.164 1.00 0.00 O ATOM 0 H GLY A 329 8.463 -4.416 -0.892 1.00 0.00 H new ATOM 0 HA2 GLY A 329 10.899 -5.209 -2.091 1.00 0.00 H new ATOM 0 HA3 GLY A 329 9.298 -5.514 -2.735 1.00 0.00 H new ATOM 343 N CYS A 330 9.309 -2.801 -3.688 1.00 0.00 N ATOM 344 CA CYS A 330 9.495 -1.774 -4.751 1.00 0.00 C ATOM 345 C CYS A 330 8.802 -0.481 -4.320 1.00 0.00 C ATOM 346 O CYS A 330 7.926 -0.489 -3.480 1.00 0.00 O ATOM 347 CB CYS A 330 8.900 -2.278 -6.069 1.00 0.00 C ATOM 348 SG CYS A 330 7.123 -1.944 -6.112 1.00 0.00 S ATOM 0 H CYS A 330 8.442 -2.722 -3.157 1.00 0.00 H new ATOM 0 HA CYS A 330 10.558 -1.584 -4.899 1.00 0.00 H new ATOM 0 HB2 CYS A 330 9.391 -1.789 -6.910 1.00 0.00 H new ATOM 0 HB3 CYS A 330 9.080 -3.348 -6.173 1.00 0.00 H new ATOM 353 N ASP A 331 9.191 0.633 -4.874 1.00 0.00 N ATOM 354 CA ASP A 331 8.557 1.919 -4.471 1.00 0.00 C ATOM 355 C ASP A 331 7.113 1.964 -4.971 1.00 0.00 C ATOM 356 O ASP A 331 6.850 2.254 -6.121 1.00 0.00 O ATOM 357 CB ASP A 331 9.342 3.084 -5.077 1.00 0.00 C ATOM 358 CG ASP A 331 8.767 4.407 -4.567 1.00 0.00 C ATOM 359 OD1 ASP A 331 7.898 4.362 -3.712 1.00 0.00 O ATOM 360 OD2 ASP A 331 9.205 5.443 -5.041 1.00 0.00 O ATOM 0 H ASP A 331 9.918 0.709 -5.586 1.00 0.00 H new ATOM 0 HA ASP A 331 8.563 1.998 -3.384 1.00 0.00 H new ATOM 0 HB2 ASP A 331 10.395 3.005 -4.808 1.00 0.00 H new ATOM 0 HB3 ASP A 331 9.287 3.047 -6.165 1.00 0.00 H new ATOM 365 N ASP A 332 6.174 1.687 -4.108 1.00 0.00 N ATOM 366 CA ASP A 332 4.744 1.721 -4.522 1.00 0.00 C ATOM 367 C ASP A 332 3.858 1.850 -3.280 1.00 0.00 C ATOM 368 O ASP A 332 3.898 1.018 -2.394 1.00 0.00 O ATOM 369 CB ASP A 332 4.397 0.429 -5.266 1.00 0.00 C ATOM 370 CG ASP A 332 2.992 0.546 -5.864 1.00 0.00 C ATOM 371 OD1 ASP A 332 2.408 1.611 -5.750 1.00 0.00 O ATOM 372 OD2 ASP A 332 2.527 -0.431 -6.426 1.00 0.00 O ATOM 0 H ASP A 332 6.337 1.438 -3.132 1.00 0.00 H new ATOM 0 HA ASP A 332 4.575 2.574 -5.179 1.00 0.00 H new ATOM 0 HB2 ASP A 332 5.126 0.244 -6.055 1.00 0.00 H new ATOM 0 HB3 ASP A 332 4.444 -0.420 -4.584 1.00 0.00 H new ATOM 377 N SER A 333 3.060 2.882 -3.208 1.00 0.00 N ATOM 378 CA SER A 333 2.172 3.061 -2.024 1.00 0.00 C ATOM 379 C SER A 333 0.711 2.924 -2.454 1.00 0.00 C ATOM 380 O SER A 333 0.286 3.490 -3.443 1.00 0.00 O ATOM 381 CB SER A 333 2.392 4.454 -1.437 1.00 0.00 C ATOM 382 OG SER A 333 3.763 4.611 -1.098 1.00 0.00 O ATOM 0 H SER A 333 2.985 3.609 -3.919 1.00 0.00 H new ATOM 0 HA SER A 333 2.405 2.302 -1.277 1.00 0.00 H new ATOM 0 HB2 SER A 333 2.094 5.216 -2.158 1.00 0.00 H new ATOM 0 HB3 SER A 333 1.769 4.591 -0.553 1.00 0.00 H new ATOM 0 HG SER A 333 3.895 5.478 -0.660 1.00 0.00 H new ATOM 388 N TYR A 334 -0.062 2.181 -1.712 1.00 0.00 N ATOM 389 CA TYR A 334 -1.499 2.006 -2.063 1.00 0.00 C ATOM 390 C TYR A 334 -2.296 1.668 -0.804 1.00 0.00 C ATOM 391 O TYR A 334 -1.754 1.194 0.174 1.00 0.00 O ATOM 392 CB TYR A 334 -1.653 0.881 -3.086 1.00 0.00 C ATOM 393 CG TYR A 334 -0.790 -0.294 -2.699 1.00 0.00 C ATOM 394 CD1 TYR A 334 -1.129 -1.079 -1.592 1.00 0.00 C ATOM 395 CD2 TYR A 334 0.343 -0.605 -3.457 1.00 0.00 C ATOM 396 CE1 TYR A 334 -0.332 -2.175 -1.240 1.00 0.00 C ATOM 397 CE2 TYR A 334 1.140 -1.702 -3.109 1.00 0.00 C ATOM 398 CZ TYR A 334 0.802 -2.488 -2.000 1.00 0.00 C ATOM 399 OH TYR A 334 1.587 -3.570 -1.655 1.00 0.00 O ATOM 0 H TYR A 334 0.241 1.685 -0.874 1.00 0.00 H new ATOM 0 HA TYR A 334 -1.877 2.933 -2.494 1.00 0.00 H new ATOM 0 HB2 TYR A 334 -2.697 0.572 -3.144 1.00 0.00 H new ATOM 0 HB3 TYR A 334 -1.371 1.239 -4.076 1.00 0.00 H new ATOM 0 HD1 TYR A 334 -2.006 -0.840 -1.009 1.00 0.00 H new ATOM 0 HD2 TYR A 334 0.604 0.002 -4.312 1.00 0.00 H new ATOM 0 HE1 TYR A 334 -0.592 -2.779 -0.383 1.00 0.00 H new ATOM 0 HE2 TYR A 334 2.015 -1.942 -3.695 1.00 0.00 H new ATOM 0 HH TYR A 334 2.206 -3.310 -0.941 1.00 0.00 H new ATOM 409 N HIS A 335 -3.581 1.901 -0.815 1.00 0.00 N ATOM 410 CA HIS A 335 -4.393 1.578 0.388 1.00 0.00 C ATOM 411 C HIS A 335 -4.591 0.066 0.472 1.00 0.00 C ATOM 412 O HIS A 335 -4.458 -0.647 -0.502 1.00 0.00 O ATOM 413 CB HIS A 335 -5.756 2.270 0.313 1.00 0.00 C ATOM 414 CG HIS A 335 -5.564 3.760 0.321 1.00 0.00 C ATOM 415 ND1 HIS A 335 -6.234 4.595 -0.560 1.00 0.00 N ATOM 416 CD2 HIS A 335 -4.782 4.580 1.095 1.00 0.00 C ATOM 417 CE1 HIS A 335 -5.845 5.856 -0.297 1.00 0.00 C ATOM 418 NE2 HIS A 335 -4.961 5.899 0.701 1.00 0.00 N ATOM 0 H HIS A 335 -4.098 2.298 -1.599 1.00 0.00 H new ATOM 0 HA HIS A 335 -3.869 1.932 1.276 1.00 0.00 H new ATOM 0 HB2 HIS A 335 -6.281 1.965 -0.592 1.00 0.00 H new ATOM 0 HB3 HIS A 335 -6.376 1.968 1.157 1.00 0.00 H new ATOM 0 HD2 HIS A 335 -4.128 4.250 1.889 1.00 0.00 H new ATOM 0 HE1 HIS A 335 -6.204 6.725 -0.828 1.00 0.00 H new ATOM 0 HE2 HIS A 335 -4.511 6.727 1.092 1.00 0.00 H new ATOM 426 N THR A 336 -4.898 -0.426 1.636 1.00 0.00 N ATOM 427 CA THR A 336 -5.098 -1.888 1.811 1.00 0.00 C ATOM 428 C THR A 336 -6.265 -2.369 0.945 1.00 0.00 C ATOM 429 O THR A 336 -6.478 -3.554 0.790 1.00 0.00 O ATOM 430 CB THR A 336 -5.407 -2.169 3.282 1.00 0.00 C ATOM 431 OG1 THR A 336 -6.634 -1.546 3.634 1.00 0.00 O ATOM 432 CG2 THR A 336 -4.281 -1.612 4.156 1.00 0.00 C ATOM 0 H THR A 336 -5.020 0.129 2.483 1.00 0.00 H new ATOM 0 HA THR A 336 -4.194 -2.417 1.508 1.00 0.00 H new ATOM 0 HB THR A 336 -5.488 -3.245 3.438 1.00 0.00 H new ATOM 0 HG1 THR A 336 -6.797 -1.663 4.593 1.00 0.00 H new ATOM 0 HG21 THR A 336 -4.501 -1.812 5.205 1.00 0.00 H new ATOM 0 HG22 THR A 336 -3.340 -2.090 3.885 1.00 0.00 H new ATOM 0 HG23 THR A 336 -4.199 -0.536 4.002 1.00 0.00 H new ATOM 440 N PHE A 337 -7.026 -1.463 0.385 1.00 0.00 N ATOM 441 CA PHE A 337 -8.184 -1.877 -0.459 1.00 0.00 C ATOM 442 C PHE A 337 -8.048 -1.308 -1.875 1.00 0.00 C ATOM 443 O PHE A 337 -8.881 -1.549 -2.726 1.00 0.00 O ATOM 444 CB PHE A 337 -9.480 -1.363 0.169 1.00 0.00 C ATOM 445 CG PHE A 337 -9.373 0.122 0.413 1.00 0.00 C ATOM 446 CD1 PHE A 337 -9.765 1.026 -0.581 1.00 0.00 C ATOM 447 CD2 PHE A 337 -8.888 0.596 1.638 1.00 0.00 C ATOM 448 CE1 PHE A 337 -9.671 2.403 -0.351 1.00 0.00 C ATOM 449 CE2 PHE A 337 -8.792 1.972 1.869 1.00 0.00 C ATOM 450 CZ PHE A 337 -9.185 2.877 0.875 1.00 0.00 C ATOM 0 H PHE A 337 -6.894 -0.456 0.477 1.00 0.00 H new ATOM 0 HA PHE A 337 -8.203 -2.965 -0.517 1.00 0.00 H new ATOM 0 HB2 PHE A 337 -10.323 -1.573 -0.489 1.00 0.00 H new ATOM 0 HB3 PHE A 337 -9.672 -1.883 1.108 1.00 0.00 H new ATOM 0 HD1 PHE A 337 -10.140 0.661 -1.526 1.00 0.00 H new ATOM 0 HD2 PHE A 337 -8.588 -0.102 2.406 1.00 0.00 H new ATOM 0 HE1 PHE A 337 -9.973 3.101 -1.118 1.00 0.00 H new ATOM 0 HE2 PHE A 337 -8.415 2.336 2.813 1.00 0.00 H new ATOM 0 HZ PHE A 337 -9.114 3.940 1.053 1.00 0.00 H new ATOM 460 N CYS A 338 -7.016 -0.556 -2.140 1.00 0.00 N ATOM 461 CA CYS A 338 -6.855 0.016 -3.508 1.00 0.00 C ATOM 462 C CYS A 338 -6.046 -0.944 -4.378 1.00 0.00 C ATOM 463 O CYS A 338 -5.786 -0.670 -5.532 1.00 0.00 O ATOM 464 CB CYS A 338 -6.113 1.352 -3.435 1.00 0.00 C ATOM 465 SG CYS A 338 -7.300 2.710 -3.272 1.00 0.00 S ATOM 0 H CYS A 338 -6.282 -0.314 -1.475 1.00 0.00 H new ATOM 0 HA CYS A 338 -7.844 0.167 -3.939 1.00 0.00 H new ATOM 0 HB2 CYS A 338 -5.429 1.352 -2.586 1.00 0.00 H new ATOM 0 HB3 CYS A 338 -5.509 1.492 -4.331 1.00 0.00 H new ATOM 470 N LEU A 339 -5.624 -2.058 -3.843 1.00 0.00 N ATOM 471 CA LEU A 339 -4.814 -2.988 -4.674 1.00 0.00 C ATOM 472 C LEU A 339 -4.729 -4.374 -4.032 1.00 0.00 C ATOM 473 O LEU A 339 -4.619 -5.372 -4.715 1.00 0.00 O ATOM 474 CB LEU A 339 -3.405 -2.418 -4.807 1.00 0.00 C ATOM 475 CG LEU A 339 -2.605 -3.258 -5.803 1.00 0.00 C ATOM 476 CD1 LEU A 339 -3.180 -3.078 -7.209 1.00 0.00 C ATOM 477 CD2 LEU A 339 -1.146 -2.800 -5.788 1.00 0.00 C ATOM 0 H LEU A 339 -5.802 -2.359 -2.885 1.00 0.00 H new ATOM 0 HA LEU A 339 -5.289 -3.090 -5.650 1.00 0.00 H new ATOM 0 HB2 LEU A 339 -3.451 -1.382 -5.143 1.00 0.00 H new ATOM 0 HB3 LEU A 339 -2.909 -2.416 -3.836 1.00 0.00 H new ATOM 0 HG LEU A 339 -2.665 -4.310 -5.522 1.00 0.00 H new ATOM 0 HD11 LEU A 339 -2.607 -3.678 -7.916 1.00 0.00 H new ATOM 0 HD12 LEU A 339 -4.221 -3.400 -7.220 1.00 0.00 H new ATOM 0 HD13 LEU A 339 -3.122 -2.028 -7.494 1.00 0.00 H new ATOM 0 HD21 LEU A 339 -0.570 -3.396 -6.497 1.00 0.00 H new ATOM 0 HD22 LEU A 339 -1.092 -1.748 -6.070 1.00 0.00 H new ATOM 0 HD23 LEU A 339 -0.734 -2.929 -4.787 1.00 0.00 H new ATOM 489 N ILE A 340 -4.748 -4.445 -2.730 1.00 0.00 N ATOM 490 CA ILE A 340 -4.633 -5.764 -2.057 1.00 0.00 C ATOM 491 C ILE A 340 -5.962 -6.134 -1.384 1.00 0.00 C ATOM 492 O ILE A 340 -6.672 -5.277 -0.897 1.00 0.00 O ATOM 493 CB ILE A 340 -3.528 -5.663 -1.008 1.00 0.00 C ATOM 494 CG1 ILE A 340 -4.009 -4.806 0.165 1.00 0.00 C ATOM 495 CG2 ILE A 340 -2.293 -5.014 -1.636 1.00 0.00 C ATOM 496 CD1 ILE A 340 -2.835 -4.517 1.102 1.00 0.00 C ATOM 0 H ILE A 340 -4.838 -3.644 -2.104 1.00 0.00 H new ATOM 0 HA ILE A 340 -4.395 -6.538 -2.787 1.00 0.00 H new ATOM 0 HB ILE A 340 -3.277 -6.661 -0.648 1.00 0.00 H new ATOM 0 HG12 ILE A 340 -4.432 -3.872 -0.203 1.00 0.00 H new ATOM 0 HG13 ILE A 340 -4.801 -5.323 0.706 1.00 0.00 H new ATOM 0 HG21 ILE A 340 -1.502 -4.940 -0.890 1.00 0.00 H new ATOM 0 HG22 ILE A 340 -1.948 -5.622 -2.472 1.00 0.00 H new ATOM 0 HG23 ILE A 340 -2.548 -4.017 -1.994 1.00 0.00 H new ATOM 0 HD11 ILE A 340 -3.178 -3.907 1.937 1.00 0.00 H new ATOM 0 HD12 ILE A 340 -2.432 -5.456 1.480 1.00 0.00 H new ATOM 0 HD13 ILE A 340 -2.058 -3.982 0.557 1.00 0.00 H new ATOM 508 N PRO A 341 -6.298 -7.408 -1.349 1.00 0.00 N ATOM 509 CA PRO A 341 -7.557 -7.875 -0.718 1.00 0.00 C ATOM 510 C PRO A 341 -7.766 -7.272 0.679 1.00 0.00 C ATOM 511 O PRO A 341 -8.824 -6.750 0.967 1.00 0.00 O ATOM 512 CB PRO A 341 -7.433 -9.402 -0.640 1.00 0.00 C ATOM 513 CG PRO A 341 -6.143 -9.781 -1.303 1.00 0.00 C ATOM 514 CD PRO A 341 -5.518 -8.521 -1.906 1.00 0.00 C ATOM 0 HA PRO A 341 -8.422 -7.561 -1.302 1.00 0.00 H new ATOM 0 HB2 PRO A 341 -7.444 -9.736 0.398 1.00 0.00 H new ATOM 0 HB3 PRO A 341 -8.276 -9.882 -1.138 1.00 0.00 H new ATOM 0 HG2 PRO A 341 -5.464 -10.232 -0.580 1.00 0.00 H new ATOM 0 HG3 PRO A 341 -6.321 -10.525 -2.080 1.00 0.00 H new ATOM 0 HD2 PRO A 341 -4.464 -8.437 -1.640 1.00 0.00 H new ATOM 0 HD3 PRO A 341 -5.572 -8.535 -2.995 1.00 0.00 H new ATOM 522 N PRO A 342 -6.774 -7.326 1.547 1.00 0.00 N ATOM 523 CA PRO A 342 -6.887 -6.756 2.911 1.00 0.00 C ATOM 524 C PRO A 342 -7.743 -5.487 2.941 1.00 0.00 C ATOM 525 O PRO A 342 -7.974 -4.858 1.929 1.00 0.00 O ATOM 526 CB PRO A 342 -5.440 -6.439 3.271 1.00 0.00 C ATOM 527 CG PRO A 342 -4.624 -7.464 2.554 1.00 0.00 C ATOM 528 CD PRO A 342 -5.445 -7.939 1.348 1.00 0.00 C ATOM 0 HA PRO A 342 -7.375 -7.439 3.606 1.00 0.00 H new ATOM 0 HB2 PRO A 342 -5.168 -5.431 2.959 1.00 0.00 H new ATOM 0 HB3 PRO A 342 -5.281 -6.493 4.348 1.00 0.00 H new ATOM 0 HG2 PRO A 342 -3.674 -7.040 2.229 1.00 0.00 H new ATOM 0 HG3 PRO A 342 -4.391 -8.300 3.214 1.00 0.00 H new ATOM 0 HD2 PRO A 342 -4.995 -7.617 0.409 1.00 0.00 H new ATOM 0 HD3 PRO A 342 -5.510 -9.027 1.314 1.00 0.00 H new ATOM 536 N LEU A 343 -8.219 -5.113 4.093 1.00 0.00 N ATOM 537 CA LEU A 343 -9.067 -3.895 4.194 1.00 0.00 C ATOM 538 C LEU A 343 -8.672 -3.095 5.437 1.00 0.00 C ATOM 539 O LEU A 343 -7.537 -2.689 5.595 1.00 0.00 O ATOM 540 CB LEU A 343 -10.538 -4.308 4.309 1.00 0.00 C ATOM 541 CG LEU A 343 -10.969 -5.058 3.044 1.00 0.00 C ATOM 542 CD1 LEU A 343 -12.368 -5.642 3.253 1.00 0.00 C ATOM 543 CD2 LEU A 343 -11.001 -4.095 1.852 1.00 0.00 C ATOM 0 H LEU A 343 -8.057 -5.601 4.974 1.00 0.00 H new ATOM 0 HA LEU A 343 -8.924 -3.281 3.305 1.00 0.00 H new ATOM 0 HB2 LEU A 343 -10.679 -4.942 5.184 1.00 0.00 H new ATOM 0 HB3 LEU A 343 -11.163 -3.426 4.450 1.00 0.00 H new ATOM 0 HG LEU A 343 -10.258 -5.859 2.843 1.00 0.00 H new ATOM 0 HD11 LEU A 343 -12.677 -6.176 2.355 1.00 0.00 H new ATOM 0 HD12 LEU A 343 -12.352 -6.331 4.097 1.00 0.00 H new ATOM 0 HD13 LEU A 343 -13.072 -4.835 3.456 1.00 0.00 H new ATOM 0 HD21 LEU A 343 -11.308 -4.635 0.956 1.00 0.00 H new ATOM 0 HD22 LEU A 343 -11.710 -3.291 2.052 1.00 0.00 H new ATOM 0 HD23 LEU A 343 -10.008 -3.673 1.699 1.00 0.00 H new ATOM 555 N HIS A 344 -9.606 -2.867 6.319 1.00 0.00 N ATOM 556 CA HIS A 344 -9.301 -2.094 7.553 1.00 0.00 C ATOM 557 C HIS A 344 -8.131 -2.742 8.297 1.00 0.00 C ATOM 558 O HIS A 344 -7.293 -2.071 8.861 1.00 0.00 O ATOM 559 CB HIS A 344 -10.532 -2.082 8.461 1.00 0.00 C ATOM 560 CG HIS A 344 -11.653 -1.351 7.776 1.00 0.00 C ATOM 561 ND1 HIS A 344 -12.973 -1.463 8.193 1.00 0.00 N ATOM 562 CD2 HIS A 344 -11.672 -0.495 6.702 1.00 0.00 C ATOM 563 CE1 HIS A 344 -13.722 -0.693 7.382 1.00 0.00 C ATOM 564 NE2 HIS A 344 -12.976 -0.084 6.459 1.00 0.00 N ATOM 0 H HIS A 344 -10.572 -3.185 6.236 1.00 0.00 H new ATOM 0 HA HIS A 344 -9.033 -1.073 7.280 1.00 0.00 H new ATOM 0 HB2 HIS A 344 -10.837 -3.103 8.692 1.00 0.00 H new ATOM 0 HB3 HIS A 344 -10.294 -1.599 9.408 1.00 0.00 H new ATOM 0 HD2 HIS A 344 -10.806 -0.189 6.134 1.00 0.00 H new ATOM 0 HE1 HIS A 344 -14.793 -0.582 7.468 1.00 0.00 H new ATOM 0 HE2 HIS A 344 -13.296 0.551 5.728 1.00 0.00 H new ATOM 573 N ASP A 345 -8.074 -4.045 8.311 1.00 0.00 N ATOM 574 CA ASP A 345 -6.965 -4.731 9.031 1.00 0.00 C ATOM 575 C ASP A 345 -5.735 -4.833 8.126 1.00 0.00 C ATOM 576 O ASP A 345 -5.787 -5.392 7.048 1.00 0.00 O ATOM 577 CB ASP A 345 -7.415 -6.135 9.441 1.00 0.00 C ATOM 578 CG ASP A 345 -6.329 -6.790 10.296 1.00 0.00 C ATOM 579 OD1 ASP A 345 -5.364 -6.113 10.613 1.00 0.00 O ATOM 580 OD2 ASP A 345 -6.482 -7.956 10.622 1.00 0.00 O ATOM 0 H ASP A 345 -8.746 -4.663 7.856 1.00 0.00 H new ATOM 0 HA ASP A 345 -6.706 -4.155 9.919 1.00 0.00 H new ATOM 0 HB2 ASP A 345 -8.349 -6.080 10.000 1.00 0.00 H new ATOM 0 HB3 ASP A 345 -7.609 -6.739 8.555 1.00 0.00 H new ATOM 585 N VAL A 346 -4.625 -4.299 8.561 1.00 0.00 N ATOM 586 CA VAL A 346 -3.388 -4.363 7.736 1.00 0.00 C ATOM 587 C VAL A 346 -2.461 -5.461 8.292 1.00 0.00 C ATOM 588 O VAL A 346 -1.987 -5.353 9.406 1.00 0.00 O ATOM 589 CB VAL A 346 -2.666 -3.016 7.815 1.00 0.00 C ATOM 590 CG1 VAL A 346 -1.663 -2.905 6.666 1.00 0.00 C ATOM 591 CG2 VAL A 346 -3.688 -1.882 7.710 1.00 0.00 C ATOM 0 H VAL A 346 -4.523 -3.820 9.456 1.00 0.00 H new ATOM 0 HA VAL A 346 -3.647 -4.588 6.702 1.00 0.00 H new ATOM 0 HB VAL A 346 -2.138 -2.943 8.766 1.00 0.00 H new ATOM 0 HG11 VAL A 346 -1.149 -1.945 6.723 1.00 0.00 H new ATOM 0 HG12 VAL A 346 -0.934 -3.712 6.740 1.00 0.00 H new ATOM 0 HG13 VAL A 346 -2.190 -2.978 5.715 1.00 0.00 H new ATOM 0 HG21 VAL A 346 -3.174 -0.923 7.766 1.00 0.00 H new ATOM 0 HG22 VAL A 346 -4.216 -1.955 6.760 1.00 0.00 H new ATOM 0 HG23 VAL A 346 -4.403 -1.959 8.529 1.00 0.00 H new ATOM 601 N PRO A 347 -2.184 -6.508 7.539 1.00 0.00 N ATOM 602 CA PRO A 347 -1.282 -7.601 8.014 1.00 0.00 C ATOM 603 C PRO A 347 0.094 -7.071 8.433 1.00 0.00 C ATOM 604 O PRO A 347 0.619 -6.148 7.844 1.00 0.00 O ATOM 605 CB PRO A 347 -1.131 -8.530 6.806 1.00 0.00 C ATOM 606 CG PRO A 347 -2.262 -8.210 5.887 1.00 0.00 C ATOM 607 CD PRO A 347 -2.696 -6.775 6.182 1.00 0.00 C ATOM 0 HA PRO A 347 -1.696 -8.097 8.892 1.00 0.00 H new ATOM 0 HB2 PRO A 347 -0.172 -8.373 6.312 1.00 0.00 H new ATOM 0 HB3 PRO A 347 -1.163 -9.575 7.113 1.00 0.00 H new ATOM 0 HG2 PRO A 347 -1.952 -8.312 4.847 1.00 0.00 H new ATOM 0 HG3 PRO A 347 -3.090 -8.901 6.042 1.00 0.00 H new ATOM 0 HD2 PRO A 347 -2.280 -6.077 5.456 1.00 0.00 H new ATOM 0 HD3 PRO A 347 -3.780 -6.671 6.139 1.00 0.00 H new ATOM 615 N LYS A 348 0.679 -7.648 9.448 1.00 0.00 N ATOM 616 CA LYS A 348 2.016 -7.175 9.905 1.00 0.00 C ATOM 617 C LYS A 348 3.028 -7.295 8.764 1.00 0.00 C ATOM 618 O LYS A 348 3.830 -6.410 8.537 1.00 0.00 O ATOM 619 CB LYS A 348 2.483 -8.026 11.086 1.00 0.00 C ATOM 620 CG LYS A 348 3.823 -7.495 11.592 1.00 0.00 C ATOM 621 CD LYS A 348 4.249 -8.276 12.838 1.00 0.00 C ATOM 622 CE LYS A 348 4.553 -9.729 12.462 1.00 0.00 C ATOM 623 NZ LYS A 348 5.714 -10.215 13.261 1.00 0.00 N ATOM 0 H LYS A 348 0.289 -8.426 9.980 1.00 0.00 H new ATOM 0 HA LYS A 348 1.940 -6.132 10.212 1.00 0.00 H new ATOM 0 HB2 LYS A 348 1.742 -7.997 11.885 1.00 0.00 H new ATOM 0 HB3 LYS A 348 2.583 -9.068 10.781 1.00 0.00 H new ATOM 0 HG2 LYS A 348 4.580 -7.591 10.814 1.00 0.00 H new ATOM 0 HG3 LYS A 348 3.740 -6.434 11.827 1.00 0.00 H new ATOM 0 HD2 LYS A 348 5.130 -7.814 13.284 1.00 0.00 H new ATOM 0 HD3 LYS A 348 3.458 -8.243 13.587 1.00 0.00 H new ATOM 0 HE2 LYS A 348 3.681 -10.355 12.650 1.00 0.00 H new ATOM 0 HE3 LYS A 348 4.774 -9.802 11.397 1.00 0.00 H new ATOM 0 HZ1 LYS A 348 5.922 -11.202 13.007 1.00 0.00 H new ATOM 0 HZ2 LYS A 348 6.545 -9.623 13.060 1.00 0.00 H new ATOM 0 HZ3 LYS A 348 5.486 -10.159 14.274 1.00 0.00 H new ATOM 637 N GLY A 349 2.997 -8.380 8.044 1.00 0.00 N ATOM 638 CA GLY A 349 3.958 -8.553 6.917 1.00 0.00 C ATOM 639 C GLY A 349 3.667 -7.512 5.840 1.00 0.00 C ATOM 640 O GLY A 349 2.534 -7.303 5.453 1.00 0.00 O ATOM 0 H GLY A 349 2.349 -9.155 8.186 1.00 0.00 H new ATOM 0 HA2 GLY A 349 4.981 -8.444 7.277 1.00 0.00 H new ATOM 0 HA3 GLY A 349 3.871 -9.557 6.501 1.00 0.00 H new ATOM 644 N ASP A 350 4.680 -6.856 5.349 1.00 0.00 N ATOM 645 CA ASP A 350 4.459 -5.835 4.296 1.00 0.00 C ATOM 646 C ASP A 350 3.944 -6.524 3.034 1.00 0.00 C ATOM 647 O ASP A 350 4.336 -7.629 2.714 1.00 0.00 O ATOM 648 CB ASP A 350 5.781 -5.127 3.997 1.00 0.00 C ATOM 649 CG ASP A 350 6.212 -4.317 5.221 1.00 0.00 C ATOM 650 OD1 ASP A 350 5.390 -4.132 6.103 1.00 0.00 O ATOM 651 OD2 ASP A 350 7.356 -3.897 5.257 1.00 0.00 O ATOM 0 H ASP A 350 5.651 -6.985 5.633 1.00 0.00 H new ATOM 0 HA ASP A 350 3.726 -5.102 4.634 1.00 0.00 H new ATOM 0 HB2 ASP A 350 6.548 -5.858 3.743 1.00 0.00 H new ATOM 0 HB3 ASP A 350 5.668 -4.471 3.134 1.00 0.00 H new ATOM 656 N TRP A 351 3.066 -5.886 2.314 1.00 0.00 N ATOM 657 CA TRP A 351 2.530 -6.513 1.076 1.00 0.00 C ATOM 658 C TRP A 351 3.298 -5.975 -0.127 1.00 0.00 C ATOM 659 O TRP A 351 3.534 -4.789 -0.248 1.00 0.00 O ATOM 660 CB TRP A 351 1.045 -6.177 0.925 1.00 0.00 C ATOM 661 CG TRP A 351 0.412 -7.134 -0.032 1.00 0.00 C ATOM 662 CD1 TRP A 351 0.428 -7.010 -1.379 1.00 0.00 C ATOM 663 CD2 TRP A 351 -0.336 -8.350 0.258 1.00 0.00 C ATOM 664 NE1 TRP A 351 -0.258 -8.075 -1.935 1.00 0.00 N ATOM 665 CE2 TRP A 351 -0.748 -8.928 -0.966 1.00 0.00 C ATOM 666 CE3 TRP A 351 -0.691 -9.002 1.452 1.00 0.00 C ATOM 667 CZ2 TRP A 351 -1.487 -10.111 -1.004 1.00 0.00 C ATOM 668 CZ3 TRP A 351 -1.436 -10.193 1.418 1.00 0.00 C ATOM 669 CH2 TRP A 351 -1.833 -10.746 0.192 1.00 0.00 C ATOM 0 H TRP A 351 2.697 -4.960 2.529 1.00 0.00 H new ATOM 0 HA TRP A 351 2.646 -7.595 1.136 1.00 0.00 H new ATOM 0 HB2 TRP A 351 0.548 -6.233 1.894 1.00 0.00 H new ATOM 0 HB3 TRP A 351 0.927 -5.155 0.565 1.00 0.00 H new ATOM 0 HD1 TRP A 351 0.899 -6.210 -1.930 1.00 0.00 H new ATOM 0 HE1 TRP A 351 -0.386 -8.213 -2.937 1.00 0.00 H new ATOM 0 HE3 TRP A 351 -0.389 -8.585 2.401 1.00 0.00 H new ATOM 0 HZ2 TRP A 351 -1.790 -10.533 -1.951 1.00 0.00 H new ATOM 0 HZ3 TRP A 351 -1.704 -10.685 2.341 1.00 0.00 H new ATOM 0 HH2 TRP A 351 -2.405 -11.662 0.172 1.00 0.00 H new ATOM 680 N ARG A 352 3.691 -6.842 -1.012 1.00 0.00 N ATOM 681 CA ARG A 352 4.449 -6.402 -2.211 1.00 0.00 C ATOM 682 C ARG A 352 3.577 -6.576 -3.449 1.00 0.00 C ATOM 683 O ARG A 352 2.914 -7.581 -3.619 1.00 0.00 O ATOM 684 CB ARG A 352 5.705 -7.261 -2.336 1.00 0.00 C ATOM 685 CG ARG A 352 6.631 -6.969 -1.156 1.00 0.00 C ATOM 686 CD ARG A 352 7.796 -7.954 -1.172 1.00 0.00 C ATOM 687 NE ARG A 352 8.775 -7.586 -0.110 1.00 0.00 N ATOM 688 CZ ARG A 352 8.522 -7.873 1.138 1.00 0.00 C ATOM 689 NH1 ARG A 352 7.411 -8.482 1.455 1.00 0.00 N ATOM 690 NH2 ARG A 352 9.379 -7.553 2.068 1.00 0.00 N ATOM 0 H ARG A 352 3.518 -7.846 -0.956 1.00 0.00 H new ATOM 0 HA ARG A 352 4.729 -5.353 -2.117 1.00 0.00 H new ATOM 0 HB2 ARG A 352 5.438 -8.318 -2.352 1.00 0.00 H new ATOM 0 HB3 ARG A 352 6.215 -7.047 -3.276 1.00 0.00 H new ATOM 0 HG2 ARG A 352 7.004 -5.946 -1.216 1.00 0.00 H new ATOM 0 HG3 ARG A 352 6.082 -7.053 -0.218 1.00 0.00 H new ATOM 0 HD2 ARG A 352 7.431 -8.968 -1.009 1.00 0.00 H new ATOM 0 HD3 ARG A 352 8.281 -7.943 -2.148 1.00 0.00 H new ATOM 0 HE ARG A 352 9.642 -7.110 -0.358 1.00 0.00 H new ATOM 0 HH11 ARG A 352 6.742 -8.733 0.728 1.00 0.00 H new ATOM 0 HH12 ARG A 352 7.213 -8.707 2.430 1.00 0.00 H new ATOM 0 HH21 ARG A 352 10.247 -7.078 1.820 1.00 0.00 H new ATOM 0 HH22 ARG A 352 9.181 -7.777 3.043 1.00 0.00 H new ATOM 704 N CYS A 353 3.571 -5.606 -4.313 1.00 0.00 N ATOM 705 CA CYS A 353 2.740 -5.711 -5.539 1.00 0.00 C ATOM 706 C CYS A 353 3.250 -6.900 -6.371 1.00 0.00 C ATOM 707 O CYS A 353 4.393 -7.283 -6.271 1.00 0.00 O ATOM 708 CB CYS A 353 2.840 -4.408 -6.339 1.00 0.00 C ATOM 709 SG CYS A 353 3.668 -3.139 -5.343 1.00 0.00 S ATOM 0 H CYS A 353 4.107 -4.743 -4.223 1.00 0.00 H new ATOM 0 HA CYS A 353 1.694 -5.873 -5.279 1.00 0.00 H new ATOM 0 HB2 CYS A 353 3.395 -4.579 -7.262 1.00 0.00 H new ATOM 0 HB3 CYS A 353 1.844 -4.068 -6.624 1.00 0.00 H new ATOM 714 N PRO A 354 2.411 -7.512 -7.163 1.00 0.00 N ATOM 715 CA PRO A 354 2.822 -8.692 -7.976 1.00 0.00 C ATOM 716 C PRO A 354 4.139 -8.473 -8.738 1.00 0.00 C ATOM 717 O PRO A 354 4.924 -9.387 -8.900 1.00 0.00 O ATOM 718 CB PRO A 354 1.676 -8.872 -8.974 1.00 0.00 C ATOM 719 CG PRO A 354 0.485 -8.196 -8.374 1.00 0.00 C ATOM 720 CD PRO A 354 0.996 -7.161 -7.369 1.00 0.00 C ATOM 0 HA PRO A 354 3.000 -9.557 -7.337 1.00 0.00 H new ATOM 0 HB2 PRO A 354 1.928 -8.431 -9.939 1.00 0.00 H new ATOM 0 HB3 PRO A 354 1.476 -9.929 -9.149 1.00 0.00 H new ATOM 0 HG2 PRO A 354 -0.112 -7.715 -9.148 1.00 0.00 H new ATOM 0 HG3 PRO A 354 -0.159 -8.923 -7.880 1.00 0.00 H new ATOM 0 HD2 PRO A 354 0.891 -6.147 -7.756 1.00 0.00 H new ATOM 0 HD3 PRO A 354 0.436 -7.205 -6.435 1.00 0.00 H new ATOM 728 N LYS A 355 4.393 -7.281 -9.208 1.00 0.00 N ATOM 729 CA LYS A 355 5.656 -7.037 -9.971 1.00 0.00 C ATOM 730 C LYS A 355 6.873 -7.385 -9.111 1.00 0.00 C ATOM 731 O LYS A 355 7.791 -8.044 -9.557 1.00 0.00 O ATOM 732 CB LYS A 355 5.733 -5.563 -10.370 1.00 0.00 C ATOM 733 CG LYS A 355 5.960 -4.715 -9.119 1.00 0.00 C ATOM 734 CD LYS A 355 5.674 -3.246 -9.438 1.00 0.00 C ATOM 735 CE LYS A 355 6.708 -2.728 -10.440 1.00 0.00 C ATOM 736 NZ LYS A 355 6.612 -1.244 -10.531 1.00 0.00 N ATOM 0 H LYS A 355 3.786 -6.469 -9.099 1.00 0.00 H new ATOM 0 HA LYS A 355 5.655 -7.666 -10.861 1.00 0.00 H new ATOM 0 HB2 LYS A 355 6.545 -5.408 -11.081 1.00 0.00 H new ATOM 0 HB3 LYS A 355 4.812 -5.260 -10.867 1.00 0.00 H new ATOM 0 HG2 LYS A 355 5.310 -5.056 -8.313 1.00 0.00 H new ATOM 0 HG3 LYS A 355 6.987 -4.829 -8.771 1.00 0.00 H new ATOM 0 HD2 LYS A 355 4.670 -3.141 -9.849 1.00 0.00 H new ATOM 0 HD3 LYS A 355 5.708 -2.652 -8.525 1.00 0.00 H new ATOM 0 HE2 LYS A 355 7.711 -3.020 -10.128 1.00 0.00 H new ATOM 0 HE3 LYS A 355 6.537 -3.175 -11.419 1.00 0.00 H new ATOM 0 HZ1 LYS A 355 7.315 -0.892 -11.212 1.00 0.00 H new ATOM 0 HZ2 LYS A 355 5.658 -0.977 -10.848 1.00 0.00 H new ATOM 0 HZ3 LYS A 355 6.796 -0.826 -9.597 1.00 0.00 H new ATOM 750 N CYS A 356 6.889 -6.946 -7.889 1.00 0.00 N ATOM 751 CA CYS A 356 8.047 -7.246 -7.003 1.00 0.00 C ATOM 752 C CYS A 356 8.017 -8.725 -6.611 1.00 0.00 C ATOM 753 O CYS A 356 9.043 -9.360 -6.465 1.00 0.00 O ATOM 754 CB CYS A 356 7.969 -6.373 -5.748 1.00 0.00 C ATOM 755 SG CYS A 356 6.291 -5.720 -5.592 1.00 0.00 S ATOM 0 H CYS A 356 6.149 -6.390 -7.461 1.00 0.00 H new ATOM 0 HA CYS A 356 8.977 -7.033 -7.530 1.00 0.00 H new ATOM 0 HB2 CYS A 356 8.230 -6.957 -4.866 1.00 0.00 H new ATOM 0 HB3 CYS A 356 8.687 -5.556 -5.812 1.00 0.00 H new ATOM 760 N LEU A 357 6.847 -9.276 -6.433 1.00 0.00 N ATOM 761 CA LEU A 357 6.751 -10.711 -6.045 1.00 0.00 C ATOM 762 C LEU A 357 7.385 -11.581 -7.131 1.00 0.00 C ATOM 763 O LEU A 357 8.020 -12.578 -6.850 1.00 0.00 O ATOM 764 CB LEU A 357 5.280 -11.093 -5.869 1.00 0.00 C ATOM 765 CG LEU A 357 5.184 -12.533 -5.360 1.00 0.00 C ATOM 766 CD1 LEU A 357 5.747 -12.619 -3.938 1.00 0.00 C ATOM 767 CD2 LEU A 357 3.718 -12.972 -5.352 1.00 0.00 C ATOM 0 H LEU A 357 5.954 -8.794 -6.540 1.00 0.00 H new ATOM 0 HA LEU A 357 7.281 -10.870 -5.106 1.00 0.00 H new ATOM 0 HB2 LEU A 357 4.799 -10.414 -5.165 1.00 0.00 H new ATOM 0 HB3 LEU A 357 4.752 -10.995 -6.817 1.00 0.00 H new ATOM 0 HG LEU A 357 5.760 -13.186 -6.016 1.00 0.00 H new ATOM 0 HD11 LEU A 357 5.676 -13.646 -3.580 1.00 0.00 H new ATOM 0 HD12 LEU A 357 6.791 -12.307 -3.941 1.00 0.00 H new ATOM 0 HD13 LEU A 357 5.175 -11.965 -3.280 1.00 0.00 H new ATOM 0 HD21 LEU A 357 3.647 -13.998 -4.990 1.00 0.00 H new ATOM 0 HD22 LEU A 357 3.145 -12.316 -4.697 1.00 0.00 H new ATOM 0 HD23 LEU A 357 3.316 -12.916 -6.364 1.00 0.00 H new ATOM 779 N ALA A 358 7.218 -11.213 -8.370 1.00 0.00 N ATOM 780 CA ALA A 358 7.813 -12.021 -9.474 1.00 0.00 C ATOM 781 C ALA A 358 9.337 -12.028 -9.333 1.00 0.00 C ATOM 782 O ALA A 358 9.996 -12.991 -9.669 1.00 0.00 O ATOM 783 CB ALA A 358 7.427 -11.409 -10.821 1.00 0.00 C ATOM 0 H ALA A 358 6.696 -10.389 -8.667 1.00 0.00 H new ATOM 0 HA ALA A 358 7.437 -13.043 -9.421 1.00 0.00 H new ATOM 0 HB1 ALA A 358 7.862 -12.000 -11.627 1.00 0.00 H new ATOM 0 HB2 ALA A 358 6.342 -11.403 -10.920 1.00 0.00 H new ATOM 0 HB3 ALA A 358 7.802 -10.387 -10.877 1.00 0.00 H new ATOM 789 N GLN A 359 9.899 -10.961 -8.837 1.00 0.00 N ATOM 790 CA GLN A 359 11.380 -10.906 -8.673 1.00 0.00 C ATOM 791 C GLN A 359 11.832 -12.038 -7.749 1.00 0.00 C ATOM 792 O GLN A 359 12.893 -12.606 -7.918 1.00 0.00 O ATOM 793 CB GLN A 359 11.776 -9.559 -8.066 1.00 0.00 C ATOM 794 CG GLN A 359 11.425 -8.436 -9.042 1.00 0.00 C ATOM 795 CD GLN A 359 11.776 -7.085 -8.416 1.00 0.00 C ATOM 796 OE1 GLN A 359 11.998 -6.993 -7.225 1.00 0.00 O ATOM 797 NE2 GLN A 359 11.837 -6.024 -9.174 1.00 0.00 N ATOM 0 H GLN A 359 9.398 -10.125 -8.538 1.00 0.00 H new ATOM 0 HA GLN A 359 11.859 -11.019 -9.646 1.00 0.00 H new ATOM 0 HB2 GLN A 359 11.257 -9.408 -7.120 1.00 0.00 H new ATOM 0 HB3 GLN A 359 12.844 -9.546 -7.849 1.00 0.00 H new ATOM 0 HG2 GLN A 359 11.971 -8.568 -9.976 1.00 0.00 H new ATOM 0 HG3 GLN A 359 10.363 -8.471 -9.286 1.00 0.00 H new ATOM 0 HE21 GLN A 359 11.651 -6.100 -10.174 1.00 0.00 H new ATOM 0 HE22 GLN A 359 12.071 -5.119 -8.766 1.00 0.00 H new ATOM 806 N GLU A 360 11.034 -12.368 -6.771 1.00 0.00 N ATOM 807 CA GLU A 360 11.415 -13.463 -5.835 1.00 0.00 C ATOM 808 C GLU A 360 11.955 -14.652 -6.632 1.00 0.00 C ATOM 809 O GLU A 360 13.162 -14.735 -6.791 1.00 0.00 O ATOM 810 CB GLU A 360 10.186 -13.900 -5.035 1.00 0.00 C ATOM 811 CG GLU A 360 10.602 -14.924 -3.977 1.00 0.00 C ATOM 812 CD GLU A 360 9.360 -15.435 -3.244 1.00 0.00 C ATOM 813 OE1 GLU A 360 8.273 -15.009 -3.595 1.00 0.00 O ATOM 814 OE2 GLU A 360 9.518 -16.244 -2.345 1.00 0.00 O ATOM 815 OXT GLU A 360 11.152 -15.458 -7.071 1.00 0.00 O ATOM 0 H GLU A 360 10.135 -11.927 -6.580 1.00 0.00 H new ATOM 0 HA GLU A 360 12.185 -13.105 -5.152 1.00 0.00 H new ATOM 0 HB2 GLU A 360 9.724 -13.036 -4.558 1.00 0.00 H new ATOM 0 HB3 GLU A 360 9.440 -14.333 -5.702 1.00 0.00 H new ATOM 0 HG2 GLU A 360 11.127 -15.755 -4.447 1.00 0.00 H new ATOM 0 HG3 GLU A 360 11.294 -14.469 -3.268 1.00 0.00 H new TER 822 GLU A 360 HETATM 823 ZN ZN A 401 -6.205 4.607 -2.559 1.00 0.00 ZN HETATM 824 ZN ZN A 402 5.908 -3.542 -4.986 1.00 0.00 ZN