USER MOD reduce.3.24.130724 H: found=0, std=0, add=593, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 594 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 272 LYS NZ :NH3+ -144:sc= 0.117 (180deg=0) USER MOD Set 1.2: A 276 HIS : no HE2:sc= -4.7! C(o=-4.6!,f=-6.7!) USER MOD Single : A 220 SER OG : rot 180:sc= 0 USER MOD Single : A 221 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 222 THR OG1 : rot 180:sc= 0.00231 USER MOD Single : A 227 LYS NZ :NH3+ -128:sc= 0 (180deg=-1.22) USER MOD Single : A 228 ASN : amide:sc= -1.25 K(o=-1.3,f=-1.9) USER MOD Single : A 233 THR OG1 : rot 84:sc= 1.23 USER MOD Single : A 239 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 241 THR OG1 : rot 99:sc= 1.32 USER MOD Single : A 243 SER OG : rot 180:sc= 0 USER MOD Single : A 247 SER OG : rot 180:sc= 0 USER MOD Single : A 259 THR OG1 : rot 180:sc= 0 USER MOD Single : A 279 TYR OH : rot 180:sc= 0 USER MOD Single : A 280 SER OG : rot 180:sc= 0 USER MOD Single : A 281 LYS NZ :NH3+ 167:sc=-0.00168 (180deg=-0.106) USER MOD Single : A 283 HIS : no HD1:sc= -9.05! C(o=-9!,f=-9.8!) USER MOD Single : A 284 HIS : no HD1:sc= -1.28 K(o=-1.3,f=-0.46) USER MOD Single : A 288 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 90 N SER A 220 -9.226 14.702 -0.347 1.00 0.00 N ATOM 91 CA SER A 220 -8.022 14.682 -1.170 1.00 0.00 C ATOM 92 C SER A 220 -8.207 13.771 -2.381 1.00 0.00 C ATOM 93 O SER A 220 -9.005 12.834 -2.351 1.00 0.00 O ATOM 94 CB SER A 220 -6.822 14.215 -0.345 1.00 0.00 C ATOM 95 OG SER A 220 -5.605 14.666 -0.914 1.00 0.00 O ATOM 0 HA SER A 220 -7.837 15.696 -1.524 1.00 0.00 H new ATOM 0 HB2 SER A 220 -6.911 14.589 0.675 1.00 0.00 H new ATOM 0 HB3 SER A 220 -6.818 13.127 -0.287 1.00 0.00 H new ATOM 0 HG SER A 220 -4.853 14.356 -0.367 1.00 0.00 H new ATOM 101 N LYS A 221 -7.464 14.055 -3.445 1.00 0.00 N ATOM 102 CA LYS A 221 -7.543 13.262 -4.667 1.00 0.00 C ATOM 103 C LYS A 221 -6.274 12.440 -4.865 1.00 0.00 C ATOM 104 O LYS A 221 -6.284 11.419 -5.553 1.00 0.00 O ATOM 105 CB LYS A 221 -7.768 14.173 -5.876 1.00 0.00 C ATOM 106 CG LYS A 221 -9.186 14.709 -5.978 1.00 0.00 C ATOM 107 CD LYS A 221 -9.425 15.845 -4.998 1.00 0.00 C ATOM 108 CE LYS A 221 -8.745 17.127 -5.455 1.00 0.00 C ATOM 109 NZ LYS A 221 -9.609 17.914 -6.379 1.00 0.00 N ATOM 0 H LYS A 221 -6.800 14.828 -3.486 1.00 0.00 H new ATOM 0 HA LYS A 221 -8.386 12.578 -4.573 1.00 0.00 H new ATOM 0 HB2 LYS A 221 -7.074 15.012 -5.822 1.00 0.00 H new ATOM 0 HB3 LYS A 221 -7.531 13.621 -6.785 1.00 0.00 H new ATOM 0 HG2 LYS A 221 -9.372 15.058 -6.994 1.00 0.00 H new ATOM 0 HG3 LYS A 221 -9.895 13.904 -5.783 1.00 0.00 H new ATOM 0 HD2 LYS A 221 -10.496 16.017 -4.893 1.00 0.00 H new ATOM 0 HD3 LYS A 221 -9.050 15.563 -4.014 1.00 0.00 H new ATOM 0 HE2 LYS A 221 -8.494 17.735 -4.586 1.00 0.00 H new ATOM 0 HE3 LYS A 221 -7.807 16.883 -5.954 1.00 0.00 H new ATOM 0 HZ1 LYS A 221 -9.110 18.780 -6.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 221 -9.828 17.343 -7.221 1.00 0.00 H new ATOM 0 HZ3 LYS A 221 -10.493 18.169 -5.895 1.00 0.00 H new ATOM 123 N THR A 222 -5.181 12.891 -4.257 1.00 0.00 N ATOM 124 CA THR A 222 -3.904 12.198 -4.367 1.00 0.00 C ATOM 125 C THR A 222 -3.695 11.241 -3.198 1.00 0.00 C ATOM 126 O THR A 222 -3.032 10.213 -3.334 1.00 0.00 O ATOM 127 CB THR A 222 -2.728 13.191 -4.419 1.00 0.00 C ATOM 128 OG1 THR A 222 -2.835 14.134 -3.346 1.00 0.00 O ATOM 129 CG2 THR A 222 -2.701 13.929 -5.748 1.00 0.00 C ATOM 0 H THR A 222 -5.155 13.734 -3.683 1.00 0.00 H new ATOM 0 HA THR A 222 -3.932 11.631 -5.297 1.00 0.00 H new ATOM 0 HB THR A 222 -1.801 12.627 -4.316 1.00 0.00 H new ATOM 0 HG1 THR A 222 -2.083 14.761 -3.385 1.00 0.00 H new ATOM 0 HG21 THR A 222 -1.862 14.625 -5.761 1.00 0.00 H new ATOM 0 HG22 THR A 222 -2.590 13.211 -6.561 1.00 0.00 H new ATOM 0 HG23 THR A 222 -3.632 14.481 -5.877 1.00 0.00 H new ATOM 137 N VAL A 223 -4.267 11.586 -2.048 1.00 0.00 N ATOM 138 CA VAL A 223 -4.145 10.757 -0.855 1.00 0.00 C ATOM 139 C VAL A 223 -5.329 9.806 -0.723 1.00 0.00 C ATOM 140 O VAL A 223 -6.485 10.232 -0.736 1.00 0.00 O ATOM 141 CB VAL A 223 -4.047 11.617 0.419 1.00 0.00 C ATOM 142 CG1 VAL A 223 -3.926 10.734 1.651 1.00 0.00 C ATOM 143 CG2 VAL A 223 -2.871 12.577 0.324 1.00 0.00 C ATOM 0 H VAL A 223 -4.819 12.434 -1.918 1.00 0.00 H new ATOM 0 HA VAL A 223 -3.228 10.178 -0.965 1.00 0.00 H new ATOM 0 HB VAL A 223 -4.960 12.205 0.511 1.00 0.00 H new ATOM 0 HG11 VAL A 223 -3.858 11.359 2.541 1.00 0.00 H new ATOM 0 HG12 VAL A 223 -4.803 10.091 1.725 1.00 0.00 H new ATOM 0 HG13 VAL A 223 -3.030 10.118 1.571 1.00 0.00 H new ATOM 0 HG21 VAL A 223 -2.817 13.177 1.232 1.00 0.00 H new ATOM 0 HG22 VAL A 223 -1.947 12.010 0.208 1.00 0.00 H new ATOM 0 HG23 VAL A 223 -3.005 13.233 -0.536 1.00 0.00 H new ATOM 153 N ILE A 224 -5.035 8.516 -0.597 1.00 0.00 N ATOM 154 CA ILE A 224 -6.076 7.505 -0.461 1.00 0.00 C ATOM 155 C ILE A 224 -5.810 6.600 0.737 1.00 0.00 C ATOM 156 O ILE A 224 -4.672 6.200 0.986 1.00 0.00 O ATOM 157 CB ILE A 224 -6.188 6.639 -1.730 1.00 0.00 C ATOM 158 CG1 ILE A 224 -6.379 7.525 -2.963 1.00 0.00 C ATOM 159 CG2 ILE A 224 -7.339 5.653 -1.597 1.00 0.00 C ATOM 160 CD1 ILE A 224 -6.026 6.836 -4.262 1.00 0.00 C ATOM 0 H ILE A 224 -4.084 8.147 -0.586 1.00 0.00 H new ATOM 0 HA ILE A 224 -7.015 8.037 -0.310 1.00 0.00 H new ATOM 0 HB ILE A 224 -5.263 6.075 -1.851 1.00 0.00 H new ATOM 0 HG12 ILE A 224 -7.417 7.855 -3.006 1.00 0.00 H new ATOM 0 HG13 ILE A 224 -5.765 8.419 -2.857 1.00 0.00 H new ATOM 0 HG21 ILE A 224 -7.406 5.048 -2.501 1.00 0.00 H new ATOM 0 HG22 ILE A 224 -7.165 5.004 -0.738 1.00 0.00 H new ATOM 0 HG23 ILE A 224 -8.272 6.199 -1.456 1.00 0.00 H new ATOM 0 HD11 ILE A 224 -6.185 7.523 -5.093 1.00 0.00 H new ATOM 0 HD12 ILE A 224 -4.980 6.530 -4.239 1.00 0.00 H new ATOM 0 HD13 ILE A 224 -6.658 5.957 -4.391 1.00 0.00 H new ATOM 172 N LEU A 225 -6.866 6.279 1.475 1.00 0.00 N ATOM 173 CA LEU A 225 -6.748 5.418 2.647 1.00 0.00 C ATOM 174 C LEU A 225 -7.299 4.025 2.357 1.00 0.00 C ATOM 175 O LEU A 225 -8.454 3.874 1.960 1.00 0.00 O ATOM 176 CB LEU A 225 -7.489 6.035 3.834 1.00 0.00 C ATOM 177 CG LEU A 225 -7.052 7.443 4.239 1.00 0.00 C ATOM 178 CD1 LEU A 225 -8.038 8.045 5.228 1.00 0.00 C ATOM 179 CD2 LEU A 225 -5.650 7.417 4.831 1.00 0.00 C ATOM 0 H LEU A 225 -7.814 6.602 1.283 1.00 0.00 H new ATOM 0 HA LEU A 225 -5.691 5.326 2.895 1.00 0.00 H new ATOM 0 HB2 LEU A 225 -8.553 6.060 3.599 1.00 0.00 H new ATOM 0 HB3 LEU A 225 -7.368 5.377 4.694 1.00 0.00 H new ATOM 0 HG LEU A 225 -7.037 8.068 3.346 1.00 0.00 H new ATOM 0 HD11 LEU A 225 -7.710 9.047 5.504 1.00 0.00 H new ATOM 0 HD12 LEU A 225 -9.025 8.100 4.770 1.00 0.00 H new ATOM 0 HD13 LEU A 225 -8.086 7.420 6.120 1.00 0.00 H new ATOM 0 HD21 LEU A 225 -5.356 8.428 5.114 1.00 0.00 H new ATOM 0 HD22 LEU A 225 -5.639 6.776 5.713 1.00 0.00 H new ATOM 0 HD23 LEU A 225 -4.950 7.029 4.091 1.00 0.00 H new ATOM 191 N ALA A 226 -6.466 3.010 2.561 1.00 0.00 N ATOM 192 CA ALA A 226 -6.871 1.630 2.326 1.00 0.00 C ATOM 193 C ALA A 226 -7.195 0.922 3.638 1.00 0.00 C ATOM 194 O ALA A 226 -6.368 0.872 4.549 1.00 0.00 O ATOM 195 CB ALA A 226 -5.780 0.881 1.575 1.00 0.00 C ATOM 0 H ALA A 226 -5.506 3.118 2.889 1.00 0.00 H new ATOM 0 HA ALA A 226 -7.775 1.641 1.717 1.00 0.00 H new ATOM 0 HB1 ALA A 226 -6.096 -0.149 1.406 1.00 0.00 H new ATOM 0 HB2 ALA A 226 -5.599 1.367 0.616 1.00 0.00 H new ATOM 0 HB3 ALA A 226 -4.863 0.887 2.164 1.00 0.00 H new ATOM 201 N LYS A 227 -8.403 0.377 3.728 1.00 0.00 N ATOM 202 CA LYS A 227 -8.837 -0.329 4.927 1.00 0.00 C ATOM 203 C LYS A 227 -9.009 -1.818 4.650 1.00 0.00 C ATOM 204 O LYS A 227 -8.986 -2.251 3.498 1.00 0.00 O ATOM 205 CB LYS A 227 -10.153 0.260 5.442 1.00 0.00 C ATOM 206 CG LYS A 227 -9.978 1.555 6.216 1.00 0.00 C ATOM 207 CD LYS A 227 -11.190 2.460 6.070 1.00 0.00 C ATOM 208 CE LYS A 227 -10.897 3.868 6.564 1.00 0.00 C ATOM 209 NZ LYS A 227 -10.210 4.688 5.528 1.00 0.00 N ATOM 0 H LYS A 227 -9.100 0.411 2.984 1.00 0.00 H new ATOM 0 HA LYS A 227 -8.067 -0.206 5.689 1.00 0.00 H new ATOM 0 HB2 LYS A 227 -10.817 0.439 4.596 1.00 0.00 H new ATOM 0 HB3 LYS A 227 -10.643 -0.473 6.083 1.00 0.00 H new ATOM 0 HG2 LYS A 227 -9.815 1.331 7.270 1.00 0.00 H new ATOM 0 HG3 LYS A 227 -9.089 2.076 5.860 1.00 0.00 H new ATOM 0 HD2 LYS A 227 -11.494 2.496 5.024 1.00 0.00 H new ATOM 0 HD3 LYS A 227 -12.026 2.043 6.631 1.00 0.00 H new ATOM 0 HE2 LYS A 227 -11.830 4.353 6.852 1.00 0.00 H new ATOM 0 HE3 LYS A 227 -10.275 3.817 7.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 227 -9.351 5.111 5.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 227 -9.951 4.083 4.722 1.00 0.00 H new ATOM 0 HZ3 LYS A 227 -10.848 5.443 5.203 1.00 0.00 H new ATOM 223 N ASN A 228 -9.182 -2.598 5.712 1.00 0.00 N ATOM 224 CA ASN A 228 -9.358 -4.040 5.582 1.00 0.00 C ATOM 225 C ASN A 228 -8.102 -4.692 5.015 1.00 0.00 C ATOM 226 O ASN A 228 -8.156 -5.396 4.005 1.00 0.00 O ATOM 227 CB ASN A 228 -10.558 -4.348 4.684 1.00 0.00 C ATOM 228 CG ASN A 228 -11.847 -4.493 5.469 1.00 0.00 C ATOM 229 OD1 ASN A 228 -12.474 -3.501 5.842 1.00 0.00 O ATOM 230 ND2 ASN A 228 -12.248 -5.733 5.725 1.00 0.00 N ATOM 0 H ASN A 228 -9.204 -2.256 6.673 1.00 0.00 H new ATOM 0 HA ASN A 228 -9.541 -4.451 6.575 1.00 0.00 H new ATOM 0 HB2 ASN A 228 -10.672 -3.551 3.949 1.00 0.00 H new ATOM 0 HB3 ASN A 228 -10.368 -5.268 4.131 1.00 0.00 H new ATOM 0 HD21 ASN A 228 -13.108 -5.893 6.250 1.00 0.00 H new ATOM 0 HD22 ASN A 228 -11.696 -6.525 5.396 1.00 0.00 H new ATOM 237 N LEU A 229 -6.971 -4.455 5.670 1.00 0.00 N ATOM 238 CA LEU A 229 -5.700 -5.021 5.232 1.00 0.00 C ATOM 239 C LEU A 229 -5.158 -6.007 6.262 1.00 0.00 C ATOM 240 O LEU A 229 -5.081 -5.715 7.456 1.00 0.00 O ATOM 241 CB LEU A 229 -4.680 -3.906 4.990 1.00 0.00 C ATOM 242 CG LEU A 229 -4.960 -2.986 3.801 1.00 0.00 C ATOM 243 CD1 LEU A 229 -4.163 -1.697 3.925 1.00 0.00 C ATOM 244 CD2 LEU A 229 -4.636 -3.692 2.493 1.00 0.00 C ATOM 0 H LEU A 229 -6.908 -3.875 6.506 1.00 0.00 H new ATOM 0 HA LEU A 229 -5.872 -5.558 4.299 1.00 0.00 H new ATOM 0 HB2 LEU A 229 -4.620 -3.295 5.890 1.00 0.00 H new ATOM 0 HB3 LEU A 229 -3.700 -4.362 4.848 1.00 0.00 H new ATOM 0 HG LEU A 229 -6.021 -2.735 3.802 1.00 0.00 H new ATOM 0 HD11 LEU A 229 -4.375 -1.055 3.070 1.00 0.00 H new ATOM 0 HD12 LEU A 229 -4.444 -1.183 4.844 1.00 0.00 H new ATOM 0 HD13 LEU A 229 -3.098 -1.929 3.950 1.00 0.00 H new ATOM 0 HD21 LEU A 229 -4.841 -3.023 1.658 1.00 0.00 H new ATOM 0 HD22 LEU A 229 -3.583 -3.973 2.482 1.00 0.00 H new ATOM 0 HD23 LEU A 229 -5.251 -4.587 2.400 1.00 0.00 H new ATOM 256 N PRO A 230 -4.771 -7.202 5.791 1.00 0.00 N ATOM 257 CA PRO A 230 -4.227 -8.254 6.655 1.00 0.00 C ATOM 258 C PRO A 230 -2.842 -7.907 7.190 1.00 0.00 C ATOM 259 O PRO A 230 -1.988 -7.412 6.454 1.00 0.00 O ATOM 260 CB PRO A 230 -4.153 -9.470 5.728 1.00 0.00 C ATOM 261 CG PRO A 230 -4.044 -8.896 4.358 1.00 0.00 C ATOM 262 CD PRO A 230 -4.835 -7.617 4.380 1.00 0.00 C ATOM 0 HA PRO A 230 -4.842 -8.412 7.541 1.00 0.00 H new ATOM 0 HB2 PRO A 230 -3.293 -10.096 5.964 1.00 0.00 H new ATOM 0 HB3 PRO A 230 -5.040 -10.097 5.825 1.00 0.00 H new ATOM 0 HG2 PRO A 230 -3.003 -8.706 4.096 1.00 0.00 H new ATOM 0 HG3 PRO A 230 -4.439 -9.587 3.613 1.00 0.00 H new ATOM 0 HD2 PRO A 230 -4.402 -6.865 3.720 1.00 0.00 H new ATOM 0 HD3 PRO A 230 -5.863 -7.774 4.053 1.00 0.00 H new ATOM 270 N ALA A 231 -2.626 -8.169 8.474 1.00 0.00 N ATOM 271 CA ALA A 231 -1.344 -7.886 9.107 1.00 0.00 C ATOM 272 C ALA A 231 -0.185 -8.279 8.197 1.00 0.00 C ATOM 273 O ALA A 231 0.850 -7.613 8.170 1.00 0.00 O ATOM 274 CB ALA A 231 -1.241 -8.613 10.439 1.00 0.00 C ATOM 0 H ALA A 231 -3.323 -8.577 9.097 1.00 0.00 H new ATOM 0 HA ALA A 231 -1.284 -6.813 9.286 1.00 0.00 H new ATOM 0 HB1 ALA A 231 -0.278 -8.392 10.900 1.00 0.00 H new ATOM 0 HB2 ALA A 231 -2.044 -8.281 11.098 1.00 0.00 H new ATOM 0 HB3 ALA A 231 -1.327 -9.687 10.275 1.00 0.00 H new ATOM 280 N GLY A 232 -0.365 -9.365 7.452 1.00 0.00 N ATOM 281 CA GLY A 232 0.675 -9.828 6.551 1.00 0.00 C ATOM 282 C GLY A 232 1.191 -8.727 5.647 1.00 0.00 C ATOM 283 O GLY A 232 2.390 -8.641 5.381 1.00 0.00 O ATOM 0 H GLY A 232 -1.212 -9.933 7.456 1.00 0.00 H new ATOM 0 HA2 GLY A 232 1.502 -10.233 7.134 1.00 0.00 H new ATOM 0 HA3 GLY A 232 0.286 -10.643 5.940 1.00 0.00 H new ATOM 287 N THR A 233 0.283 -7.881 5.169 1.00 0.00 N ATOM 288 CA THR A 233 0.652 -6.782 4.286 1.00 0.00 C ATOM 289 C THR A 233 1.881 -6.046 4.809 1.00 0.00 C ATOM 290 O THR A 233 2.164 -6.063 6.007 1.00 0.00 O ATOM 291 CB THR A 233 -0.505 -5.777 4.127 1.00 0.00 C ATOM 292 OG1 THR A 233 -1.740 -6.477 3.943 1.00 0.00 O ATOM 293 CG2 THR A 233 -0.259 -4.852 2.944 1.00 0.00 C ATOM 0 H THR A 233 -0.714 -7.937 5.379 1.00 0.00 H new ATOM 0 HA THR A 233 0.880 -7.220 3.314 1.00 0.00 H new ATOM 0 HB THR A 233 -0.561 -5.175 5.034 1.00 0.00 H new ATOM 0 HG1 THR A 233 -2.109 -6.725 4.816 1.00 0.00 H new ATOM 0 HG21 THR A 233 -1.089 -4.151 2.851 1.00 0.00 H new ATOM 0 HG22 THR A 233 0.667 -4.299 3.101 1.00 0.00 H new ATOM 0 HG23 THR A 233 -0.179 -5.442 2.031 1.00 0.00 H new ATOM 301 N LEU A 234 2.606 -5.400 3.903 1.00 0.00 N ATOM 302 CA LEU A 234 3.806 -4.656 4.273 1.00 0.00 C ATOM 303 C LEU A 234 3.949 -3.397 3.424 1.00 0.00 C ATOM 304 O LEU A 234 3.576 -3.380 2.252 1.00 0.00 O ATOM 305 CB LEU A 234 5.046 -5.537 4.111 1.00 0.00 C ATOM 306 CG LEU A 234 5.137 -6.746 5.043 1.00 0.00 C ATOM 307 CD1 LEU A 234 6.279 -7.658 4.625 1.00 0.00 C ATOM 308 CD2 LEU A 234 5.313 -6.295 6.486 1.00 0.00 C ATOM 0 H LEU A 234 2.385 -5.376 2.908 1.00 0.00 H new ATOM 0 HA LEU A 234 3.712 -4.359 5.318 1.00 0.00 H new ATOM 0 HB2 LEU A 234 5.082 -5.894 3.082 1.00 0.00 H new ATOM 0 HB3 LEU A 234 5.930 -4.918 4.265 1.00 0.00 H new ATOM 0 HG LEU A 234 4.206 -7.308 4.970 1.00 0.00 H new ATOM 0 HD11 LEU A 234 6.328 -8.513 5.300 1.00 0.00 H new ATOM 0 HD12 LEU A 234 6.110 -8.009 3.607 1.00 0.00 H new ATOM 0 HD13 LEU A 234 7.219 -7.107 4.668 1.00 0.00 H new ATOM 0 HD21 LEU A 234 5.376 -7.168 7.135 1.00 0.00 H new ATOM 0 HD22 LEU A 234 6.228 -5.710 6.575 1.00 0.00 H new ATOM 0 HD23 LEU A 234 4.461 -5.683 6.782 1.00 0.00 H new ATOM 320 N ALA A 235 4.493 -2.344 4.025 1.00 0.00 N ATOM 321 CA ALA A 235 4.690 -1.081 3.324 1.00 0.00 C ATOM 322 C ALA A 235 5.182 -1.315 1.899 1.00 0.00 C ATOM 323 O ALA A 235 4.674 -0.717 0.951 1.00 0.00 O ATOM 324 CB ALA A 235 5.671 -0.201 4.085 1.00 0.00 C ATOM 0 H ALA A 235 4.805 -2.340 4.996 1.00 0.00 H new ATOM 0 HA ALA A 235 3.728 -0.571 3.270 1.00 0.00 H new ATOM 0 HB1 ALA A 235 5.808 0.738 3.550 1.00 0.00 H new ATOM 0 HB2 ALA A 235 5.279 0.003 5.081 1.00 0.00 H new ATOM 0 HB3 ALA A 235 6.629 -0.713 4.170 1.00 0.00 H new ATOM 330 N ALA A 236 6.174 -2.188 1.757 1.00 0.00 N ATOM 331 CA ALA A 236 6.733 -2.501 0.448 1.00 0.00 C ATOM 332 C ALA A 236 5.675 -3.099 -0.473 1.00 0.00 C ATOM 333 O ALA A 236 5.554 -2.704 -1.632 1.00 0.00 O ATOM 334 CB ALA A 236 7.910 -3.455 0.591 1.00 0.00 C ATOM 0 H ALA A 236 6.607 -2.691 2.532 1.00 0.00 H new ATOM 0 HA ALA A 236 7.084 -1.572 -0.001 1.00 0.00 H new ATOM 0 HB1 ALA A 236 8.318 -3.680 -0.395 1.00 0.00 H new ATOM 0 HB2 ALA A 236 8.682 -2.991 1.206 1.00 0.00 H new ATOM 0 HB3 ALA A 236 7.575 -4.378 1.064 1.00 0.00 H new ATOM 340 N GLU A 237 4.910 -4.051 0.051 1.00 0.00 N ATOM 341 CA GLU A 237 3.863 -4.704 -0.725 1.00 0.00 C ATOM 342 C GLU A 237 2.916 -3.673 -1.335 1.00 0.00 C ATOM 343 O GLU A 237 2.760 -3.604 -2.554 1.00 0.00 O ATOM 344 CB GLU A 237 3.076 -5.678 0.154 1.00 0.00 C ATOM 345 CG GLU A 237 3.846 -6.940 0.503 1.00 0.00 C ATOM 346 CD GLU A 237 3.816 -7.969 -0.611 1.00 0.00 C ATOM 347 OE1 GLU A 237 2.818 -8.715 -0.702 1.00 0.00 O ATOM 348 OE2 GLU A 237 4.789 -8.028 -1.391 1.00 0.00 O ATOM 0 H GLU A 237 4.996 -4.387 1.010 1.00 0.00 H new ATOM 0 HA GLU A 237 4.339 -5.260 -1.533 1.00 0.00 H new ATOM 0 HB2 GLU A 237 2.788 -5.172 1.075 1.00 0.00 H new ATOM 0 HB3 GLU A 237 2.155 -5.955 -0.359 1.00 0.00 H new ATOM 0 HG2 GLU A 237 4.881 -6.680 0.724 1.00 0.00 H new ATOM 0 HG3 GLU A 237 3.427 -7.378 1.409 1.00 0.00 H new ATOM 355 N ILE A 238 2.287 -2.877 -0.478 1.00 0.00 N ATOM 356 CA ILE A 238 1.357 -1.851 -0.931 1.00 0.00 C ATOM 357 C ILE A 238 2.035 -0.878 -1.890 1.00 0.00 C ATOM 358 O ILE A 238 1.564 -0.662 -3.006 1.00 0.00 O ATOM 359 CB ILE A 238 0.769 -1.060 0.253 1.00 0.00 C ATOM 360 CG1 ILE A 238 -0.004 -1.995 1.185 1.00 0.00 C ATOM 361 CG2 ILE A 238 -0.131 0.058 -0.251 1.00 0.00 C ATOM 362 CD1 ILE A 238 -1.278 -2.536 0.577 1.00 0.00 C ATOM 0 H ILE A 238 2.404 -2.923 0.534 1.00 0.00 H new ATOM 0 HA ILE A 238 0.549 -2.366 -1.450 1.00 0.00 H new ATOM 0 HB ILE A 238 1.589 -0.613 0.815 1.00 0.00 H new ATOM 0 HG12 ILE A 238 0.639 -2.830 1.464 1.00 0.00 H new ATOM 0 HG13 ILE A 238 -0.248 -1.460 2.103 1.00 0.00 H new ATOM 0 HG21 ILE A 238 -0.539 0.607 0.598 1.00 0.00 H new ATOM 0 HG22 ILE A 238 0.448 0.736 -0.878 1.00 0.00 H new ATOM 0 HG23 ILE A 238 -0.948 -0.367 -0.834 1.00 0.00 H new ATOM 0 HD11 ILE A 238 -1.774 -3.191 1.294 1.00 0.00 H new ATOM 0 HD12 ILE A 238 -1.940 -1.708 0.324 1.00 0.00 H new ATOM 0 HD13 ILE A 238 -1.040 -3.099 -0.325 1.00 0.00 H new ATOM 374 N GLN A 239 3.145 -0.297 -1.447 1.00 0.00 N ATOM 375 CA GLN A 239 3.889 0.652 -2.268 1.00 0.00 C ATOM 376 C GLN A 239 4.024 0.145 -3.700 1.00 0.00 C ATOM 377 O GLN A 239 3.591 0.805 -4.644 1.00 0.00 O ATOM 378 CB GLN A 239 5.275 0.898 -1.669 1.00 0.00 C ATOM 379 CG GLN A 239 6.048 2.009 -2.362 1.00 0.00 C ATOM 380 CD GLN A 239 7.393 2.276 -1.714 1.00 0.00 C ATOM 381 OE1 GLN A 239 8.441 1.976 -2.287 1.00 0.00 O ATOM 382 NE2 GLN A 239 7.370 2.842 -0.513 1.00 0.00 N ATOM 0 H GLN A 239 3.549 -0.466 -0.526 1.00 0.00 H new ATOM 0 HA GLN A 239 3.336 1.591 -2.286 1.00 0.00 H new ATOM 0 HB2 GLN A 239 5.167 1.146 -0.613 1.00 0.00 H new ATOM 0 HB3 GLN A 239 5.854 -0.024 -1.722 1.00 0.00 H new ATOM 0 HG2 GLN A 239 6.199 1.743 -3.408 1.00 0.00 H new ATOM 0 HG3 GLN A 239 5.454 2.923 -2.348 1.00 0.00 H new ATOM 0 HE21 GLN A 239 6.478 3.074 -0.075 1.00 0.00 H new ATOM 0 HE22 GLN A 239 8.244 3.045 -0.028 1.00 0.00 H new ATOM 391 N GLU A 240 4.626 -1.030 -3.852 1.00 0.00 N ATOM 392 CA GLU A 240 4.818 -1.624 -5.170 1.00 0.00 C ATOM 393 C GLU A 240 3.476 -1.913 -5.837 1.00 0.00 C ATOM 394 O GLU A 240 3.188 -1.409 -6.923 1.00 0.00 O ATOM 395 CB GLU A 240 5.633 -2.914 -5.059 1.00 0.00 C ATOM 396 CG GLU A 240 6.251 -3.359 -6.374 1.00 0.00 C ATOM 397 CD GLU A 240 6.626 -4.828 -6.375 1.00 0.00 C ATOM 398 OE1 GLU A 240 7.075 -5.326 -5.321 1.00 0.00 O ATOM 399 OE2 GLU A 240 6.472 -5.480 -7.429 1.00 0.00 O ATOM 0 H GLU A 240 4.989 -1.589 -3.080 1.00 0.00 H new ATOM 0 HA GLU A 240 5.364 -0.910 -5.786 1.00 0.00 H new ATOM 0 HB2 GLU A 240 6.426 -2.771 -4.325 1.00 0.00 H new ATOM 0 HB3 GLU A 240 4.989 -3.709 -4.682 1.00 0.00 H new ATOM 0 HG2 GLU A 240 5.548 -3.167 -7.185 1.00 0.00 H new ATOM 0 HG3 GLU A 240 7.140 -2.761 -6.574 1.00 0.00 H new ATOM 406 N THR A 241 2.659 -2.730 -5.180 1.00 0.00 N ATOM 407 CA THR A 241 1.349 -3.088 -5.708 1.00 0.00 C ATOM 408 C THR A 241 0.679 -1.893 -6.375 1.00 0.00 C ATOM 409 O THR A 241 0.273 -1.963 -7.536 1.00 0.00 O ATOM 410 CB THR A 241 0.424 -3.628 -4.600 1.00 0.00 C ATOM 411 OG1 THR A 241 1.024 -4.768 -3.974 1.00 0.00 O ATOM 412 CG2 THR A 241 -0.934 -4.010 -5.167 1.00 0.00 C ATOM 0 H THR A 241 2.882 -3.156 -4.281 1.00 0.00 H new ATOM 0 HA THR A 241 1.511 -3.871 -6.449 1.00 0.00 H new ATOM 0 HB THR A 241 0.282 -2.841 -3.860 1.00 0.00 H new ATOM 0 HG1 THR A 241 1.457 -4.493 -3.139 1.00 0.00 H new ATOM 0 HG21 THR A 241 -1.569 -4.388 -4.366 1.00 0.00 H new ATOM 0 HG22 THR A 241 -1.400 -3.133 -5.617 1.00 0.00 H new ATOM 0 HG23 THR A 241 -0.807 -4.783 -5.925 1.00 0.00 H new ATOM 420 N PHE A 242 0.567 -0.794 -5.636 1.00 0.00 N ATOM 421 CA PHE A 242 -0.055 0.418 -6.157 1.00 0.00 C ATOM 422 C PHE A 242 0.814 1.053 -7.239 1.00 0.00 C ATOM 423 O PHE A 242 0.320 1.446 -8.295 1.00 0.00 O ATOM 424 CB PHE A 242 -0.294 1.420 -5.026 1.00 0.00 C ATOM 425 CG PHE A 242 -1.464 1.070 -4.151 1.00 0.00 C ATOM 426 CD1 PHE A 242 -1.471 -0.107 -3.421 1.00 0.00 C ATOM 427 CD2 PHE A 242 -2.556 1.917 -4.060 1.00 0.00 C ATOM 428 CE1 PHE A 242 -2.546 -0.433 -2.615 1.00 0.00 C ATOM 429 CE2 PHE A 242 -3.633 1.598 -3.256 1.00 0.00 C ATOM 430 CZ PHE A 242 -3.629 0.420 -2.533 1.00 0.00 C ATOM 0 H PHE A 242 0.899 -0.718 -4.675 1.00 0.00 H new ATOM 0 HA PHE A 242 -1.013 0.144 -6.599 1.00 0.00 H new ATOM 0 HB2 PHE A 242 0.604 1.482 -4.411 1.00 0.00 H new ATOM 0 HB3 PHE A 242 -0.455 2.409 -5.456 1.00 0.00 H new ATOM 0 HD1 PHE A 242 -0.627 -0.778 -3.482 1.00 0.00 H new ATOM 0 HD2 PHE A 242 -2.566 2.838 -4.624 1.00 0.00 H new ATOM 0 HE1 PHE A 242 -2.539 -1.354 -2.050 1.00 0.00 H new ATOM 0 HE2 PHE A 242 -4.477 2.268 -3.192 1.00 0.00 H new ATOM 0 HZ PHE A 242 -4.471 0.167 -1.905 1.00 0.00 H new ATOM 440 N SER A 243 2.112 1.148 -6.967 1.00 0.00 N ATOM 441 CA SER A 243 3.049 1.739 -7.914 1.00 0.00 C ATOM 442 C SER A 243 2.851 1.156 -9.310 1.00 0.00 C ATOM 443 O SER A 243 2.976 1.860 -10.312 1.00 0.00 O ATOM 444 CB SER A 243 4.489 1.506 -7.452 1.00 0.00 C ATOM 445 OG SER A 243 5.391 2.350 -8.147 1.00 0.00 O ATOM 0 H SER A 243 2.538 0.823 -6.099 1.00 0.00 H new ATOM 0 HA SER A 243 2.857 2.811 -7.956 1.00 0.00 H new ATOM 0 HB2 SER A 243 4.565 1.691 -6.381 1.00 0.00 H new ATOM 0 HB3 SER A 243 4.762 0.464 -7.615 1.00 0.00 H new ATOM 0 HG SER A 243 6.304 2.183 -7.832 1.00 0.00 H new ATOM 451 N ARG A 244 2.541 -0.135 -9.367 1.00 0.00 N ATOM 452 CA ARG A 244 2.327 -0.815 -10.639 1.00 0.00 C ATOM 453 C ARG A 244 1.554 0.076 -11.607 1.00 0.00 C ATOM 454 O ARG A 244 1.917 0.200 -12.777 1.00 0.00 O ATOM 455 CB ARG A 244 1.569 -2.125 -10.420 1.00 0.00 C ATOM 456 CG ARG A 244 2.297 -3.105 -9.514 1.00 0.00 C ATOM 457 CD ARG A 244 1.870 -4.539 -9.787 1.00 0.00 C ATOM 458 NE ARG A 244 2.195 -4.957 -11.148 1.00 0.00 N ATOM 459 CZ ARG A 244 2.364 -6.225 -11.506 1.00 0.00 C ATOM 460 NH1 ARG A 244 2.240 -7.193 -10.609 1.00 0.00 N ATOM 461 NH2 ARG A 244 2.659 -6.526 -12.765 1.00 0.00 N ATOM 0 H ARG A 244 2.432 -0.731 -8.547 1.00 0.00 H new ATOM 0 HA ARG A 244 3.302 -1.036 -11.073 1.00 0.00 H new ATOM 0 HB2 ARG A 244 0.592 -1.902 -9.990 1.00 0.00 H new ATOM 0 HB3 ARG A 244 1.392 -2.598 -11.386 1.00 0.00 H new ATOM 0 HG2 ARG A 244 3.373 -3.010 -9.663 1.00 0.00 H new ATOM 0 HG3 ARG A 244 2.096 -2.857 -8.472 1.00 0.00 H new ATOM 0 HD2 ARG A 244 2.360 -5.205 -9.077 1.00 0.00 H new ATOM 0 HD3 ARG A 244 0.796 -4.635 -9.625 1.00 0.00 H new ATOM 0 HE ARG A 244 2.298 -4.236 -11.862 1.00 0.00 H new ATOM 0 HH11 ARG A 244 2.014 -6.965 -9.641 1.00 0.00 H new ATOM 0 HH12 ARG A 244 2.370 -8.166 -10.887 1.00 0.00 H new ATOM 0 HH21 ARG A 244 2.756 -5.784 -13.458 1.00 0.00 H new ATOM 0 HH22 ARG A 244 2.789 -7.500 -13.040 1.00 0.00 H new ATOM 475 N PHE A 245 0.487 0.694 -11.112 1.00 0.00 N ATOM 476 CA PHE A 245 -0.338 1.572 -11.933 1.00 0.00 C ATOM 477 C PHE A 245 0.416 2.848 -12.293 1.00 0.00 C ATOM 478 O PHE A 245 0.452 3.255 -13.453 1.00 0.00 O ATOM 479 CB PHE A 245 -1.635 1.922 -11.199 1.00 0.00 C ATOM 480 CG PHE A 245 -2.565 0.754 -11.035 1.00 0.00 C ATOM 481 CD1 PHE A 245 -2.364 -0.172 -10.025 1.00 0.00 C ATOM 482 CD2 PHE A 245 -3.641 0.583 -11.892 1.00 0.00 C ATOM 483 CE1 PHE A 245 -3.219 -1.247 -9.872 1.00 0.00 C ATOM 484 CE2 PHE A 245 -4.499 -0.490 -11.744 1.00 0.00 C ATOM 485 CZ PHE A 245 -4.288 -1.406 -10.732 1.00 0.00 C ATOM 0 H PHE A 245 0.173 0.603 -10.146 1.00 0.00 H new ATOM 0 HA PHE A 245 -0.581 1.043 -12.854 1.00 0.00 H new ATOM 0 HB2 PHE A 245 -1.390 2.322 -10.215 1.00 0.00 H new ATOM 0 HB3 PHE A 245 -2.150 2.712 -11.745 1.00 0.00 H new ATOM 0 HD1 PHE A 245 -1.530 -0.053 -9.349 1.00 0.00 H new ATOM 0 HD2 PHE A 245 -3.811 1.297 -12.685 1.00 0.00 H new ATOM 0 HE1 PHE A 245 -3.051 -1.962 -9.080 1.00 0.00 H new ATOM 0 HE2 PHE A 245 -5.333 -0.612 -12.419 1.00 0.00 H new ATOM 0 HZ PHE A 245 -4.958 -2.245 -10.613 1.00 0.00 H new ATOM 495 N GLY A 246 1.019 3.476 -11.287 1.00 0.00 N ATOM 496 CA GLY A 246 1.764 4.700 -11.516 1.00 0.00 C ATOM 497 C GLY A 246 2.665 5.057 -10.351 1.00 0.00 C ATOM 498 O GLY A 246 2.498 4.539 -9.247 1.00 0.00 O ATOM 0 H GLY A 246 1.004 3.158 -10.318 1.00 0.00 H new ATOM 0 HA2 GLY A 246 2.367 4.591 -12.418 1.00 0.00 H new ATOM 0 HA3 GLY A 246 1.066 5.518 -11.696 1.00 0.00 H new ATOM 502 N SER A 247 3.625 5.943 -10.597 1.00 0.00 N ATOM 503 CA SER A 247 4.560 6.364 -9.561 1.00 0.00 C ATOM 504 C SER A 247 3.815 6.847 -8.320 1.00 0.00 C ATOM 505 O SER A 247 2.766 7.487 -8.421 1.00 0.00 O ATOM 506 CB SER A 247 5.471 7.475 -10.087 1.00 0.00 C ATOM 507 OG SER A 247 6.480 6.950 -10.933 1.00 0.00 O ATOM 0 H SER A 247 3.775 6.383 -11.505 1.00 0.00 H new ATOM 0 HA SER A 247 5.170 5.504 -9.286 1.00 0.00 H new ATOM 0 HB2 SER A 247 4.878 8.207 -10.635 1.00 0.00 H new ATOM 0 HB3 SER A 247 5.931 7.999 -9.249 1.00 0.00 H new ATOM 0 HG SER A 247 7.048 7.680 -11.257 1.00 0.00 H new ATOM 513 N LEU A 248 4.362 6.538 -7.150 1.00 0.00 N ATOM 514 CA LEU A 248 3.750 6.940 -5.889 1.00 0.00 C ATOM 515 C LEU A 248 4.573 8.029 -5.207 1.00 0.00 C ATOM 516 O LEU A 248 5.678 8.349 -5.641 1.00 0.00 O ATOM 517 CB LEU A 248 3.612 5.733 -4.959 1.00 0.00 C ATOM 518 CG LEU A 248 2.712 4.601 -5.458 1.00 0.00 C ATOM 519 CD1 LEU A 248 2.960 3.331 -4.659 1.00 0.00 C ATOM 520 CD2 LEU A 248 1.248 5.008 -5.376 1.00 0.00 C ATOM 0 H LEU A 248 5.229 6.010 -7.048 1.00 0.00 H new ATOM 0 HA LEU A 248 2.759 7.340 -6.106 1.00 0.00 H new ATOM 0 HB2 LEU A 248 4.606 5.326 -4.775 1.00 0.00 H new ATOM 0 HB3 LEU A 248 3.227 6.080 -4.000 1.00 0.00 H new ATOM 0 HG LEU A 248 2.955 4.402 -6.502 1.00 0.00 H new ATOM 0 HD11 LEU A 248 2.311 2.537 -5.028 1.00 0.00 H new ATOM 0 HD12 LEU A 248 4.002 3.029 -4.769 1.00 0.00 H new ATOM 0 HD13 LEU A 248 2.745 3.516 -3.606 1.00 0.00 H new ATOM 0 HD21 LEU A 248 0.622 4.191 -5.735 1.00 0.00 H new ATOM 0 HD22 LEU A 248 0.991 5.234 -4.341 1.00 0.00 H new ATOM 0 HD23 LEU A 248 1.081 5.891 -5.993 1.00 0.00 H new ATOM 532 N GLY A 249 4.025 8.594 -4.135 1.00 0.00 N ATOM 533 CA GLY A 249 4.722 9.640 -3.410 1.00 0.00 C ATOM 534 C GLY A 249 4.957 9.279 -1.956 1.00 0.00 C ATOM 535 O GLY A 249 5.965 8.658 -1.619 1.00 0.00 O ATOM 0 H GLY A 249 3.111 8.346 -3.756 1.00 0.00 H new ATOM 0 HA2 GLY A 249 5.680 9.836 -3.892 1.00 0.00 H new ATOM 0 HA3 GLY A 249 4.144 10.562 -3.463 1.00 0.00 H new ATOM 539 N ARG A 250 4.025 9.671 -1.093 1.00 0.00 N ATOM 540 CA ARG A 250 4.137 9.387 0.332 1.00 0.00 C ATOM 541 C ARG A 250 3.408 8.096 0.689 1.00 0.00 C ATOM 542 O ARG A 250 2.194 7.986 0.512 1.00 0.00 O ATOM 543 CB ARG A 250 3.570 10.549 1.151 1.00 0.00 C ATOM 544 CG ARG A 250 4.255 10.739 2.494 1.00 0.00 C ATOM 545 CD ARG A 250 5.679 11.246 2.327 1.00 0.00 C ATOM 546 NE ARG A 250 5.744 12.705 2.329 1.00 0.00 N ATOM 547 CZ ARG A 250 6.851 13.390 2.592 1.00 0.00 C ATOM 548 NH1 ARG A 250 7.979 12.752 2.871 1.00 0.00 N ATOM 549 NH2 ARG A 250 6.831 14.717 2.574 1.00 0.00 N ATOM 0 H ARG A 250 3.185 10.186 -1.356 1.00 0.00 H new ATOM 0 HA ARG A 250 5.194 9.264 0.570 1.00 0.00 H new ATOM 0 HB2 ARG A 250 3.661 11.468 0.573 1.00 0.00 H new ATOM 0 HB3 ARG A 250 2.506 10.381 1.316 1.00 0.00 H new ATOM 0 HG2 ARG A 250 3.685 11.445 3.098 1.00 0.00 H new ATOM 0 HG3 ARG A 250 4.266 9.793 3.035 1.00 0.00 H new ATOM 0 HD2 ARG A 250 6.300 10.854 3.133 1.00 0.00 H new ATOM 0 HD3 ARG A 250 6.092 10.866 1.393 1.00 0.00 H new ATOM 0 HE ARG A 250 4.893 13.226 2.117 1.00 0.00 H new ATOM 0 HH11 ARG A 250 7.998 11.732 2.884 1.00 0.00 H new ATOM 0 HH12 ARG A 250 8.828 13.281 3.073 1.00 0.00 H new ATOM 0 HH21 ARG A 250 5.965 15.211 2.358 1.00 0.00 H new ATOM 0 HH22 ARG A 250 7.681 15.243 2.776 1.00 0.00 H new ATOM 563 N VAL A 251 4.156 7.119 1.192 1.00 0.00 N ATOM 564 CA VAL A 251 3.582 5.835 1.574 1.00 0.00 C ATOM 565 C VAL A 251 3.812 5.547 3.053 1.00 0.00 C ATOM 566 O VAL A 251 4.900 5.130 3.454 1.00 0.00 O ATOM 567 CB VAL A 251 4.175 4.684 0.740 1.00 0.00 C ATOM 568 CG1 VAL A 251 3.669 3.341 1.246 1.00 0.00 C ATOM 569 CG2 VAL A 251 3.844 4.867 -0.733 1.00 0.00 C ATOM 0 H VAL A 251 5.162 7.193 1.344 1.00 0.00 H new ATOM 0 HA VAL A 251 2.511 5.899 1.382 1.00 0.00 H new ATOM 0 HB VAL A 251 5.259 4.701 0.850 1.00 0.00 H new ATOM 0 HG11 VAL A 251 4.099 2.540 0.644 1.00 0.00 H new ATOM 0 HG12 VAL A 251 3.963 3.210 2.287 1.00 0.00 H new ATOM 0 HG13 VAL A 251 2.582 3.309 1.169 1.00 0.00 H new ATOM 0 HG21 VAL A 251 4.271 4.045 -1.307 1.00 0.00 H new ATOM 0 HG22 VAL A 251 2.762 4.878 -0.864 1.00 0.00 H new ATOM 0 HG23 VAL A 251 4.261 5.810 -1.085 1.00 0.00 H new ATOM 579 N LEU A 252 2.782 5.773 3.862 1.00 0.00 N ATOM 580 CA LEU A 252 2.872 5.538 5.299 1.00 0.00 C ATOM 581 C LEU A 252 1.901 4.445 5.733 1.00 0.00 C ATOM 582 O LEU A 252 0.684 4.603 5.630 1.00 0.00 O ATOM 583 CB LEU A 252 2.580 6.829 6.065 1.00 0.00 C ATOM 584 CG LEU A 252 3.419 8.046 5.674 1.00 0.00 C ATOM 585 CD1 LEU A 252 2.842 9.312 6.290 1.00 0.00 C ATOM 586 CD2 LEU A 252 4.867 7.856 6.100 1.00 0.00 C ATOM 0 H LEU A 252 1.875 6.119 3.547 1.00 0.00 H new ATOM 0 HA LEU A 252 3.886 5.209 5.527 1.00 0.00 H new ATOM 0 HB2 LEU A 252 1.528 7.079 5.928 1.00 0.00 H new ATOM 0 HB3 LEU A 252 2.727 6.638 7.128 1.00 0.00 H new ATOM 0 HG LEU A 252 3.391 8.148 4.589 1.00 0.00 H new ATOM 0 HD11 LEU A 252 3.452 10.168 6.001 1.00 0.00 H new ATOM 0 HD12 LEU A 252 1.822 9.457 5.935 1.00 0.00 H new ATOM 0 HD13 LEU A 252 2.838 9.219 7.376 1.00 0.00 H new ATOM 0 HD21 LEU A 252 5.449 8.732 5.813 1.00 0.00 H new ATOM 0 HD22 LEU A 252 4.914 7.727 7.181 1.00 0.00 H new ATOM 0 HD23 LEU A 252 5.277 6.972 5.611 1.00 0.00 H new ATOM 598 N LEU A 253 2.447 3.336 6.221 1.00 0.00 N ATOM 599 CA LEU A 253 1.629 2.216 6.674 1.00 0.00 C ATOM 600 C LEU A 253 2.091 1.723 8.041 1.00 0.00 C ATOM 601 O LEU A 253 3.046 0.955 8.161 1.00 0.00 O ATOM 602 CB LEU A 253 1.688 1.073 5.659 1.00 0.00 C ATOM 603 CG LEU A 253 1.270 -0.305 6.175 1.00 0.00 C ATOM 604 CD1 LEU A 253 -0.136 -0.254 6.753 1.00 0.00 C ATOM 605 CD2 LEU A 253 1.355 -1.339 5.063 1.00 0.00 C ATOM 0 H LEU A 253 3.452 3.189 6.313 1.00 0.00 H new ATOM 0 HA LEU A 253 0.599 2.562 6.762 1.00 0.00 H new ATOM 0 HB2 LEU A 253 1.050 1.331 4.814 1.00 0.00 H new ATOM 0 HB3 LEU A 253 2.707 1.003 5.280 1.00 0.00 H new ATOM 0 HG LEU A 253 1.957 -0.599 6.969 1.00 0.00 H new ATOM 0 HD11 LEU A 253 -0.417 -1.243 7.115 1.00 0.00 H new ATOM 0 HD12 LEU A 253 -0.164 0.456 7.579 1.00 0.00 H new ATOM 0 HD13 LEU A 253 -0.836 0.061 5.979 1.00 0.00 H new ATOM 0 HD21 LEU A 253 1.054 -2.313 5.448 1.00 0.00 H new ATOM 0 HD22 LEU A 253 0.692 -1.051 4.247 1.00 0.00 H new ATOM 0 HD23 LEU A 253 2.380 -1.395 4.696 1.00 0.00 H new ATOM 617 N PRO A 254 1.398 2.171 9.098 1.00 0.00 N ATOM 618 CA PRO A 254 1.717 1.786 10.476 1.00 0.00 C ATOM 619 C PRO A 254 1.392 0.323 10.759 1.00 0.00 C ATOM 620 O PRO A 254 0.458 -0.236 10.185 1.00 0.00 O ATOM 621 CB PRO A 254 0.827 2.704 11.317 1.00 0.00 C ATOM 622 CG PRO A 254 -0.314 3.047 10.423 1.00 0.00 C ATOM 623 CD PRO A 254 0.248 3.089 9.029 1.00 0.00 C ATOM 0 HA PRO A 254 2.781 1.888 10.691 1.00 0.00 H new ATOM 0 HB2 PRO A 254 0.484 2.203 12.222 1.00 0.00 H new ATOM 0 HB3 PRO A 254 1.366 3.598 11.632 1.00 0.00 H new ATOM 0 HG2 PRO A 254 -1.108 2.304 10.501 1.00 0.00 H new ATOM 0 HG3 PRO A 254 -0.749 4.008 10.697 1.00 0.00 H new ATOM 0 HD2 PRO A 254 -0.484 2.762 8.290 1.00 0.00 H new ATOM 0 HD3 PRO A 254 0.554 4.097 8.749 1.00 0.00 H new ATOM 631 N GLU A 255 2.168 -0.290 11.647 1.00 0.00 N ATOM 632 CA GLU A 255 1.960 -1.688 12.005 1.00 0.00 C ATOM 633 C GLU A 255 0.770 -1.838 12.948 1.00 0.00 C ATOM 634 O GLU A 255 -0.031 -2.762 12.813 1.00 0.00 O ATOM 635 CB GLU A 255 3.219 -2.262 12.660 1.00 0.00 C ATOM 636 CG GLU A 255 4.309 -2.628 11.667 1.00 0.00 C ATOM 637 CD GLU A 255 5.674 -2.743 12.315 1.00 0.00 C ATOM 638 OE1 GLU A 255 5.908 -2.052 13.330 1.00 0.00 O ATOM 639 OE2 GLU A 255 6.509 -3.521 11.809 1.00 0.00 O ATOM 0 H GLU A 255 2.946 0.159 12.131 1.00 0.00 H new ATOM 0 HA GLU A 255 1.749 -2.243 11.091 1.00 0.00 H new ATOM 0 HB2 GLU A 255 3.614 -1.534 13.368 1.00 0.00 H new ATOM 0 HB3 GLU A 255 2.948 -3.149 13.233 1.00 0.00 H new ATOM 0 HG2 GLU A 255 4.057 -3.575 11.189 1.00 0.00 H new ATOM 0 HG3 GLU A 255 4.347 -1.874 10.881 1.00 0.00 H new ATOM 646 N GLY A 256 0.661 -0.920 13.904 1.00 0.00 N ATOM 647 CA GLY A 256 -0.434 -0.967 14.856 1.00 0.00 C ATOM 648 C GLY A 256 -1.791 -0.961 14.181 1.00 0.00 C ATOM 649 O GLY A 256 -2.742 -1.561 14.678 1.00 0.00 O ATOM 0 H GLY A 256 1.311 -0.145 14.036 1.00 0.00 H new ATOM 0 HA2 GLY A 256 -0.340 -1.864 15.468 1.00 0.00 H new ATOM 0 HA3 GLY A 256 -0.363 -0.113 15.529 1.00 0.00 H new ATOM 653 N GLY A 257 -1.881 -0.277 13.044 1.00 0.00 N ATOM 654 CA GLY A 257 -3.136 -0.206 12.318 1.00 0.00 C ATOM 655 C GLY A 257 -3.022 -0.748 10.908 1.00 0.00 C ATOM 656 O GLY A 257 -2.179 -0.300 10.130 1.00 0.00 O ATOM 0 H GLY A 257 -1.107 0.229 12.613 1.00 0.00 H new ATOM 0 HA2 GLY A 257 -3.897 -0.768 12.859 1.00 0.00 H new ATOM 0 HA3 GLY A 257 -3.472 0.830 12.279 1.00 0.00 H new ATOM 660 N ILE A 258 -3.870 -1.716 10.577 1.00 0.00 N ATOM 661 CA ILE A 258 -3.860 -2.320 9.251 1.00 0.00 C ATOM 662 C ILE A 258 -4.011 -1.262 8.164 1.00 0.00 C ATOM 663 O ILE A 258 -3.443 -1.386 7.078 1.00 0.00 O ATOM 664 CB ILE A 258 -4.985 -3.361 9.098 1.00 0.00 C ATOM 665 CG1 ILE A 258 -6.310 -2.791 9.607 1.00 0.00 C ATOM 666 CG2 ILE A 258 -4.630 -4.638 9.845 1.00 0.00 C ATOM 667 CD1 ILE A 258 -7.497 -3.689 9.339 1.00 0.00 C ATOM 0 H ILE A 258 -4.573 -2.099 11.209 1.00 0.00 H new ATOM 0 HA ILE A 258 -2.897 -2.818 9.139 1.00 0.00 H new ATOM 0 HB ILE A 258 -5.097 -3.601 8.041 1.00 0.00 H new ATOM 0 HG12 ILE A 258 -6.232 -2.616 10.680 1.00 0.00 H new ATOM 0 HG13 ILE A 258 -6.484 -1.823 9.138 1.00 0.00 H new ATOM 0 HG21 ILE A 258 -5.435 -5.364 9.728 1.00 0.00 H new ATOM 0 HG22 ILE A 258 -3.706 -5.051 9.440 1.00 0.00 H new ATOM 0 HG23 ILE A 258 -4.494 -4.415 10.903 1.00 0.00 H new ATOM 0 HD11 ILE A 258 -8.402 -3.221 9.727 1.00 0.00 H new ATOM 0 HD12 ILE A 258 -7.601 -3.844 8.265 1.00 0.00 H new ATOM 0 HD13 ILE A 258 -7.345 -4.649 9.832 1.00 0.00 H new ATOM 679 N THR A 259 -4.779 -0.219 8.463 1.00 0.00 N ATOM 680 CA THR A 259 -5.005 0.862 7.512 1.00 0.00 C ATOM 681 C THR A 259 -3.686 1.405 6.974 1.00 0.00 C ATOM 682 O THR A 259 -2.722 1.573 7.721 1.00 0.00 O ATOM 683 CB THR A 259 -5.800 2.016 8.151 1.00 0.00 C ATOM 684 OG1 THR A 259 -5.078 2.549 9.267 1.00 0.00 O ATOM 685 CG2 THR A 259 -7.171 1.541 8.608 1.00 0.00 C ATOM 0 H THR A 259 -5.255 -0.100 9.357 1.00 0.00 H new ATOM 0 HA THR A 259 -5.585 0.443 6.690 1.00 0.00 H new ATOM 0 HB THR A 259 -5.935 2.795 7.400 1.00 0.00 H new ATOM 0 HG1 THR A 259 -5.589 3.283 9.667 1.00 0.00 H new ATOM 0 HG21 THR A 259 -7.714 2.373 9.056 1.00 0.00 H new ATOM 0 HG22 THR A 259 -7.729 1.163 7.752 1.00 0.00 H new ATOM 0 HG23 THR A 259 -7.054 0.746 9.344 1.00 0.00 H new ATOM 693 N ALA A 260 -3.650 1.679 5.674 1.00 0.00 N ATOM 694 CA ALA A 260 -2.449 2.207 5.038 1.00 0.00 C ATOM 695 C ALA A 260 -2.723 3.557 4.384 1.00 0.00 C ATOM 696 O ALA A 260 -3.830 3.817 3.914 1.00 0.00 O ATOM 697 CB ALA A 260 -1.920 1.218 4.009 1.00 0.00 C ATOM 0 H ALA A 260 -4.438 1.544 5.041 1.00 0.00 H new ATOM 0 HA ALA A 260 -1.693 2.353 5.809 1.00 0.00 H new ATOM 0 HB1 ALA A 260 -1.023 1.624 3.541 1.00 0.00 H new ATOM 0 HB2 ALA A 260 -1.678 0.276 4.501 1.00 0.00 H new ATOM 0 HB3 ALA A 260 -2.680 1.045 3.247 1.00 0.00 H new ATOM 703 N ILE A 261 -1.707 4.414 4.360 1.00 0.00 N ATOM 704 CA ILE A 261 -1.839 5.737 3.764 1.00 0.00 C ATOM 705 C ILE A 261 -0.922 5.889 2.555 1.00 0.00 C ATOM 706 O ILE A 261 0.301 5.819 2.676 1.00 0.00 O ATOM 707 CB ILE A 261 -1.516 6.848 4.781 1.00 0.00 C ATOM 708 CG1 ILE A 261 -2.442 6.743 5.994 1.00 0.00 C ATOM 709 CG2 ILE A 261 -1.641 8.216 4.129 1.00 0.00 C ATOM 710 CD1 ILE A 261 -1.920 7.463 7.218 1.00 0.00 C ATOM 0 H ILE A 261 -0.784 4.215 4.746 1.00 0.00 H new ATOM 0 HA ILE A 261 -2.877 5.837 3.446 1.00 0.00 H new ATOM 0 HB ILE A 261 -0.488 6.722 5.120 1.00 0.00 H new ATOM 0 HG12 ILE A 261 -3.418 7.151 5.732 1.00 0.00 H new ATOM 0 HG13 ILE A 261 -2.591 5.691 6.237 1.00 0.00 H new ATOM 0 HG21 ILE A 261 -1.410 8.990 4.861 1.00 0.00 H new ATOM 0 HG22 ILE A 261 -0.944 8.286 3.294 1.00 0.00 H new ATOM 0 HG23 ILE A 261 -2.659 8.354 3.765 1.00 0.00 H new ATOM 0 HD11 ILE A 261 -2.628 7.346 8.039 1.00 0.00 H new ATOM 0 HD12 ILE A 261 -0.957 7.040 7.506 1.00 0.00 H new ATOM 0 HD13 ILE A 261 -1.798 8.522 6.993 1.00 0.00 H new ATOM 722 N VAL A 262 -1.522 6.100 1.387 1.00 0.00 N ATOM 723 CA VAL A 262 -0.760 6.265 0.155 1.00 0.00 C ATOM 724 C VAL A 262 -1.051 7.613 -0.495 1.00 0.00 C ATOM 725 O VAL A 262 -2.207 8.017 -0.615 1.00 0.00 O ATOM 726 CB VAL A 262 -1.072 5.143 -0.853 1.00 0.00 C ATOM 727 CG1 VAL A 262 -0.296 5.354 -2.144 1.00 0.00 C ATOM 728 CG2 VAL A 262 -0.759 3.782 -0.249 1.00 0.00 C ATOM 0 H VAL A 262 -2.533 6.161 1.269 1.00 0.00 H new ATOM 0 HA VAL A 262 0.295 6.216 0.426 1.00 0.00 H new ATOM 0 HB VAL A 262 -2.136 5.175 -1.088 1.00 0.00 H new ATOM 0 HG11 VAL A 262 -0.529 4.552 -2.844 1.00 0.00 H new ATOM 0 HG12 VAL A 262 -0.575 6.312 -2.584 1.00 0.00 H new ATOM 0 HG13 VAL A 262 0.773 5.350 -1.931 1.00 0.00 H new ATOM 0 HG21 VAL A 262 -0.985 3.001 -0.975 1.00 0.00 H new ATOM 0 HG22 VAL A 262 0.297 3.736 0.016 1.00 0.00 H new ATOM 0 HG23 VAL A 262 -1.364 3.633 0.645 1.00 0.00 H new ATOM 738 N GLU A 263 0.006 8.303 -0.912 1.00 0.00 N ATOM 739 CA GLU A 263 -0.138 9.607 -1.550 1.00 0.00 C ATOM 740 C GLU A 263 0.416 9.581 -2.972 1.00 0.00 C ATOM 741 O GLU A 263 1.620 9.730 -3.184 1.00 0.00 O ATOM 742 CB GLU A 263 0.579 10.682 -0.731 1.00 0.00 C ATOM 743 CG GLU A 263 0.665 12.026 -1.434 1.00 0.00 C ATOM 744 CD GLU A 263 1.439 13.055 -0.632 1.00 0.00 C ATOM 745 OE1 GLU A 263 0.967 13.434 0.460 1.00 0.00 O ATOM 746 OE2 GLU A 263 2.516 13.481 -1.098 1.00 0.00 O ATOM 0 H GLU A 263 0.970 7.982 -0.820 1.00 0.00 H new ATOM 0 HA GLU A 263 -1.201 9.845 -1.597 1.00 0.00 H new ATOM 0 HB2 GLU A 263 0.059 10.811 0.218 1.00 0.00 H new ATOM 0 HB3 GLU A 263 1.587 10.338 -0.498 1.00 0.00 H new ATOM 0 HG2 GLU A 263 1.142 11.894 -2.405 1.00 0.00 H new ATOM 0 HG3 GLU A 263 -0.342 12.399 -1.621 1.00 0.00 H new ATOM 753 N PHE A 264 -0.471 9.390 -3.943 1.00 0.00 N ATOM 754 CA PHE A 264 -0.071 9.342 -5.345 1.00 0.00 C ATOM 755 C PHE A 264 0.420 10.708 -5.816 1.00 0.00 C ATOM 756 O PHE A 264 -0.186 11.737 -5.516 1.00 0.00 O ATOM 757 CB PHE A 264 -1.241 8.880 -6.215 1.00 0.00 C ATOM 758 CG PHE A 264 -1.408 7.388 -6.253 1.00 0.00 C ATOM 759 CD1 PHE A 264 -1.808 6.693 -5.123 1.00 0.00 C ATOM 760 CD2 PHE A 264 -1.164 6.680 -7.419 1.00 0.00 C ATOM 761 CE1 PHE A 264 -1.960 5.320 -5.156 1.00 0.00 C ATOM 762 CE2 PHE A 264 -1.316 5.307 -7.458 1.00 0.00 C ATOM 763 CZ PHE A 264 -1.716 4.626 -6.325 1.00 0.00 C ATOM 0 H PHE A 264 -1.471 9.266 -3.785 1.00 0.00 H new ATOM 0 HA PHE A 264 0.747 8.628 -5.440 1.00 0.00 H new ATOM 0 HB2 PHE A 264 -2.161 9.331 -5.842 1.00 0.00 H new ATOM 0 HB3 PHE A 264 -1.095 9.247 -7.231 1.00 0.00 H new ATOM 0 HD1 PHE A 264 -2.003 7.230 -4.207 1.00 0.00 H new ATOM 0 HD2 PHE A 264 -0.851 7.208 -8.308 1.00 0.00 H new ATOM 0 HE1 PHE A 264 -2.270 4.789 -4.268 1.00 0.00 H new ATOM 0 HE2 PHE A 264 -1.122 4.767 -8.373 1.00 0.00 H new ATOM 0 HZ PHE A 264 -1.838 3.553 -6.353 1.00 0.00 H new ATOM 773 N LEU A 265 1.524 10.709 -6.556 1.00 0.00 N ATOM 774 CA LEU A 265 2.099 11.947 -7.070 1.00 0.00 C ATOM 775 C LEU A 265 1.146 12.625 -8.050 1.00 0.00 C ATOM 776 O LEU A 265 1.118 13.850 -8.156 1.00 0.00 O ATOM 777 CB LEU A 265 3.437 11.666 -7.755 1.00 0.00 C ATOM 778 CG LEU A 265 4.535 11.079 -6.867 1.00 0.00 C ATOM 779 CD1 LEU A 265 5.715 10.621 -7.709 1.00 0.00 C ATOM 780 CD2 LEU A 265 4.982 12.098 -5.828 1.00 0.00 C ATOM 0 H LEU A 265 2.038 9.867 -6.813 1.00 0.00 H new ATOM 0 HA LEU A 265 2.263 12.619 -6.227 1.00 0.00 H new ATOM 0 HB2 LEU A 265 3.261 10.979 -8.583 1.00 0.00 H new ATOM 0 HB3 LEU A 265 3.805 12.597 -8.186 1.00 0.00 H new ATOM 0 HG LEU A 265 4.129 10.212 -6.346 1.00 0.00 H new ATOM 0 HD11 LEU A 265 6.486 10.206 -7.060 1.00 0.00 H new ATOM 0 HD12 LEU A 265 5.385 9.858 -8.414 1.00 0.00 H new ATOM 0 HD13 LEU A 265 6.121 11.470 -8.258 1.00 0.00 H new ATOM 0 HD21 LEU A 265 5.764 11.663 -5.205 1.00 0.00 H new ATOM 0 HD22 LEU A 265 5.369 12.984 -6.331 1.00 0.00 H new ATOM 0 HD23 LEU A 265 4.133 12.377 -5.203 1.00 0.00 H new ATOM 792 N GLU A 266 0.366 11.818 -8.763 1.00 0.00 N ATOM 793 CA GLU A 266 -0.589 12.340 -9.733 1.00 0.00 C ATOM 794 C GLU A 266 -2.017 11.967 -9.346 1.00 0.00 C ATOM 795 O GLU A 266 -2.313 10.825 -8.992 1.00 0.00 O ATOM 796 CB GLU A 266 -0.272 11.807 -11.132 1.00 0.00 C ATOM 797 CG GLU A 266 -0.871 12.643 -12.251 1.00 0.00 C ATOM 798 CD GLU A 266 -0.159 13.969 -12.434 1.00 0.00 C ATOM 799 OE1 GLU A 266 -0.050 14.726 -11.446 1.00 0.00 O ATOM 800 OE2 GLU A 266 0.289 14.250 -13.565 1.00 0.00 O ATOM 0 H GLU A 266 0.377 10.801 -8.687 1.00 0.00 H new ATOM 0 HA GLU A 266 -0.505 13.427 -9.738 1.00 0.00 H new ATOM 0 HB2 GLU A 266 0.810 11.766 -11.260 1.00 0.00 H new ATOM 0 HB3 GLU A 266 -0.642 10.785 -11.215 1.00 0.00 H new ATOM 0 HG2 GLU A 266 -0.828 12.080 -13.183 1.00 0.00 H new ATOM 0 HG3 GLU A 266 -1.924 12.827 -12.038 1.00 0.00 H new ATOM 807 N PRO A 267 -2.925 12.952 -9.414 1.00 0.00 N ATOM 808 CA PRO A 267 -4.337 12.752 -9.074 1.00 0.00 C ATOM 809 C PRO A 267 -5.061 11.881 -10.096 1.00 0.00 C ATOM 810 O PRO A 267 -5.937 11.091 -9.743 1.00 0.00 O ATOM 811 CB PRO A 267 -4.908 14.172 -9.082 1.00 0.00 C ATOM 812 CG PRO A 267 -4.012 14.936 -9.994 1.00 0.00 C ATOM 813 CD PRO A 267 -2.643 14.336 -9.827 1.00 0.00 C ATOM 0 HA PRO A 267 -4.458 12.234 -8.122 1.00 0.00 H new ATOM 0 HB2 PRO A 267 -5.938 14.182 -9.439 1.00 0.00 H new ATOM 0 HB3 PRO A 267 -4.913 14.602 -8.080 1.00 0.00 H new ATOM 0 HG2 PRO A 267 -4.349 14.858 -11.028 1.00 0.00 H new ATOM 0 HG3 PRO A 267 -4.007 15.996 -9.739 1.00 0.00 H new ATOM 0 HD2 PRO A 267 -2.073 14.370 -10.756 1.00 0.00 H new ATOM 0 HD3 PRO A 267 -2.060 14.869 -9.076 1.00 0.00 H new ATOM 821 N LEU A 268 -4.689 12.030 -11.363 1.00 0.00 N ATOM 822 CA LEU A 268 -5.303 11.257 -12.436 1.00 0.00 C ATOM 823 C LEU A 268 -5.015 9.768 -12.268 1.00 0.00 C ATOM 824 O LEU A 268 -5.925 8.941 -12.313 1.00 0.00 O ATOM 825 CB LEU A 268 -4.790 11.737 -13.795 1.00 0.00 C ATOM 826 CG LEU A 268 -5.020 13.214 -14.115 1.00 0.00 C ATOM 827 CD1 LEU A 268 -4.173 13.641 -15.304 1.00 0.00 C ATOM 828 CD2 LEU A 268 -6.494 13.478 -14.387 1.00 0.00 C ATOM 0 H LEU A 268 -3.965 12.679 -11.672 1.00 0.00 H new ATOM 0 HA LEU A 268 -6.381 11.408 -12.388 1.00 0.00 H new ATOM 0 HB2 LEU A 268 -3.720 11.537 -13.848 1.00 0.00 H new ATOM 0 HB3 LEU A 268 -5.266 11.139 -14.572 1.00 0.00 H new ATOM 0 HG LEU A 268 -4.719 13.804 -13.249 1.00 0.00 H new ATOM 0 HD11 LEU A 268 -4.350 14.695 -15.517 1.00 0.00 H new ATOM 0 HD12 LEU A 268 -3.119 13.490 -15.073 1.00 0.00 H new ATOM 0 HD13 LEU A 268 -4.442 13.045 -16.176 1.00 0.00 H new ATOM 0 HD21 LEU A 268 -6.639 14.534 -14.613 1.00 0.00 H new ATOM 0 HD22 LEU A 268 -6.821 12.877 -15.236 1.00 0.00 H new ATOM 0 HD23 LEU A 268 -7.080 13.212 -13.507 1.00 0.00 H new ATOM 840 N GLU A 269 -3.743 9.435 -12.072 1.00 0.00 N ATOM 841 CA GLU A 269 -3.336 8.046 -11.896 1.00 0.00 C ATOM 842 C GLU A 269 -3.958 7.453 -10.635 1.00 0.00 C ATOM 843 O GLU A 269 -4.434 6.318 -10.639 1.00 0.00 O ATOM 844 CB GLU A 269 -1.811 7.943 -11.823 1.00 0.00 C ATOM 845 CG GLU A 269 -1.144 7.818 -13.183 1.00 0.00 C ATOM 846 CD GLU A 269 -1.420 6.483 -13.847 1.00 0.00 C ATOM 847 OE1 GLU A 269 -0.910 5.457 -13.350 1.00 0.00 O ATOM 848 OE2 GLU A 269 -2.145 6.464 -14.864 1.00 0.00 O ATOM 0 H GLU A 269 -2.977 10.108 -12.031 1.00 0.00 H new ATOM 0 HA GLU A 269 -3.690 7.479 -12.757 1.00 0.00 H new ATOM 0 HB2 GLU A 269 -1.420 8.824 -11.315 1.00 0.00 H new ATOM 0 HB3 GLU A 269 -1.542 7.079 -11.215 1.00 0.00 H new ATOM 0 HG2 GLU A 269 -1.495 8.621 -13.831 1.00 0.00 H new ATOM 0 HG3 GLU A 269 -0.068 7.947 -13.069 1.00 0.00 H new ATOM 855 N ALA A 270 -3.948 8.229 -9.556 1.00 0.00 N ATOM 856 CA ALA A 270 -4.511 7.782 -8.288 1.00 0.00 C ATOM 857 C ALA A 270 -5.945 7.294 -8.466 1.00 0.00 C ATOM 858 O ALA A 270 -6.299 6.202 -8.022 1.00 0.00 O ATOM 859 CB ALA A 270 -4.457 8.904 -7.262 1.00 0.00 C ATOM 0 H ALA A 270 -3.556 9.170 -9.535 1.00 0.00 H new ATOM 0 HA ALA A 270 -3.912 6.946 -7.927 1.00 0.00 H new ATOM 0 HB1 ALA A 270 -4.881 8.556 -6.320 1.00 0.00 H new ATOM 0 HB2 ALA A 270 -3.421 9.204 -7.105 1.00 0.00 H new ATOM 0 HB3 ALA A 270 -5.031 9.757 -7.625 1.00 0.00 H new ATOM 865 N ARG A 271 -6.767 8.111 -9.118 1.00 0.00 N ATOM 866 CA ARG A 271 -8.163 7.763 -9.353 1.00 0.00 C ATOM 867 C ARG A 271 -8.273 6.478 -10.169 1.00 0.00 C ATOM 868 O ARG A 271 -9.046 5.581 -9.834 1.00 0.00 O ATOM 869 CB ARG A 271 -8.880 8.903 -10.077 1.00 0.00 C ATOM 870 CG ARG A 271 -9.277 10.051 -9.162 1.00 0.00 C ATOM 871 CD ARG A 271 -9.897 11.198 -9.945 1.00 0.00 C ATOM 872 NE ARG A 271 -10.353 12.274 -9.069 1.00 0.00 N ATOM 873 CZ ARG A 271 -11.238 13.194 -9.436 1.00 0.00 C ATOM 874 NH1 ARG A 271 -11.759 13.169 -10.655 1.00 0.00 N ATOM 875 NH2 ARG A 271 -11.604 14.142 -8.583 1.00 0.00 N ATOM 0 H ARG A 271 -6.490 9.018 -9.493 1.00 0.00 H new ATOM 0 HA ARG A 271 -8.639 7.600 -8.386 1.00 0.00 H new ATOM 0 HB2 ARG A 271 -8.232 9.285 -10.866 1.00 0.00 H new ATOM 0 HB3 ARG A 271 -9.774 8.510 -10.561 1.00 0.00 H new ATOM 0 HG2 ARG A 271 -9.986 9.694 -8.415 1.00 0.00 H new ATOM 0 HG3 ARG A 271 -8.399 10.409 -8.624 1.00 0.00 H new ATOM 0 HD2 ARG A 271 -9.167 11.591 -10.652 1.00 0.00 H new ATOM 0 HD3 ARG A 271 -10.738 10.825 -10.530 1.00 0.00 H new ATOM 0 HE ARG A 271 -9.971 12.322 -8.124 1.00 0.00 H new ATOM 0 HH11 ARG A 271 -11.480 12.442 -11.314 1.00 0.00 H new ATOM 0 HH12 ARG A 271 -12.438 13.877 -10.934 1.00 0.00 H new ATOM 0 HH21 ARG A 271 -11.206 14.165 -7.644 1.00 0.00 H new ATOM 0 HH22 ARG A 271 -12.284 14.848 -8.866 1.00 0.00 H new ATOM 889 N LYS A 272 -7.495 6.398 -11.243 1.00 0.00 N ATOM 890 CA LYS A 272 -7.503 5.225 -12.109 1.00 0.00 C ATOM 891 C LYS A 272 -7.302 3.949 -11.297 1.00 0.00 C ATOM 892 O LYS A 272 -8.090 3.008 -11.397 1.00 0.00 O ATOM 893 CB LYS A 272 -6.410 5.342 -13.173 1.00 0.00 C ATOM 894 CG LYS A 272 -6.346 4.151 -14.113 1.00 0.00 C ATOM 895 CD LYS A 272 -5.066 4.156 -14.933 1.00 0.00 C ATOM 896 CE LYS A 272 -5.029 2.996 -15.915 1.00 0.00 C ATOM 897 NZ LYS A 272 -4.533 1.744 -15.278 1.00 0.00 N ATOM 0 H LYS A 272 -6.850 7.133 -11.535 1.00 0.00 H new ATOM 0 HA LYS A 272 -8.475 5.174 -12.600 1.00 0.00 H new ATOM 0 HB2 LYS A 272 -6.579 6.247 -13.757 1.00 0.00 H new ATOM 0 HB3 LYS A 272 -5.445 5.457 -12.679 1.00 0.00 H new ATOM 0 HG2 LYS A 272 -6.406 3.228 -13.537 1.00 0.00 H new ATOM 0 HG3 LYS A 272 -7.207 4.167 -14.781 1.00 0.00 H new ATOM 0 HD2 LYS A 272 -4.985 5.097 -15.477 1.00 0.00 H new ATOM 0 HD3 LYS A 272 -4.205 4.098 -14.267 1.00 0.00 H new ATOM 0 HE2 LYS A 272 -6.029 2.828 -16.316 1.00 0.00 H new ATOM 0 HE3 LYS A 272 -4.387 3.254 -16.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 272 -3.963 1.208 -15.963 1.00 0.00 H new ATOM 0 HZ2 LYS A 272 -3.948 1.983 -14.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 272 -5.342 1.166 -14.973 1.00 0.00 H new ATOM 911 N ALA A 273 -6.244 3.924 -10.493 1.00 0.00 N ATOM 912 CA ALA A 273 -5.943 2.766 -9.662 1.00 0.00 C ATOM 913 C ALA A 273 -7.080 2.478 -8.688 1.00 0.00 C ATOM 914 O ALA A 273 -7.531 1.339 -8.563 1.00 0.00 O ATOM 915 CB ALA A 273 -4.640 2.983 -8.906 1.00 0.00 C ATOM 0 H ALA A 273 -5.581 4.693 -10.400 1.00 0.00 H new ATOM 0 HA ALA A 273 -5.832 1.901 -10.315 1.00 0.00 H new ATOM 0 HB1 ALA A 273 -4.428 2.110 -8.289 1.00 0.00 H new ATOM 0 HB2 ALA A 273 -3.827 3.131 -9.617 1.00 0.00 H new ATOM 0 HB3 ALA A 273 -4.731 3.863 -8.270 1.00 0.00 H new ATOM 921 N PHE A 274 -7.540 3.517 -7.999 1.00 0.00 N ATOM 922 CA PHE A 274 -8.624 3.375 -7.034 1.00 0.00 C ATOM 923 C PHE A 274 -9.775 2.566 -7.625 1.00 0.00 C ATOM 924 O PHE A 274 -10.340 1.695 -6.963 1.00 0.00 O ATOM 925 CB PHE A 274 -9.127 4.751 -6.594 1.00 0.00 C ATOM 926 CG PHE A 274 -10.049 4.702 -5.409 1.00 0.00 C ATOM 927 CD1 PHE A 274 -11.257 4.028 -5.482 1.00 0.00 C ATOM 928 CD2 PHE A 274 -9.707 5.330 -4.222 1.00 0.00 C ATOM 929 CE1 PHE A 274 -12.107 3.980 -4.394 1.00 0.00 C ATOM 930 CE2 PHE A 274 -10.554 5.286 -3.131 1.00 0.00 C ATOM 931 CZ PHE A 274 -11.756 4.611 -3.217 1.00 0.00 C ATOM 0 H PHE A 274 -7.179 4.467 -8.091 1.00 0.00 H new ATOM 0 HA PHE A 274 -8.236 2.843 -6.165 1.00 0.00 H new ATOM 0 HB2 PHE A 274 -8.271 5.382 -6.353 1.00 0.00 H new ATOM 0 HB3 PHE A 274 -9.646 5.223 -7.428 1.00 0.00 H new ATOM 0 HD1 PHE A 274 -11.538 3.534 -6.401 1.00 0.00 H new ATOM 0 HD2 PHE A 274 -8.769 5.859 -4.149 1.00 0.00 H new ATOM 0 HE1 PHE A 274 -13.045 3.449 -4.464 1.00 0.00 H new ATOM 0 HE2 PHE A 274 -10.276 5.779 -2.211 1.00 0.00 H new ATOM 0 HZ PHE A 274 -12.420 4.577 -2.366 1.00 0.00 H new ATOM 941 N ARG A 275 -10.118 2.861 -8.875 1.00 0.00 N ATOM 942 CA ARG A 275 -11.203 2.163 -9.554 1.00 0.00 C ATOM 943 C ARG A 275 -10.853 0.694 -9.770 1.00 0.00 C ATOM 944 O ARG A 275 -11.573 -0.199 -9.321 1.00 0.00 O ATOM 945 CB ARG A 275 -11.503 2.829 -10.898 1.00 0.00 C ATOM 946 CG ARG A 275 -12.548 3.930 -10.813 1.00 0.00 C ATOM 947 CD ARG A 275 -13.935 3.362 -10.553 1.00 0.00 C ATOM 948 NE ARG A 275 -14.990 4.262 -11.010 1.00 0.00 N ATOM 949 CZ ARG A 275 -15.461 5.270 -10.286 1.00 0.00 C ATOM 950 NH1 ARG A 275 -14.973 5.506 -9.076 1.00 0.00 N ATOM 951 NH2 ARG A 275 -16.422 6.046 -10.771 1.00 0.00 N ATOM 0 H ARG A 275 -9.660 3.578 -9.438 1.00 0.00 H new ATOM 0 HA ARG A 275 -12.089 2.219 -8.922 1.00 0.00 H new ATOM 0 HB2 ARG A 275 -10.580 3.246 -11.301 1.00 0.00 H new ATOM 0 HB3 ARG A 275 -11.844 2.070 -11.602 1.00 0.00 H new ATOM 0 HG2 ARG A 275 -12.283 4.624 -10.016 1.00 0.00 H new ATOM 0 HG3 ARG A 275 -12.555 4.499 -11.743 1.00 0.00 H new ATOM 0 HD2 ARG A 275 -14.034 2.401 -11.059 1.00 0.00 H new ATOM 0 HD3 ARG A 275 -14.056 3.174 -9.486 1.00 0.00 H new ATOM 0 HE ARG A 275 -15.387 4.108 -11.937 1.00 0.00 H new ATOM 0 HH11 ARG A 275 -14.234 4.912 -8.699 1.00 0.00 H new ATOM 0 HH12 ARG A 275 -15.337 6.281 -8.522 1.00 0.00 H new ATOM 0 HH21 ARG A 275 -16.800 5.868 -11.702 1.00 0.00 H new ATOM 0 HH22 ARG A 275 -16.783 6.820 -10.213 1.00 0.00 H new ATOM 965 N HIS A 276 -9.744 0.450 -10.460 1.00 0.00 N ATOM 966 CA HIS A 276 -9.298 -0.912 -10.735 1.00 0.00 C ATOM 967 C HIS A 276 -9.210 -1.725 -9.447 1.00 0.00 C ATOM 968 O HIS A 276 -9.896 -2.736 -9.290 1.00 0.00 O ATOM 969 CB HIS A 276 -7.939 -0.895 -11.435 1.00 0.00 C ATOM 970 CG HIS A 276 -7.914 -0.052 -12.673 1.00 0.00 C ATOM 971 ND1 HIS A 276 -8.854 -0.159 -13.675 1.00 0.00 N ATOM 972 CD2 HIS A 276 -7.055 0.918 -13.066 1.00 0.00 C ATOM 973 CE1 HIS A 276 -8.574 0.707 -14.633 1.00 0.00 C ATOM 974 NE2 HIS A 276 -7.487 1.373 -14.288 1.00 0.00 N ATOM 0 H HIS A 276 -9.137 1.177 -10.839 1.00 0.00 H new ATOM 0 HA HIS A 276 -10.030 -1.382 -11.392 1.00 0.00 H new ATOM 0 HB2 HIS A 276 -7.185 -0.526 -10.739 1.00 0.00 H new ATOM 0 HB3 HIS A 276 -7.660 -1.916 -11.695 1.00 0.00 H new ATOM 0 HD1 HIS A 276 -9.643 -0.806 -13.677 1.00 0.00 H new ATOM 0 HD2 HIS A 276 -6.191 1.269 -12.521 1.00 0.00 H new ATOM 0 HE1 HIS A 276 -9.138 0.846 -15.543 1.00 0.00 H new ATOM 983 N LEU A 277 -8.361 -1.278 -8.528 1.00 0.00 N ATOM 984 CA LEU A 277 -8.182 -1.965 -7.253 1.00 0.00 C ATOM 985 C LEU A 277 -9.519 -2.149 -6.541 1.00 0.00 C ATOM 986 O LEU A 277 -9.877 -3.259 -6.149 1.00 0.00 O ATOM 987 CB LEU A 277 -7.220 -1.180 -6.360 1.00 0.00 C ATOM 988 CG LEU A 277 -5.873 -0.812 -6.984 1.00 0.00 C ATOM 989 CD1 LEU A 277 -4.992 -0.100 -5.970 1.00 0.00 C ATOM 990 CD2 LEU A 277 -5.176 -2.055 -7.520 1.00 0.00 C ATOM 0 H LEU A 277 -7.786 -0.443 -8.642 1.00 0.00 H new ATOM 0 HA LEU A 277 -7.760 -2.950 -7.455 1.00 0.00 H new ATOM 0 HB2 LEU A 277 -7.715 -0.261 -6.046 1.00 0.00 H new ATOM 0 HB3 LEU A 277 -7.033 -1.765 -5.459 1.00 0.00 H new ATOM 0 HG LEU A 277 -6.054 -0.133 -7.818 1.00 0.00 H new ATOM 0 HD11 LEU A 277 -4.038 0.154 -6.432 1.00 0.00 H new ATOM 0 HD12 LEU A 277 -5.487 0.811 -5.634 1.00 0.00 H new ATOM 0 HD13 LEU A 277 -4.819 -0.754 -5.116 1.00 0.00 H new ATOM 0 HD21 LEU A 277 -4.219 -1.774 -7.960 1.00 0.00 H new ATOM 0 HD22 LEU A 277 -5.008 -2.758 -6.704 1.00 0.00 H new ATOM 0 HD23 LEU A 277 -5.801 -2.524 -8.280 1.00 0.00 H new ATOM 1002 N ALA A 278 -10.253 -1.053 -6.380 1.00 0.00 N ATOM 1003 CA ALA A 278 -11.552 -1.094 -5.720 1.00 0.00 C ATOM 1004 C ALA A 278 -12.322 -2.354 -6.101 1.00 0.00 C ATOM 1005 O ALA A 278 -12.214 -2.843 -7.226 1.00 0.00 O ATOM 1006 CB ALA A 278 -12.361 0.146 -6.070 1.00 0.00 C ATOM 0 H ALA A 278 -9.970 -0.126 -6.698 1.00 0.00 H new ATOM 0 HA ALA A 278 -11.384 -1.114 -4.643 1.00 0.00 H new ATOM 0 HB1 ALA A 278 -13.329 0.102 -5.570 1.00 0.00 H new ATOM 0 HB2 ALA A 278 -11.823 1.036 -5.742 1.00 0.00 H new ATOM 0 HB3 ALA A 278 -12.511 0.190 -7.149 1.00 0.00 H new ATOM 1012 N TYR A 279 -13.097 -2.876 -5.156 1.00 0.00 N ATOM 1013 CA TYR A 279 -13.882 -4.082 -5.392 1.00 0.00 C ATOM 1014 C TYR A 279 -12.975 -5.273 -5.687 1.00 0.00 C ATOM 1015 O TYR A 279 -13.284 -6.106 -6.540 1.00 0.00 O ATOM 1016 CB TYR A 279 -14.852 -3.865 -6.554 1.00 0.00 C ATOM 1017 CG TYR A 279 -15.952 -2.874 -6.248 1.00 0.00 C ATOM 1018 CD1 TYR A 279 -15.757 -1.511 -6.435 1.00 0.00 C ATOM 1019 CD2 TYR A 279 -17.185 -3.300 -5.770 1.00 0.00 C ATOM 1020 CE1 TYR A 279 -16.759 -0.601 -6.156 1.00 0.00 C ATOM 1021 CE2 TYR A 279 -18.193 -2.397 -5.490 1.00 0.00 C ATOM 1022 CZ TYR A 279 -17.975 -1.049 -5.684 1.00 0.00 C ATOM 1023 OH TYR A 279 -18.976 -0.147 -5.404 1.00 0.00 O ATOM 0 H TYR A 279 -13.198 -2.483 -4.220 1.00 0.00 H new ATOM 0 HA TYR A 279 -14.451 -4.297 -4.488 1.00 0.00 H new ATOM 0 HB2 TYR A 279 -14.293 -3.518 -7.423 1.00 0.00 H new ATOM 0 HB3 TYR A 279 -15.301 -4.821 -6.825 1.00 0.00 H new ATOM 0 HD1 TYR A 279 -14.806 -1.157 -6.805 1.00 0.00 H new ATOM 0 HD2 TYR A 279 -17.359 -4.355 -5.615 1.00 0.00 H new ATOM 0 HE1 TYR A 279 -16.591 0.455 -6.307 1.00 0.00 H new ATOM 0 HE2 TYR A 279 -19.147 -2.745 -5.121 1.00 0.00 H new ATOM 0 HH TYR A 279 -19.768 -0.626 -5.082 1.00 0.00 H new ATOM 1033 N SER A 280 -11.855 -5.347 -4.975 1.00 0.00 N ATOM 1034 CA SER A 280 -10.901 -6.434 -5.162 1.00 0.00 C ATOM 1035 C SER A 280 -10.356 -6.915 -3.820 1.00 0.00 C ATOM 1036 O SER A 280 -10.335 -6.168 -2.841 1.00 0.00 O ATOM 1037 CB SER A 280 -9.749 -5.980 -6.060 1.00 0.00 C ATOM 1038 OG SER A 280 -9.111 -7.089 -6.670 1.00 0.00 O ATOM 0 H SER A 280 -11.586 -4.667 -4.264 1.00 0.00 H new ATOM 0 HA SER A 280 -11.421 -7.263 -5.642 1.00 0.00 H new ATOM 0 HB2 SER A 280 -10.127 -5.306 -6.829 1.00 0.00 H new ATOM 0 HB3 SER A 280 -9.024 -5.418 -5.471 1.00 0.00 H new ATOM 0 HG SER A 280 -8.379 -6.773 -7.240 1.00 0.00 H new ATOM 1044 N LYS A 281 -9.916 -8.168 -3.782 1.00 0.00 N ATOM 1045 CA LYS A 281 -9.370 -8.751 -2.563 1.00 0.00 C ATOM 1046 C LYS A 281 -7.850 -8.854 -2.643 1.00 0.00 C ATOM 1047 O LYS A 281 -7.299 -9.258 -3.668 1.00 0.00 O ATOM 1048 CB LYS A 281 -9.974 -10.135 -2.320 1.00 0.00 C ATOM 1049 CG LYS A 281 -11.311 -10.098 -1.600 1.00 0.00 C ATOM 1050 CD LYS A 281 -12.141 -11.334 -1.901 1.00 0.00 C ATOM 1051 CE LYS A 281 -13.573 -11.176 -1.414 1.00 0.00 C ATOM 1052 NZ LYS A 281 -14.345 -10.224 -2.260 1.00 0.00 N ATOM 0 H LYS A 281 -9.927 -8.800 -4.583 1.00 0.00 H new ATOM 0 HA LYS A 281 -9.629 -8.098 -1.730 1.00 0.00 H new ATOM 0 HB2 LYS A 281 -10.101 -10.640 -3.278 1.00 0.00 H new ATOM 0 HB3 LYS A 281 -9.273 -10.731 -1.736 1.00 0.00 H new ATOM 0 HG2 LYS A 281 -11.145 -10.023 -0.525 1.00 0.00 H new ATOM 0 HG3 LYS A 281 -11.862 -9.207 -1.900 1.00 0.00 H new ATOM 0 HD2 LYS A 281 -12.139 -11.522 -2.975 1.00 0.00 H new ATOM 0 HD3 LYS A 281 -11.687 -12.203 -1.425 1.00 0.00 H new ATOM 0 HE2 LYS A 281 -14.067 -12.148 -1.417 1.00 0.00 H new ATOM 0 HE3 LYS A 281 -13.569 -10.824 -0.382 1.00 0.00 H new ATOM 0 HZ1 LYS A 281 -15.358 -10.307 -2.040 1.00 0.00 H new ATOM 0 HZ2 LYS A 281 -14.027 -9.253 -2.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 281 -14.189 -10.447 -3.264 1.00 0.00 H new ATOM 1066 N PHE A 282 -7.178 -8.490 -1.556 1.00 0.00 N ATOM 1067 CA PHE A 282 -5.722 -8.542 -1.504 1.00 0.00 C ATOM 1068 C PHE A 282 -5.238 -9.968 -1.253 1.00 0.00 C ATOM 1069 O PHE A 282 -4.688 -10.615 -2.145 1.00 0.00 O ATOM 1070 CB PHE A 282 -5.195 -7.613 -0.408 1.00 0.00 C ATOM 1071 CG PHE A 282 -3.726 -7.772 -0.143 1.00 0.00 C ATOM 1072 CD1 PHE A 282 -2.792 -7.398 -1.095 1.00 0.00 C ATOM 1073 CD2 PHE A 282 -3.278 -8.295 1.060 1.00 0.00 C ATOM 1074 CE1 PHE A 282 -1.438 -7.543 -0.854 1.00 0.00 C ATOM 1075 CE2 PHE A 282 -1.926 -8.441 1.307 1.00 0.00 C ATOM 1076 CZ PHE A 282 -1.005 -8.066 0.349 1.00 0.00 C ATOM 0 H PHE A 282 -7.619 -8.156 -0.699 1.00 0.00 H new ATOM 0 HA PHE A 282 -5.337 -8.210 -2.468 1.00 0.00 H new ATOM 0 HB2 PHE A 282 -5.395 -6.580 -0.691 1.00 0.00 H new ATOM 0 HB3 PHE A 282 -5.745 -7.803 0.514 1.00 0.00 H new ATOM 0 HD1 PHE A 282 -3.125 -6.988 -2.037 1.00 0.00 H new ATOM 0 HD2 PHE A 282 -3.993 -8.592 1.813 1.00 0.00 H new ATOM 0 HE1 PHE A 282 -0.720 -7.248 -1.605 1.00 0.00 H new ATOM 0 HE2 PHE A 282 -1.590 -8.848 2.249 1.00 0.00 H new ATOM 0 HZ PHE A 282 0.052 -8.181 0.540 1.00 0.00 H new ATOM 1086 N HIS A 283 -5.446 -10.451 -0.033 1.00 0.00 N ATOM 1087 CA HIS A 283 -5.031 -11.800 0.337 1.00 0.00 C ATOM 1088 C HIS A 283 -6.243 -12.684 0.615 1.00 0.00 C ATOM 1089 O HIS A 283 -6.479 -13.669 -0.085 1.00 0.00 O ATOM 1090 CB HIS A 283 -4.123 -11.758 1.566 1.00 0.00 C ATOM 1091 CG HIS A 283 -2.697 -11.430 1.246 1.00 0.00 C ATOM 1092 ND1 HIS A 283 -1.703 -11.382 2.201 1.00 0.00 N ATOM 1093 CD2 HIS A 283 -2.099 -11.133 0.068 1.00 0.00 C ATOM 1094 CE1 HIS A 283 -0.557 -11.069 1.624 1.00 0.00 C ATOM 1095 NE2 HIS A 283 -0.770 -10.913 0.330 1.00 0.00 N ATOM 0 H HIS A 283 -5.899 -9.929 0.717 1.00 0.00 H new ATOM 0 HA HIS A 283 -4.477 -12.226 -0.500 1.00 0.00 H new ATOM 0 HB2 HIS A 283 -4.509 -11.018 2.267 1.00 0.00 H new ATOM 0 HB3 HIS A 283 -4.161 -12.724 2.069 1.00 0.00 H new ATOM 0 HD2 HIS A 283 -2.579 -11.079 -0.898 1.00 0.00 H new ATOM 0 HE1 HIS A 283 0.393 -10.959 2.125 1.00 0.00 H new ATOM 0 HE2 HIS A 283 -0.062 -10.669 -0.362 1.00 0.00 H new ATOM 1104 N HIS A 284 -7.008 -12.325 1.641 1.00 0.00 N ATOM 1105 CA HIS A 284 -8.196 -13.086 2.012 1.00 0.00 C ATOM 1106 C HIS A 284 -9.395 -12.162 2.206 1.00 0.00 C ATOM 1107 O HIS A 284 -10.536 -12.548 1.956 1.00 0.00 O ATOM 1108 CB HIS A 284 -7.939 -13.882 3.291 1.00 0.00 C ATOM 1109 CG HIS A 284 -6.636 -14.621 3.285 1.00 0.00 C ATOM 1110 ND1 HIS A 284 -6.513 -15.928 2.863 1.00 0.00 N ATOM 1111 CD2 HIS A 284 -5.393 -14.227 3.650 1.00 0.00 C ATOM 1112 CE1 HIS A 284 -5.252 -16.307 2.971 1.00 0.00 C ATOM 1113 NE2 HIS A 284 -4.552 -15.293 3.446 1.00 0.00 N ATOM 0 H HIS A 284 -6.827 -11.512 2.230 1.00 0.00 H new ATOM 0 HA HIS A 284 -8.421 -13.779 1.201 1.00 0.00 H new ATOM 0 HB2 HIS A 284 -7.958 -13.202 4.142 1.00 0.00 H new ATOM 0 HB3 HIS A 284 -8.751 -14.595 3.435 1.00 0.00 H new ATOM 0 HD2 HIS A 284 -5.115 -13.255 4.031 1.00 0.00 H new ATOM 0 HE1 HIS A 284 -4.860 -17.280 2.715 1.00 0.00 H new ATOM 0 HE2 HIS A 284 -3.549 -15.300 3.631 1.00 0.00 H new ATOM 1122 N VAL A 285 -9.127 -10.939 2.655 1.00 0.00 N ATOM 1123 CA VAL A 285 -10.183 -9.960 2.883 1.00 0.00 C ATOM 1124 C VAL A 285 -10.229 -8.931 1.759 1.00 0.00 C ATOM 1125 O VAL A 285 -9.227 -8.644 1.104 1.00 0.00 O ATOM 1126 CB VAL A 285 -9.991 -9.230 4.225 1.00 0.00 C ATOM 1127 CG1 VAL A 285 -9.596 -10.214 5.316 1.00 0.00 C ATOM 1128 CG2 VAL A 285 -8.952 -8.128 4.088 1.00 0.00 C ATOM 0 H VAL A 285 -8.188 -10.603 2.868 1.00 0.00 H new ATOM 0 HA VAL A 285 -11.124 -10.509 2.908 1.00 0.00 H new ATOM 0 HB VAL A 285 -10.938 -8.771 4.508 1.00 0.00 H new ATOM 0 HG11 VAL A 285 -9.465 -9.680 6.257 1.00 0.00 H new ATOM 0 HG12 VAL A 285 -10.379 -10.964 5.430 1.00 0.00 H new ATOM 0 HG13 VAL A 285 -8.661 -10.704 5.043 1.00 0.00 H new ATOM 0 HG21 VAL A 285 -8.829 -7.623 5.046 1.00 0.00 H new ATOM 0 HG22 VAL A 285 -8.000 -8.562 3.782 1.00 0.00 H new ATOM 0 HG23 VAL A 285 -9.281 -7.409 3.338 1.00 0.00 H new ATOM 1138 N PRO A 286 -11.421 -8.359 1.529 1.00 0.00 N ATOM 1139 CA PRO A 286 -11.627 -7.351 0.485 1.00 0.00 C ATOM 1140 C PRO A 286 -10.946 -6.027 0.815 1.00 0.00 C ATOM 1141 O PRO A 286 -10.802 -5.666 1.983 1.00 0.00 O ATOM 1142 CB PRO A 286 -13.147 -7.178 0.455 1.00 0.00 C ATOM 1143 CG PRO A 286 -13.601 -7.572 1.818 1.00 0.00 C ATOM 1144 CD PRO A 286 -12.658 -8.653 2.271 1.00 0.00 C ATOM 0 HA PRO A 286 -11.200 -7.659 -0.470 1.00 0.00 H new ATOM 0 HB2 PRO A 286 -13.424 -6.148 0.228 1.00 0.00 H new ATOM 0 HB3 PRO A 286 -13.602 -7.807 -0.311 1.00 0.00 H new ATOM 0 HG2 PRO A 286 -13.576 -6.721 2.499 1.00 0.00 H new ATOM 0 HG3 PRO A 286 -14.629 -7.934 1.798 1.00 0.00 H new ATOM 0 HD2 PRO A 286 -12.498 -8.621 3.349 1.00 0.00 H new ATOM 0 HD3 PRO A 286 -13.042 -9.646 2.035 1.00 0.00 H new ATOM 1152 N LEU A 287 -10.529 -5.308 -0.221 1.00 0.00 N ATOM 1153 CA LEU A 287 -9.863 -4.022 -0.041 1.00 0.00 C ATOM 1154 C LEU A 287 -10.868 -2.876 -0.097 1.00 0.00 C ATOM 1155 O LEU A 287 -11.605 -2.730 -1.072 1.00 0.00 O ATOM 1156 CB LEU A 287 -8.790 -3.827 -1.114 1.00 0.00 C ATOM 1157 CG LEU A 287 -7.509 -4.644 -0.938 1.00 0.00 C ATOM 1158 CD1 LEU A 287 -6.657 -4.577 -2.196 1.00 0.00 C ATOM 1159 CD2 LEU A 287 -6.724 -4.152 0.268 1.00 0.00 C ATOM 0 H LEU A 287 -10.640 -5.593 -1.194 1.00 0.00 H new ATOM 0 HA LEU A 287 -9.391 -4.019 0.941 1.00 0.00 H new ATOM 0 HB2 LEU A 287 -9.224 -4.074 -2.083 1.00 0.00 H new ATOM 0 HB3 LEU A 287 -8.522 -2.771 -1.144 1.00 0.00 H new ATOM 0 HG LEU A 287 -7.785 -5.684 -0.766 1.00 0.00 H new ATOM 0 HD11 LEU A 287 -5.750 -5.164 -2.053 1.00 0.00 H new ATOM 0 HD12 LEU A 287 -7.220 -4.979 -3.038 1.00 0.00 H new ATOM 0 HD13 LEU A 287 -6.390 -3.540 -2.400 1.00 0.00 H new ATOM 0 HD21 LEU A 287 -5.816 -4.745 0.378 1.00 0.00 H new ATOM 0 HD22 LEU A 287 -6.458 -3.104 0.127 1.00 0.00 H new ATOM 0 HD23 LEU A 287 -7.334 -4.254 1.165 1.00 0.00 H new ATOM 1171 N TYR A 288 -10.890 -2.064 0.955 1.00 0.00 N ATOM 1172 CA TYR A 288 -11.804 -0.931 1.026 1.00 0.00 C ATOM 1173 C TYR A 288 -11.040 0.389 0.974 1.00 0.00 C ATOM 1174 O TYR A 288 -10.478 0.835 1.975 1.00 0.00 O ATOM 1175 CB TYR A 288 -12.637 -1.001 2.307 1.00 0.00 C ATOM 1176 CG TYR A 288 -13.703 -2.073 2.278 1.00 0.00 C ATOM 1177 CD1 TYR A 288 -14.877 -1.894 1.556 1.00 0.00 C ATOM 1178 CD2 TYR A 288 -13.537 -3.264 2.974 1.00 0.00 C ATOM 1179 CE1 TYR A 288 -15.853 -2.871 1.527 1.00 0.00 C ATOM 1180 CE2 TYR A 288 -14.508 -4.246 2.950 1.00 0.00 C ATOM 1181 CZ TYR A 288 -15.664 -4.045 2.225 1.00 0.00 C ATOM 1182 OH TYR A 288 -16.634 -5.021 2.200 1.00 0.00 O ATOM 0 H TYR A 288 -10.285 -2.170 1.770 1.00 0.00 H new ATOM 0 HA TYR A 288 -12.470 -0.979 0.164 1.00 0.00 H new ATOM 0 HB2 TYR A 288 -11.973 -1.183 3.152 1.00 0.00 H new ATOM 0 HB3 TYR A 288 -13.111 -0.034 2.476 1.00 0.00 H new ATOM 0 HD1 TYR A 288 -15.029 -0.976 1.008 1.00 0.00 H new ATOM 0 HD2 TYR A 288 -12.633 -3.425 3.543 1.00 0.00 H new ATOM 0 HE1 TYR A 288 -16.759 -2.716 0.961 1.00 0.00 H new ATOM 0 HE2 TYR A 288 -14.363 -5.166 3.496 1.00 0.00 H new ATOM 0 HH TYR A 288 -16.344 -5.784 2.742 1.00 0.00 H new ATOM 1192 N LEU A 289 -11.026 1.010 -0.200 1.00 0.00 N ATOM 1193 CA LEU A 289 -10.332 2.280 -0.385 1.00 0.00 C ATOM 1194 C LEU A 289 -11.255 3.455 -0.075 1.00 0.00 C ATOM 1195 O LEU A 289 -12.428 3.448 -0.445 1.00 0.00 O ATOM 1196 CB LEU A 289 -9.807 2.394 -1.817 1.00 0.00 C ATOM 1197 CG LEU A 289 -8.849 1.291 -2.270 1.00 0.00 C ATOM 1198 CD1 LEU A 289 -8.560 1.414 -3.758 1.00 0.00 C ATOM 1199 CD2 LEU A 289 -7.558 1.344 -1.468 1.00 0.00 C ATOM 0 H LEU A 289 -11.487 0.655 -1.038 1.00 0.00 H new ATOM 0 HA LEU A 289 -9.490 2.310 0.307 1.00 0.00 H new ATOM 0 HB2 LEU A 289 -10.660 2.408 -2.495 1.00 0.00 H new ATOM 0 HB3 LEU A 289 -9.300 3.353 -1.922 1.00 0.00 H new ATOM 0 HG LEU A 289 -9.325 0.327 -2.091 1.00 0.00 H new ATOM 0 HD11 LEU A 289 -7.877 0.621 -4.063 1.00 0.00 H new ATOM 0 HD12 LEU A 289 -9.491 1.326 -4.318 1.00 0.00 H new ATOM 0 HD13 LEU A 289 -8.105 2.383 -3.961 1.00 0.00 H new ATOM 0 HD21 LEU A 289 -6.888 0.552 -1.804 1.00 0.00 H new ATOM 0 HD22 LEU A 289 -7.078 2.312 -1.615 1.00 0.00 H new ATOM 0 HD23 LEU A 289 -7.781 1.206 -0.410 1.00 0.00 H new ATOM 1211 N GLU A 290 -10.715 4.462 0.605 1.00 0.00 N ATOM 1212 CA GLU A 290 -11.490 5.643 0.962 1.00 0.00 C ATOM 1213 C GLU A 290 -10.633 6.903 0.879 1.00 0.00 C ATOM 1214 O GLU A 290 -9.592 7.002 1.529 1.00 0.00 O ATOM 1215 CB GLU A 290 -12.064 5.497 2.373 1.00 0.00 C ATOM 1216 CG GLU A 290 -12.868 6.701 2.832 1.00 0.00 C ATOM 1217 CD GLU A 290 -14.254 6.746 2.217 1.00 0.00 C ATOM 1218 OE1 GLU A 290 -14.799 5.667 1.905 1.00 0.00 O ATOM 1219 OE2 GLU A 290 -14.792 7.860 2.047 1.00 0.00 O ATOM 0 H GLU A 290 -9.745 4.483 0.919 1.00 0.00 H new ATOM 0 HA GLU A 290 -12.311 5.735 0.251 1.00 0.00 H new ATOM 0 HB2 GLU A 290 -12.700 4.612 2.407 1.00 0.00 H new ATOM 0 HB3 GLU A 290 -11.246 5.329 3.073 1.00 0.00 H new ATOM 0 HG2 GLU A 290 -12.957 6.681 3.918 1.00 0.00 H new ATOM 0 HG3 GLU A 290 -12.330 7.613 2.573 1.00 0.00 H new ATOM 1226 N TRP A 291 -11.077 7.861 0.074 1.00 0.00 N ATOM 1227 CA TRP A 291 -10.350 9.114 -0.096 1.00 0.00 C ATOM 1228 C TRP A 291 -9.942 9.694 1.254 1.00 0.00 C ATOM 1229 O TRP A 291 -10.650 9.533 2.248 1.00 0.00 O ATOM 1230 CB TRP A 291 -11.206 10.125 -0.861 1.00 0.00 C ATOM 1231 CG TRP A 291 -11.356 9.795 -2.316 1.00 0.00 C ATOM 1232 CD1 TRP A 291 -12.521 9.548 -2.984 1.00 0.00 C ATOM 1233 CD2 TRP A 291 -10.305 9.675 -3.280 1.00 0.00 C ATOM 1234 NE1 TRP A 291 -12.257 9.281 -4.306 1.00 0.00 N ATOM 1235 CE2 TRP A 291 -10.905 9.354 -4.513 1.00 0.00 C ATOM 1236 CE3 TRP A 291 -8.915 9.810 -3.223 1.00 0.00 C ATOM 1237 CZ2 TRP A 291 -10.163 9.165 -5.676 1.00 0.00 C ATOM 1238 CZ3 TRP A 291 -8.179 9.622 -4.377 1.00 0.00 C ATOM 1239 CH2 TRP A 291 -8.804 9.303 -5.590 1.00 0.00 C ATOM 0 H TRP A 291 -11.936 7.795 -0.471 1.00 0.00 H new ATOM 0 HA TRP A 291 -9.447 8.906 -0.669 1.00 0.00 H new ATOM 0 HB2 TRP A 291 -12.194 10.174 -0.403 1.00 0.00 H new ATOM 0 HB3 TRP A 291 -10.760 11.115 -0.764 1.00 0.00 H new ATOM 0 HD1 TRP A 291 -13.505 9.561 -2.539 1.00 0.00 H new ATOM 0 HE1 TRP A 291 -12.955 9.064 -5.018 1.00 0.00 H new ATOM 0 HE3 TRP A 291 -8.425 10.057 -2.293 1.00 0.00 H new ATOM 0 HZ2 TRP A 291 -10.642 8.918 -6.612 1.00 0.00 H new ATOM 0 HZ3 TRP A 291 -7.104 9.723 -4.344 1.00 0.00 H new ATOM 0 HH2 TRP A 291 -8.201 9.163 -6.475 1.00 0.00 H new ATOM 1250 N ALA A 292 -8.798 10.369 1.282 1.00 0.00 N ATOM 1251 CA ALA A 292 -8.298 10.975 2.510 1.00 0.00 C ATOM 1252 C ALA A 292 -8.625 12.463 2.561 1.00 0.00 C ATOM 1253 O ALA A 292 -8.373 13.211 1.616 1.00 0.00 O ATOM 1254 CB ALA A 292 -6.797 10.758 2.632 1.00 0.00 C ATOM 0 H ALA A 292 -8.200 10.510 0.468 1.00 0.00 H new ATOM 0 HA ALA A 292 -8.794 10.492 3.352 1.00 0.00 H new ATOM 0 HB1 ALA A 292 -6.437 11.216 3.553 1.00 0.00 H new ATOM 0 HB2 ALA A 292 -6.584 9.689 2.650 1.00 0.00 H new ATOM 0 HB3 ALA A 292 -6.293 11.214 1.780 1.00 0.00 H new