USER MOD reduce.3.24.130724 H: found=0, std=0, add=324, rem=0, adj=7 USER MOD reduce.3.24.130724 removed 327 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 292 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 296 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 265 THR OG1 : rot 180:sc= 0 USER MOD Single : A 269 SER OG : rot 180:sc= -0.003 USER MOD Single : A 272 ASN : amide:sc= -0.25 K(o=-0.25,f=-3!) USER MOD Single : A 273 LYS NZ :NH3+ 143:sc= -0.0714 (180deg=-0.994) USER MOD Single : A 278 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 279 GLN : amide:sc= -0.348 K(o=-0.35,f=-1.3) USER MOD Single : A 280 MET CE :methyl 164:sc= -0.0979 (180deg=-0.665) USER MOD Single : A 285 SER OG : rot 180:sc= 0.0529 USER MOD Single : A 286 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 291 THR OG1 : rot 180:sc= 0 USER MOD Single : A 294 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 298 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 300 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ILE A 264 19.653 7.868 1.891 1.00 0.00 N ATOM 2 CA ILE A 264 20.201 6.506 1.625 1.00 0.00 C ATOM 3 C ILE A 264 19.327 5.444 2.298 1.00 0.00 C ATOM 4 O ILE A 264 19.753 4.328 2.524 1.00 0.00 O ATOM 5 CB ILE A 264 21.601 6.515 2.237 1.00 0.00 C ATOM 6 CG1 ILE A 264 22.337 5.233 1.843 1.00 0.00 C ATOM 7 CG2 ILE A 264 21.493 6.592 3.761 1.00 0.00 C ATOM 8 CD1 ILE A 264 23.847 5.459 1.941 1.00 0.00 C ATOM 0 HA ILE A 264 20.224 6.271 0.561 1.00 0.00 H new ATOM 0 HB ILE A 264 22.152 7.380 1.868 1.00 0.00 H new ATOM 0 HG12 ILE A 264 22.038 4.414 2.497 1.00 0.00 H new ATOM 0 HG13 ILE A 264 22.067 4.944 0.827 1.00 0.00 H new ATOM 0 HG21 ILE A 264 22.492 6.598 4.197 1.00 0.00 H new ATOM 0 HG22 ILE A 264 20.968 7.505 4.043 1.00 0.00 H new ATOM 0 HG23 ILE A 264 20.941 5.728 4.131 1.00 0.00 H new ATOM 0 HD11 ILE A 264 24.371 4.545 1.660 1.00 0.00 H new ATOM 0 HD12 ILE A 264 24.139 6.266 1.268 1.00 0.00 H new ATOM 0 HD13 ILE A 264 24.109 5.727 2.964 1.00 0.00 H new ATOM 22 N THR A 265 18.107 5.780 2.617 1.00 0.00 N ATOM 23 CA THR A 265 17.207 4.788 3.273 1.00 0.00 C ATOM 24 C THR A 265 16.859 3.664 2.294 1.00 0.00 C ATOM 25 O THR A 265 16.699 2.522 2.676 1.00 0.00 O ATOM 26 CB THR A 265 15.952 5.578 3.648 1.00 0.00 C ATOM 27 OG1 THR A 265 15.053 4.731 4.350 1.00 0.00 O ATOM 28 CG2 THR A 265 15.279 6.099 2.377 1.00 0.00 C ATOM 0 H THR A 265 17.694 6.698 2.452 1.00 0.00 H new ATOM 0 HA THR A 265 17.670 4.322 4.143 1.00 0.00 H new ATOM 0 HB THR A 265 16.227 6.420 4.283 1.00 0.00 H new ATOM 0 HG1 THR A 265 14.249 5.236 4.592 1.00 0.00 H new ATOM 0 HG21 THR A 265 14.385 6.662 2.644 1.00 0.00 H new ATOM 0 HG22 THR A 265 15.970 6.748 1.840 1.00 0.00 H new ATOM 0 HG23 THR A 265 15.002 5.258 1.741 1.00 0.00 H new ATOM 36 N GLY A 266 16.740 3.981 1.034 1.00 0.00 N ATOM 37 CA GLY A 266 16.401 2.934 0.031 1.00 0.00 C ATOM 38 C GLY A 266 14.990 3.180 -0.506 1.00 0.00 C ATOM 39 O GLY A 266 14.020 3.127 0.223 1.00 0.00 O ATOM 0 H GLY A 266 16.863 4.920 0.656 1.00 0.00 H new ATOM 0 HA2 GLY A 266 17.121 2.952 -0.787 1.00 0.00 H new ATOM 0 HA3 GLY A 266 16.461 1.946 0.487 1.00 0.00 H new ATOM 43 N ASP A 267 14.867 3.448 -1.778 1.00 0.00 N ATOM 44 CA ASP A 267 13.517 3.697 -2.361 1.00 0.00 C ATOM 45 C ASP A 267 12.730 2.386 -2.449 1.00 0.00 C ATOM 46 O ASP A 267 11.588 2.362 -2.863 1.00 0.00 O ATOM 47 CB ASP A 267 13.787 4.254 -3.758 1.00 0.00 C ATOM 48 CG ASP A 267 12.524 4.934 -4.289 1.00 0.00 C ATOM 49 OD1 ASP A 267 11.918 5.682 -3.540 1.00 0.00 O ATOM 50 OD2 ASP A 267 12.184 4.695 -5.437 1.00 0.00 O ATOM 0 H ASP A 267 15.642 3.505 -2.438 1.00 0.00 H new ATOM 0 HA ASP A 267 12.925 4.383 -1.756 1.00 0.00 H new ATOM 0 HB2 ASP A 267 14.610 4.968 -3.724 1.00 0.00 H new ATOM 0 HB3 ASP A 267 14.090 3.450 -4.429 1.00 0.00 H new ATOM 55 N VAL A 268 13.335 1.296 -2.063 1.00 0.00 N ATOM 56 CA VAL A 268 12.636 -0.011 -2.119 1.00 0.00 C ATOM 57 C VAL A 268 11.330 0.039 -1.326 1.00 0.00 C ATOM 58 O VAL A 268 10.819 1.096 -1.010 1.00 0.00 O ATOM 59 CB VAL A 268 13.619 -0.981 -1.474 1.00 0.00 C ATOM 60 CG1 VAL A 268 14.804 -1.210 -2.414 1.00 0.00 C ATOM 61 CG2 VAL A 268 14.122 -0.392 -0.153 1.00 0.00 C ATOM 0 H VAL A 268 14.291 1.259 -1.709 1.00 0.00 H new ATOM 0 HA VAL A 268 12.364 -0.299 -3.135 1.00 0.00 H new ATOM 0 HB VAL A 268 13.120 -1.931 -1.283 1.00 0.00 H new ATOM 0 HG11 VAL A 268 15.506 -1.904 -1.952 1.00 0.00 H new ATOM 0 HG12 VAL A 268 14.447 -1.629 -3.355 1.00 0.00 H new ATOM 0 HG13 VAL A 268 15.305 -0.261 -2.606 1.00 0.00 H new ATOM 0 HG21 VAL A 268 14.825 -1.084 0.310 1.00 0.00 H new ATOM 0 HG22 VAL A 268 14.621 0.558 -0.345 1.00 0.00 H new ATOM 0 HG23 VAL A 268 13.278 -0.230 0.518 1.00 0.00 H new ATOM 71 N SER A 269 10.789 -1.102 -1.008 1.00 0.00 N ATOM 72 CA SER A 269 9.514 -1.142 -0.237 1.00 0.00 C ATOM 73 C SER A 269 9.529 -0.085 0.870 1.00 0.00 C ATOM 74 O SER A 269 8.510 0.480 1.211 1.00 0.00 O ATOM 75 CB SER A 269 9.458 -2.546 0.363 1.00 0.00 C ATOM 76 OG SER A 269 10.577 -2.735 1.220 1.00 0.00 O ATOM 0 H SER A 269 11.176 -2.014 -1.250 1.00 0.00 H new ATOM 0 HA SER A 269 8.647 -0.931 -0.863 1.00 0.00 H new ATOM 0 HB2 SER A 269 8.531 -2.679 0.921 1.00 0.00 H new ATOM 0 HB3 SER A 269 9.462 -3.294 -0.430 1.00 0.00 H new ATOM 0 HG SER A 269 10.544 -3.634 1.608 1.00 0.00 H new ATOM 82 N ALA A 270 10.678 0.187 1.431 1.00 0.00 N ATOM 83 CA ALA A 270 10.756 1.210 2.511 1.00 0.00 C ATOM 84 C ALA A 270 9.887 2.415 2.148 1.00 0.00 C ATOM 85 O ALA A 270 8.958 2.759 2.851 1.00 0.00 O ATOM 86 CB ALA A 270 12.231 1.609 2.576 1.00 0.00 C ATOM 0 H ALA A 270 11.564 -0.255 1.187 1.00 0.00 H new ATOM 0 HA ALA A 270 10.398 0.833 3.469 1.00 0.00 H new ATOM 0 HB1 ALA A 270 12.370 2.362 3.351 1.00 0.00 H new ATOM 0 HB2 ALA A 270 12.835 0.732 2.809 1.00 0.00 H new ATOM 0 HB3 ALA A 270 12.540 2.017 1.614 1.00 0.00 H new ATOM 92 N ALA A 271 10.178 3.053 1.047 1.00 0.00 N ATOM 93 CA ALA A 271 9.368 4.224 0.630 1.00 0.00 C ATOM 94 C ALA A 271 7.997 3.755 0.140 1.00 0.00 C ATOM 95 O ALA A 271 6.979 4.353 0.434 1.00 0.00 O ATOM 96 CB ALA A 271 10.157 4.870 -0.510 1.00 0.00 C ATOM 0 H ALA A 271 10.944 2.810 0.419 1.00 0.00 H new ATOM 0 HA ALA A 271 9.196 4.925 1.447 1.00 0.00 H new ATOM 0 HB1 ALA A 271 9.620 5.746 -0.873 1.00 0.00 H new ATOM 0 HB2 ALA A 271 11.140 5.171 -0.147 1.00 0.00 H new ATOM 0 HB3 ALA A 271 10.274 4.154 -1.323 1.00 0.00 H new ATOM 102 N ASN A 272 7.965 2.681 -0.602 1.00 0.00 N ATOM 103 CA ASN A 272 6.663 2.164 -1.109 1.00 0.00 C ATOM 104 C ASN A 272 5.720 1.882 0.062 1.00 0.00 C ATOM 105 O ASN A 272 4.581 2.300 0.066 1.00 0.00 O ATOM 106 CB ASN A 272 7.011 0.868 -1.844 1.00 0.00 C ATOM 107 CG ASN A 272 6.756 1.046 -3.342 1.00 0.00 C ATOM 108 OD1 ASN A 272 6.499 2.142 -3.800 1.00 0.00 O ATOM 109 ND2 ASN A 272 6.816 0.007 -4.130 1.00 0.00 N ATOM 0 H ASN A 272 8.784 2.140 -0.879 1.00 0.00 H new ATOM 0 HA ASN A 272 6.158 2.877 -1.761 1.00 0.00 H new ATOM 0 HB2 ASN A 272 8.055 0.608 -1.671 1.00 0.00 H new ATOM 0 HB3 ASN A 272 6.409 0.045 -1.457 1.00 0.00 H new ATOM 0 HD21 ASN A 272 6.647 0.115 -5.130 1.00 0.00 H new ATOM 0 HD22 ASN A 272 7.032 -0.913 -3.746 1.00 0.00 H new ATOM 116 N LYS A 273 6.189 1.177 1.057 1.00 0.00 N ATOM 117 CA LYS A 273 5.321 0.871 2.229 1.00 0.00 C ATOM 118 C LYS A 273 4.509 2.108 2.619 1.00 0.00 C ATOM 119 O LYS A 273 3.301 2.135 2.493 1.00 0.00 O ATOM 120 CB LYS A 273 6.290 0.487 3.349 1.00 0.00 C ATOM 121 CG LYS A 273 6.108 -0.992 3.699 1.00 0.00 C ATOM 122 CD LYS A 273 7.475 -1.677 3.748 1.00 0.00 C ATOM 123 CE LYS A 273 7.632 -2.412 5.081 1.00 0.00 C ATOM 124 NZ LYS A 273 6.514 -3.396 5.112 1.00 0.00 N ATOM 0 H LYS A 273 7.136 0.800 1.108 1.00 0.00 H new ATOM 0 HA LYS A 273 4.606 0.075 2.020 1.00 0.00 H new ATOM 0 HB2 LYS A 273 7.317 0.673 3.035 1.00 0.00 H new ATOM 0 HB3 LYS A 273 6.108 1.105 4.229 1.00 0.00 H new ATOM 0 HG2 LYS A 273 5.606 -1.090 4.661 1.00 0.00 H new ATOM 0 HG3 LYS A 273 5.473 -1.477 2.957 1.00 0.00 H new ATOM 0 HD2 LYS A 273 7.571 -2.379 2.920 1.00 0.00 H new ATOM 0 HD3 LYS A 273 8.268 -0.938 3.633 1.00 0.00 H new ATOM 0 HE2 LYS A 273 8.599 -2.911 5.145 1.00 0.00 H new ATOM 0 HE3 LYS A 273 7.573 -1.721 5.922 1.00 0.00 H new ATOM 0 HZ1 LYS A 273 6.839 -4.277 5.559 1.00 0.00 H new ATOM 0 HZ2 LYS A 273 5.721 -3.003 5.658 1.00 0.00 H new ATOM 0 HZ3 LYS A 273 6.201 -3.596 4.141 1.00 0.00 H new ATOM 138 N ASP A 274 5.164 3.134 3.089 1.00 0.00 N ATOM 139 CA ASP A 274 4.432 4.368 3.483 1.00 0.00 C ATOM 140 C ASP A 274 3.393 4.729 2.418 1.00 0.00 C ATOM 141 O ASP A 274 2.213 4.818 2.692 1.00 0.00 O ATOM 142 CB ASP A 274 5.505 5.452 3.576 1.00 0.00 C ATOM 143 CG ASP A 274 4.993 6.605 4.441 1.00 0.00 C ATOM 144 OD1 ASP A 274 5.071 6.490 5.653 1.00 0.00 O ATOM 145 OD2 ASP A 274 4.531 7.583 3.877 1.00 0.00 O ATOM 0 H ASP A 274 6.175 3.170 3.217 1.00 0.00 H new ATOM 0 HA ASP A 274 3.893 4.247 4.423 1.00 0.00 H new ATOM 0 HB2 ASP A 274 6.418 5.039 4.005 1.00 0.00 H new ATOM 0 HB3 ASP A 274 5.757 5.815 2.580 1.00 0.00 H new ATOM 150 N ALA A 275 3.825 4.944 1.205 1.00 0.00 N ATOM 151 CA ALA A 275 2.868 5.305 0.125 1.00 0.00 C ATOM 152 C ALA A 275 1.800 4.218 -0.037 1.00 0.00 C ATOM 153 O ALA A 275 0.619 4.499 -0.100 1.00 0.00 O ATOM 154 CB ALA A 275 3.721 5.406 -1.140 1.00 0.00 C ATOM 0 H ALA A 275 4.802 4.885 0.917 1.00 0.00 H new ATOM 0 HA ALA A 275 2.340 6.233 0.342 1.00 0.00 H new ATOM 0 HB1 ALA A 275 3.087 5.670 -1.986 1.00 0.00 H new ATOM 0 HB2 ALA A 275 4.483 6.173 -1.005 1.00 0.00 H new ATOM 0 HB3 ALA A 275 4.202 4.447 -1.332 1.00 0.00 H new ATOM 160 N ILE A 276 2.207 2.981 -0.114 1.00 0.00 N ATOM 161 CA ILE A 276 1.225 1.876 -0.282 1.00 0.00 C ATOM 162 C ILE A 276 0.077 2.015 0.721 1.00 0.00 C ATOM 163 O ILE A 276 -1.018 2.411 0.374 1.00 0.00 O ATOM 164 CB ILE A 276 2.020 0.598 -0.013 1.00 0.00 C ATOM 165 CG1 ILE A 276 2.931 0.304 -1.208 1.00 0.00 C ATOM 166 CG2 ILE A 276 1.056 -0.572 0.188 1.00 0.00 C ATOM 167 CD1 ILE A 276 3.769 -0.942 -0.918 1.00 0.00 C ATOM 0 H ILE A 276 3.183 2.688 -0.067 1.00 0.00 H new ATOM 0 HA ILE A 276 0.773 1.878 -1.274 1.00 0.00 H new ATOM 0 HB ILE A 276 2.624 0.730 0.885 1.00 0.00 H new ATOM 0 HG12 ILE A 276 2.332 0.151 -2.106 1.00 0.00 H new ATOM 0 HG13 ILE A 276 3.582 1.156 -1.400 1.00 0.00 H new ATOM 0 HG21 ILE A 276 1.624 -1.482 0.380 1.00 0.00 H new ATOM 0 HG22 ILE A 276 0.405 -0.365 1.037 1.00 0.00 H new ATOM 0 HG23 ILE A 276 0.451 -0.704 -0.709 1.00 0.00 H new ATOM 0 HD11 ILE A 276 4.417 -1.151 -1.769 1.00 0.00 H new ATOM 0 HD12 ILE A 276 4.379 -0.772 -0.031 1.00 0.00 H new ATOM 0 HD13 ILE A 276 3.109 -1.793 -0.747 1.00 0.00 H new ATOM 179 N ARG A 277 0.316 1.685 1.961 1.00 0.00 N ATOM 180 CA ARG A 277 -0.769 1.794 2.981 1.00 0.00 C ATOM 181 C ARG A 277 -1.548 3.099 2.793 1.00 0.00 C ATOM 182 O ARG A 277 -2.761 3.102 2.733 1.00 0.00 O ATOM 183 CB ARG A 277 -0.058 1.774 4.337 1.00 0.00 C ATOM 184 CG ARG A 277 1.085 2.793 4.347 1.00 0.00 C ATOM 185 CD ARG A 277 2.247 2.243 5.177 1.00 0.00 C ATOM 186 NE ARG A 277 1.617 1.717 6.420 1.00 0.00 N ATOM 187 CZ ARG A 277 1.270 2.534 7.379 1.00 0.00 C ATOM 188 NH1 ARG A 277 1.465 3.819 7.251 1.00 0.00 N ATOM 189 NH2 ARG A 277 0.723 2.063 8.466 1.00 0.00 N ATOM 0 H ARG A 277 1.212 1.346 2.312 1.00 0.00 H new ATOM 0 HA ARG A 277 -1.492 0.982 2.897 1.00 0.00 H new ATOM 0 HB2 ARG A 277 -0.768 2.004 5.132 1.00 0.00 H new ATOM 0 HB3 ARG A 277 0.332 0.776 4.537 1.00 0.00 H new ATOM 0 HG2 ARG A 277 1.415 2.996 3.328 1.00 0.00 H new ATOM 0 HG3 ARG A 277 0.740 3.739 4.765 1.00 0.00 H new ATOM 0 HD2 ARG A 277 2.778 1.457 4.640 1.00 0.00 H new ATOM 0 HD3 ARG A 277 2.975 3.022 5.403 1.00 0.00 H new ATOM 0 HE ARG A 277 1.456 0.715 6.523 1.00 0.00 H new ATOM 0 HH11 ARG A 277 1.890 4.188 6.400 1.00 0.00 H new ATOM 0 HH12 ARG A 277 1.193 4.453 8.002 1.00 0.00 H new ATOM 0 HH21 ARG A 277 0.567 1.060 8.565 1.00 0.00 H new ATOM 0 HH22 ARG A 277 0.451 2.698 9.216 1.00 0.00 H new ATOM 203 N LYS A 278 -0.864 4.207 2.699 1.00 0.00 N ATOM 204 CA LYS A 278 -1.573 5.501 2.514 1.00 0.00 C ATOM 205 C LYS A 278 -2.566 5.397 1.353 1.00 0.00 C ATOM 206 O LYS A 278 -3.762 5.506 1.534 1.00 0.00 O ATOM 207 CB LYS A 278 -0.474 6.514 2.192 1.00 0.00 C ATOM 208 CG LYS A 278 -0.917 7.906 2.645 1.00 0.00 C ATOM 209 CD LYS A 278 0.237 8.599 3.371 1.00 0.00 C ATOM 210 CE LYS A 278 -0.321 9.509 4.467 1.00 0.00 C ATOM 211 NZ LYS A 278 -0.660 10.782 3.772 1.00 0.00 N ATOM 0 H LYS A 278 0.153 4.270 2.742 1.00 0.00 H new ATOM 0 HA LYS A 278 -2.145 5.789 3.396 1.00 0.00 H new ATOM 0 HB2 LYS A 278 0.452 6.234 2.694 1.00 0.00 H new ATOM 0 HB3 LYS A 278 -0.269 6.516 1.122 1.00 0.00 H new ATOM 0 HG2 LYS A 278 -1.227 8.498 1.784 1.00 0.00 H new ATOM 0 HG3 LYS A 278 -1.781 7.827 3.305 1.00 0.00 H new ATOM 0 HD2 LYS A 278 0.905 7.856 3.806 1.00 0.00 H new ATOM 0 HD3 LYS A 278 0.827 9.183 2.664 1.00 0.00 H new ATOM 0 HE2 LYS A 278 -1.201 9.069 4.936 1.00 0.00 H new ATOM 0 HE3 LYS A 278 0.413 9.673 5.256 1.00 0.00 H new ATOM 0 HZ1 LYS A 278 -1.050 11.459 4.458 1.00 0.00 H new ATOM 0 HZ2 LYS A 278 0.198 11.181 3.341 1.00 0.00 H new ATOM 0 HZ3 LYS A 278 -1.365 10.596 3.031 1.00 0.00 H new ATOM 225 N GLN A 279 -2.077 5.187 0.161 1.00 0.00 N ATOM 226 CA GLN A 279 -2.988 5.075 -1.011 1.00 0.00 C ATOM 227 C GLN A 279 -4.182 4.178 -0.673 1.00 0.00 C ATOM 228 O GLN A 279 -5.324 4.556 -0.843 1.00 0.00 O ATOM 229 CB GLN A 279 -2.139 4.443 -2.115 1.00 0.00 C ATOM 230 CG GLN A 279 -1.620 5.537 -3.051 1.00 0.00 C ATOM 231 CD GLN A 279 -2.803 6.262 -3.694 1.00 0.00 C ATOM 232 OE1 GLN A 279 -3.840 5.672 -3.927 1.00 0.00 O ATOM 233 NE2 GLN A 279 -2.692 7.528 -3.994 1.00 0.00 N ATOM 0 H GLN A 279 -1.084 5.088 -0.051 1.00 0.00 H new ATOM 0 HA GLN A 279 -3.393 6.042 -1.310 1.00 0.00 H new ATOM 0 HB2 GLN A 279 -1.303 3.897 -1.678 1.00 0.00 H new ATOM 0 HB3 GLN A 279 -2.732 3.721 -2.676 1.00 0.00 H new ATOM 0 HG2 GLN A 279 -1.005 6.245 -2.495 1.00 0.00 H new ATOM 0 HG3 GLN A 279 -0.985 5.100 -3.822 1.00 0.00 H new ATOM 0 HE21 GLN A 279 -1.822 8.024 -3.799 1.00 0.00 H new ATOM 0 HE22 GLN A 279 -3.475 8.021 -4.423 1.00 0.00 H new ATOM 242 N MET A 280 -3.926 2.990 -0.196 1.00 0.00 N ATOM 243 CA MET A 280 -5.046 2.067 0.151 1.00 0.00 C ATOM 244 C MET A 280 -6.034 2.761 1.090 1.00 0.00 C ATOM 245 O MET A 280 -7.204 2.882 0.792 1.00 0.00 O ATOM 246 CB MET A 280 -4.381 0.881 0.853 1.00 0.00 C ATOM 247 CG MET A 280 -4.082 -0.217 -0.170 1.00 0.00 C ATOM 248 SD MET A 280 -4.731 -1.798 0.430 1.00 0.00 S ATOM 249 CE MET A 280 -3.427 -2.137 1.638 1.00 0.00 C ATOM 0 H MET A 280 -2.991 2.618 -0.031 1.00 0.00 H new ATOM 0 HA MET A 280 -5.610 1.756 -0.728 1.00 0.00 H new ATOM 0 HB2 MET A 280 -3.459 1.202 1.337 1.00 0.00 H new ATOM 0 HB3 MET A 280 -5.034 0.495 1.636 1.00 0.00 H new ATOM 0 HG2 MET A 280 -4.534 0.033 -1.130 1.00 0.00 H new ATOM 0 HG3 MET A 280 -3.007 -0.292 -0.334 1.00 0.00 H new ATOM 0 HE1 MET A 280 -3.761 -2.914 2.325 1.00 0.00 H new ATOM 0 HE2 MET A 280 -2.529 -2.473 1.119 1.00 0.00 H new ATOM 0 HE3 MET A 280 -3.205 -1.229 2.198 1.00 0.00 H new ATOM 259 N ASP A 281 -5.574 3.215 2.223 1.00 0.00 N ATOM 260 CA ASP A 281 -6.492 3.899 3.180 1.00 0.00 C ATOM 261 C ASP A 281 -7.424 4.855 2.430 1.00 0.00 C ATOM 262 O ASP A 281 -8.626 4.679 2.412 1.00 0.00 O ATOM 263 CB ASP A 281 -5.574 4.678 4.122 1.00 0.00 C ATOM 264 CG ASP A 281 -6.286 4.903 5.457 1.00 0.00 C ATOM 265 OD1 ASP A 281 -7.188 4.139 5.761 1.00 0.00 O ATOM 266 OD2 ASP A 281 -5.917 5.834 6.154 1.00 0.00 O ATOM 0 H ASP A 281 -4.603 3.143 2.528 1.00 0.00 H new ATOM 0 HA ASP A 281 -7.126 3.194 3.718 1.00 0.00 H new ATOM 0 HB2 ASP A 281 -4.646 4.128 4.281 1.00 0.00 H new ATOM 0 HB3 ASP A 281 -5.305 5.635 3.675 1.00 0.00 H new ATOM 271 N ALA A 282 -6.878 5.868 1.817 1.00 0.00 N ATOM 272 CA ALA A 282 -7.728 6.839 1.072 1.00 0.00 C ATOM 273 C ALA A 282 -8.816 6.105 0.281 1.00 0.00 C ATOM 274 O ALA A 282 -9.993 6.257 0.540 1.00 0.00 O ATOM 275 CB ALA A 282 -6.768 7.559 0.124 1.00 0.00 C ATOM 0 H ALA A 282 -5.878 6.066 1.800 1.00 0.00 H new ATOM 0 HA ALA A 282 -8.240 7.532 1.740 1.00 0.00 H new ATOM 0 HB1 ALA A 282 -7.319 8.294 -0.463 1.00 0.00 H new ATOM 0 HB2 ALA A 282 -5.995 8.063 0.703 1.00 0.00 H new ATOM 0 HB3 ALA A 282 -6.305 6.834 -0.545 1.00 0.00 H new ATOM 281 N ALA A 283 -8.432 5.318 -0.686 1.00 0.00 N ATOM 282 CA ALA A 283 -9.445 4.583 -1.500 1.00 0.00 C ATOM 283 C ALA A 283 -10.182 3.549 -0.643 1.00 0.00 C ATOM 284 O ALA A 283 -11.238 3.069 -1.007 1.00 0.00 O ATOM 285 CB ALA A 283 -8.639 3.889 -2.597 1.00 0.00 C ATOM 0 H ALA A 283 -7.461 5.151 -0.949 1.00 0.00 H new ATOM 0 HA ALA A 283 -10.205 5.251 -1.905 1.00 0.00 H new ATOM 0 HB1 ALA A 283 -9.313 3.324 -3.242 1.00 0.00 H new ATOM 0 HB2 ALA A 283 -8.112 4.637 -3.189 1.00 0.00 H new ATOM 0 HB3 ALA A 283 -7.917 3.210 -2.144 1.00 0.00 H new ATOM 291 N ALA A 284 -9.634 3.195 0.486 1.00 0.00 N ATOM 292 CA ALA A 284 -10.306 2.184 1.354 1.00 0.00 C ATOM 293 C ALA A 284 -11.574 2.770 1.985 1.00 0.00 C ATOM 294 O ALA A 284 -12.677 2.456 1.586 1.00 0.00 O ATOM 295 CB ALA A 284 -9.279 1.841 2.433 1.00 0.00 C ATOM 0 H ALA A 284 -8.752 3.560 0.846 1.00 0.00 H new ATOM 0 HA ALA A 284 -10.616 1.305 0.790 1.00 0.00 H new ATOM 0 HB1 ALA A 284 -9.700 1.101 3.113 1.00 0.00 H new ATOM 0 HB2 ALA A 284 -8.382 1.436 1.965 1.00 0.00 H new ATOM 0 HB3 ALA A 284 -9.022 2.742 2.991 1.00 0.00 H new ATOM 301 N SER A 285 -11.427 3.613 2.972 1.00 0.00 N ATOM 302 CA SER A 285 -12.626 4.206 3.629 1.00 0.00 C ATOM 303 C SER A 285 -13.120 5.428 2.849 1.00 0.00 C ATOM 304 O SER A 285 -13.482 6.436 3.423 1.00 0.00 O ATOM 305 CB SER A 285 -12.151 4.619 5.022 1.00 0.00 C ATOM 306 OG SER A 285 -10.979 5.415 4.902 1.00 0.00 O ATOM 0 H SER A 285 -10.530 3.916 3.351 1.00 0.00 H new ATOM 0 HA SER A 285 -13.458 3.503 3.670 1.00 0.00 H new ATOM 0 HB2 SER A 285 -12.934 5.178 5.535 1.00 0.00 H new ATOM 0 HB3 SER A 285 -11.944 3.735 5.625 1.00 0.00 H new ATOM 0 HG SER A 285 -10.673 5.683 5.794 1.00 0.00 H new ATOM 312 N LYS A 286 -13.143 5.349 1.546 1.00 0.00 N ATOM 313 CA LYS A 286 -13.617 6.507 0.740 1.00 0.00 C ATOM 314 C LYS A 286 -14.740 6.076 -0.209 1.00 0.00 C ATOM 315 O LYS A 286 -15.453 6.896 -0.753 1.00 0.00 O ATOM 316 CB LYS A 286 -12.393 6.974 -0.049 1.00 0.00 C ATOM 317 CG LYS A 286 -12.831 7.953 -1.140 1.00 0.00 C ATOM 318 CD LYS A 286 -11.941 9.196 -1.098 1.00 0.00 C ATOM 319 CE LYS A 286 -11.332 9.437 -2.481 1.00 0.00 C ATOM 320 NZ LYS A 286 -11.344 10.917 -2.652 1.00 0.00 N ATOM 0 H LYS A 286 -12.854 4.533 1.007 1.00 0.00 H new ATOM 0 HA LYS A 286 -14.024 7.302 1.366 1.00 0.00 H new ATOM 0 HB2 LYS A 286 -11.678 7.454 0.619 1.00 0.00 H new ATOM 0 HB3 LYS A 286 -11.887 6.118 -0.496 1.00 0.00 H new ATOM 0 HG2 LYS A 286 -12.764 7.477 -2.118 1.00 0.00 H new ATOM 0 HG3 LYS A 286 -13.874 8.234 -0.994 1.00 0.00 H new ATOM 0 HD2 LYS A 286 -12.525 10.064 -0.790 1.00 0.00 H new ATOM 0 HD3 LYS A 286 -11.151 9.065 -0.359 1.00 0.00 H new ATOM 0 HE2 LYS A 286 -10.318 9.040 -2.541 1.00 0.00 H new ATOM 0 HE3 LYS A 286 -11.914 8.944 -3.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 286 -10.941 11.163 -3.579 1.00 0.00 H new ATOM 0 HZ2 LYS A 286 -12.323 11.265 -2.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 286 -10.777 11.358 -1.900 1.00 0.00 H new ATOM 334 N GLY A 287 -14.905 4.798 -0.412 1.00 0.00 N ATOM 335 CA GLY A 287 -15.982 4.322 -1.326 1.00 0.00 C ATOM 336 C GLY A 287 -15.388 3.360 -2.355 1.00 0.00 C ATOM 337 O GLY A 287 -15.879 2.267 -2.553 1.00 0.00 O ATOM 0 H GLY A 287 -14.341 4.063 0.015 1.00 0.00 H new ATOM 0 HA2 GLY A 287 -16.764 3.823 -0.755 1.00 0.00 H new ATOM 0 HA3 GLY A 287 -16.447 5.169 -1.830 1.00 0.00 H new ATOM 341 N ASP A 288 -14.332 3.757 -3.009 1.00 0.00 N ATOM 342 CA ASP A 288 -13.705 2.862 -4.022 1.00 0.00 C ATOM 343 C ASP A 288 -12.833 1.816 -3.324 1.00 0.00 C ATOM 344 O ASP A 288 -11.662 1.673 -3.616 1.00 0.00 O ATOM 345 CB ASP A 288 -12.850 3.785 -4.890 1.00 0.00 C ATOM 346 CG ASP A 288 -12.962 3.357 -6.355 1.00 0.00 C ATOM 347 OD1 ASP A 288 -14.048 2.975 -6.758 1.00 0.00 O ATOM 348 OD2 ASP A 288 -11.960 3.419 -7.047 1.00 0.00 O ATOM 0 H ASP A 288 -13.876 4.661 -2.886 1.00 0.00 H new ATOM 0 HA ASP A 288 -14.443 2.320 -4.613 1.00 0.00 H new ATOM 0 HB2 ASP A 288 -13.180 4.818 -4.776 1.00 0.00 H new ATOM 0 HB3 ASP A 288 -11.810 3.745 -4.567 1.00 0.00 H new ATOM 353 N VAL A 289 -13.397 1.086 -2.402 1.00 0.00 N ATOM 354 CA VAL A 289 -12.604 0.050 -1.681 1.00 0.00 C ATOM 355 C VAL A 289 -12.001 -0.943 -2.678 1.00 0.00 C ATOM 356 O VAL A 289 -11.097 -1.688 -2.357 1.00 0.00 O ATOM 357 CB VAL A 289 -13.606 -0.648 -0.761 1.00 0.00 C ATOM 358 CG1 VAL A 289 -12.856 -1.532 0.236 1.00 0.00 C ATOM 359 CG2 VAL A 289 -14.414 0.405 0.002 1.00 0.00 C ATOM 0 H VAL A 289 -14.373 1.162 -2.116 1.00 0.00 H new ATOM 0 HA VAL A 289 -11.773 0.480 -1.122 1.00 0.00 H new ATOM 0 HB VAL A 289 -14.278 -1.264 -1.358 1.00 0.00 H new ATOM 0 HG11 VAL A 289 -13.571 -2.029 0.891 1.00 0.00 H new ATOM 0 HG12 VAL A 289 -12.278 -2.281 -0.305 1.00 0.00 H new ATOM 0 HG13 VAL A 289 -12.183 -0.917 0.833 1.00 0.00 H new ATOM 0 HG21 VAL A 289 -15.129 -0.091 0.659 1.00 0.00 H new ATOM 0 HG22 VAL A 289 -13.739 1.020 0.598 1.00 0.00 H new ATOM 0 HG23 VAL A 289 -14.949 1.037 -0.707 1.00 0.00 H new ATOM 369 N GLU A 290 -12.489 -0.956 -3.888 1.00 0.00 N ATOM 370 CA GLU A 290 -11.940 -1.892 -4.902 1.00 0.00 C ATOM 371 C GLU A 290 -10.413 -1.858 -4.864 1.00 0.00 C ATOM 372 O GLU A 290 -9.761 -2.847 -4.599 1.00 0.00 O ATOM 373 CB GLU A 290 -12.451 -1.353 -6.234 1.00 0.00 C ATOM 374 CG GLU A 290 -12.359 -2.445 -7.302 1.00 0.00 C ATOM 375 CD GLU A 290 -13.645 -2.459 -8.130 1.00 0.00 C ATOM 376 OE1 GLU A 290 -13.780 -1.609 -8.994 1.00 0.00 O ATOM 377 OE2 GLU A 290 -14.473 -3.321 -7.885 1.00 0.00 O ATOM 0 H GLU A 290 -13.246 -0.356 -4.216 1.00 0.00 H new ATOM 0 HA GLU A 290 -12.243 -2.925 -4.732 1.00 0.00 H new ATOM 0 HB2 GLU A 290 -13.483 -1.019 -6.130 1.00 0.00 H new ATOM 0 HB3 GLU A 290 -11.864 -0.486 -6.536 1.00 0.00 H new ATOM 0 HG2 GLU A 290 -11.500 -2.265 -7.948 1.00 0.00 H new ATOM 0 HG3 GLU A 290 -12.206 -3.416 -6.832 1.00 0.00 H new ATOM 384 N THR A 291 -9.842 -0.719 -5.131 1.00 0.00 N ATOM 385 CA THR A 291 -8.361 -0.602 -5.116 1.00 0.00 C ATOM 386 C THR A 291 -7.814 -0.929 -3.723 1.00 0.00 C ATOM 387 O THR A 291 -6.689 -1.364 -3.574 1.00 0.00 O ATOM 388 CB THR A 291 -8.077 0.857 -5.476 1.00 0.00 C ATOM 389 OG1 THR A 291 -8.290 1.050 -6.867 1.00 0.00 O ATOM 390 CG2 THR A 291 -6.627 1.198 -5.128 1.00 0.00 C ATOM 0 H THR A 291 -10.341 0.140 -5.360 1.00 0.00 H new ATOM 0 HA THR A 291 -7.886 -1.295 -5.811 1.00 0.00 H new ATOM 0 HB THR A 291 -8.746 1.507 -4.912 1.00 0.00 H new ATOM 0 HG1 THR A 291 -8.110 1.985 -7.099 1.00 0.00 H new ATOM 0 HG21 THR A 291 -6.426 2.238 -5.385 1.00 0.00 H new ATOM 0 HG22 THR A 291 -6.465 1.050 -4.060 1.00 0.00 H new ATOM 0 HG23 THR A 291 -5.956 0.549 -5.690 1.00 0.00 H new ATOM 398 N TYR A 292 -8.600 -0.718 -2.701 1.00 0.00 N ATOM 399 CA TYR A 292 -8.123 -1.011 -1.318 1.00 0.00 C ATOM 400 C TYR A 292 -7.924 -2.518 -1.127 1.00 0.00 C ATOM 401 O TYR A 292 -6.820 -2.988 -0.940 1.00 0.00 O ATOM 402 CB TYR A 292 -9.230 -0.496 -0.397 1.00 0.00 C ATOM 403 CG TYR A 292 -8.849 -0.749 1.043 1.00 0.00 C ATOM 404 CD1 TYR A 292 -7.514 -0.630 1.445 1.00 0.00 C ATOM 405 CD2 TYR A 292 -9.832 -1.104 1.975 1.00 0.00 C ATOM 406 CE1 TYR A 292 -7.161 -0.866 2.779 1.00 0.00 C ATOM 407 CE2 TYR A 292 -9.479 -1.339 3.309 1.00 0.00 C ATOM 408 CZ TYR A 292 -8.143 -1.221 3.711 1.00 0.00 C ATOM 409 OH TYR A 292 -7.795 -1.454 5.027 1.00 0.00 O ATOM 0 H TYR A 292 -9.551 -0.356 -2.764 1.00 0.00 H new ATOM 0 HA TYR A 292 -7.164 -0.538 -1.108 1.00 0.00 H new ATOM 0 HB2 TYR A 292 -9.386 0.570 -0.560 1.00 0.00 H new ATOM 0 HB3 TYR A 292 -10.171 -0.995 -0.628 1.00 0.00 H new ATOM 0 HD1 TYR A 292 -6.756 -0.356 0.726 1.00 0.00 H new ATOM 0 HD2 TYR A 292 -10.862 -1.196 1.665 1.00 0.00 H new ATOM 0 HE1 TYR A 292 -6.131 -0.774 3.089 1.00 0.00 H new ATOM 0 HE2 TYR A 292 -10.237 -1.611 4.028 1.00 0.00 H new ATOM 0 HH TYR A 292 -8.596 -1.689 5.541 1.00 0.00 H new ATOM 419 N ARG A 293 -8.985 -3.279 -1.166 1.00 0.00 N ATOM 420 CA ARG A 293 -8.850 -4.750 -0.977 1.00 0.00 C ATOM 421 C ARG A 293 -7.742 -5.302 -1.881 1.00 0.00 C ATOM 422 O ARG A 293 -6.918 -6.087 -1.457 1.00 0.00 O ATOM 423 CB ARG A 293 -10.214 -5.334 -1.358 1.00 0.00 C ATOM 424 CG ARG A 293 -10.356 -5.384 -2.880 1.00 0.00 C ATOM 425 CD ARG A 293 -11.739 -5.930 -3.246 1.00 0.00 C ATOM 426 NE ARG A 293 -11.510 -6.790 -4.440 1.00 0.00 N ATOM 427 CZ ARG A 293 -10.890 -7.934 -4.317 1.00 0.00 C ATOM 428 NH1 ARG A 293 -10.467 -8.329 -3.147 1.00 0.00 N ATOM 429 NH2 ARG A 293 -10.694 -8.683 -5.367 1.00 0.00 N ATOM 0 H ARG A 293 -9.937 -2.945 -1.320 1.00 0.00 H new ATOM 0 HA ARG A 293 -8.577 -5.011 0.045 1.00 0.00 H new ATOM 0 HB2 ARG A 293 -10.319 -6.336 -0.942 1.00 0.00 H new ATOM 0 HB3 ARG A 293 -11.011 -4.726 -0.930 1.00 0.00 H new ATOM 0 HG2 ARG A 293 -10.224 -4.387 -3.301 1.00 0.00 H new ATOM 0 HG3 ARG A 293 -9.578 -6.017 -3.308 1.00 0.00 H new ATOM 0 HD2 ARG A 293 -12.168 -6.503 -2.423 1.00 0.00 H new ATOM 0 HD3 ARG A 293 -12.436 -5.122 -3.469 1.00 0.00 H new ATOM 0 HE ARG A 293 -11.838 -6.485 -5.357 1.00 0.00 H new ATOM 0 HH11 ARG A 293 -10.620 -7.744 -2.325 1.00 0.00 H new ATOM 0 HH12 ARG A 293 -9.984 -9.222 -3.054 1.00 0.00 H new ATOM 0 HH21 ARG A 293 -11.024 -8.375 -6.282 1.00 0.00 H new ATOM 0 HH22 ARG A 293 -10.210 -9.576 -5.273 1.00 0.00 H new ATOM 443 N LYS A 294 -7.714 -4.898 -3.122 1.00 0.00 N ATOM 444 CA LYS A 294 -6.660 -5.400 -4.043 1.00 0.00 C ATOM 445 C LYS A 294 -5.275 -5.182 -3.427 1.00 0.00 C ATOM 446 O LYS A 294 -4.592 -6.120 -3.062 1.00 0.00 O ATOM 447 CB LYS A 294 -6.818 -4.570 -5.318 1.00 0.00 C ATOM 448 CG LYS A 294 -5.927 -5.150 -6.419 1.00 0.00 C ATOM 449 CD LYS A 294 -6.480 -6.505 -6.864 1.00 0.00 C ATOM 450 CE LYS A 294 -6.118 -6.748 -8.331 1.00 0.00 C ATOM 451 NZ LYS A 294 -7.334 -6.356 -9.097 1.00 0.00 N ATOM 0 H LYS A 294 -8.376 -4.242 -3.536 1.00 0.00 H new ATOM 0 HA LYS A 294 -6.756 -6.468 -4.239 1.00 0.00 H new ATOM 0 HB2 LYS A 294 -7.860 -4.573 -5.639 1.00 0.00 H new ATOM 0 HB3 LYS A 294 -6.547 -3.532 -5.125 1.00 0.00 H new ATOM 0 HG2 LYS A 294 -5.887 -4.466 -7.267 1.00 0.00 H new ATOM 0 HG3 LYS A 294 -4.907 -5.264 -6.053 1.00 0.00 H new ATOM 0 HD2 LYS A 294 -6.070 -7.300 -6.241 1.00 0.00 H new ATOM 0 HD3 LYS A 294 -7.562 -6.527 -6.737 1.00 0.00 H new ATOM 0 HE2 LYS A 294 -5.255 -6.153 -8.629 1.00 0.00 H new ATOM 0 HE3 LYS A 294 -5.860 -7.793 -8.506 1.00 0.00 H new ATOM 0 HZ1 LYS A 294 -7.164 -6.495 -10.114 1.00 0.00 H new ATOM 0 HZ2 LYS A 294 -8.138 -6.944 -8.797 1.00 0.00 H new ATOM 0 HZ3 LYS A 294 -7.551 -5.355 -8.916 1.00 0.00 H new ATOM 465 N LEU A 295 -4.858 -3.951 -3.307 1.00 0.00 N ATOM 466 CA LEU A 295 -3.522 -3.671 -2.713 1.00 0.00 C ATOM 467 C LEU A 295 -3.300 -4.558 -1.486 1.00 0.00 C ATOM 468 O LEU A 295 -2.292 -5.224 -1.363 1.00 0.00 O ATOM 469 CB LEU A 295 -3.565 -2.197 -2.311 1.00 0.00 C ATOM 470 CG LEU A 295 -2.928 -1.347 -3.412 1.00 0.00 C ATOM 471 CD1 LEU A 295 -4.019 -0.584 -4.164 1.00 0.00 C ATOM 472 CD2 LEU A 295 -1.950 -0.350 -2.785 1.00 0.00 C ATOM 0 H LEU A 295 -5.386 -3.127 -3.595 1.00 0.00 H new ATOM 0 HA LEU A 295 -2.708 -3.876 -3.408 1.00 0.00 H new ATOM 0 HB2 LEU A 295 -4.596 -1.884 -2.147 1.00 0.00 H new ATOM 0 HB3 LEU A 295 -3.034 -2.050 -1.371 1.00 0.00 H new ATOM 0 HG LEU A 295 -2.393 -1.995 -4.106 1.00 0.00 H new ATOM 0 HD11 LEU A 295 -3.565 0.022 -4.948 1.00 0.00 H new ATOM 0 HD12 LEU A 295 -4.717 -1.293 -4.611 1.00 0.00 H new ATOM 0 HD13 LEU A 295 -4.554 0.064 -3.470 1.00 0.00 H new ATOM 0 HD21 LEU A 295 -1.496 0.256 -3.569 1.00 0.00 H new ATOM 0 HD22 LEU A 295 -2.486 0.297 -2.090 1.00 0.00 H new ATOM 0 HD23 LEU A 295 -1.171 -0.892 -2.249 1.00 0.00 H new ATOM 484 N LYS A 296 -4.238 -4.571 -0.577 1.00 0.00 N ATOM 485 CA LYS A 296 -4.086 -5.415 0.640 1.00 0.00 C ATOM 486 C LYS A 296 -3.524 -6.786 0.260 1.00 0.00 C ATOM 487 O LYS A 296 -2.421 -7.139 0.627 1.00 0.00 O ATOM 488 CB LYS A 296 -5.498 -5.553 1.209 1.00 0.00 C ATOM 489 CG LYS A 296 -5.421 -6.052 2.653 1.00 0.00 C ATOM 490 CD LYS A 296 -6.399 -5.257 3.521 1.00 0.00 C ATOM 491 CE LYS A 296 -6.996 -6.176 4.589 1.00 0.00 C ATOM 492 NZ LYS A 296 -7.353 -5.271 5.717 1.00 0.00 N ATOM 0 H LYS A 296 -5.103 -4.033 -0.626 1.00 0.00 H new ATOM 0 HA LYS A 296 -3.399 -4.977 1.364 1.00 0.00 H new ATOM 0 HB2 LYS A 296 -6.012 -4.592 1.172 1.00 0.00 H new ATOM 0 HB3 LYS A 296 -6.079 -6.249 0.603 1.00 0.00 H new ATOM 0 HG2 LYS A 296 -5.662 -7.114 2.695 1.00 0.00 H new ATOM 0 HG3 LYS A 296 -4.406 -5.940 3.034 1.00 0.00 H new ATOM 0 HD2 LYS A 296 -5.885 -4.419 3.993 1.00 0.00 H new ATOM 0 HD3 LYS A 296 -7.192 -4.837 2.903 1.00 0.00 H new ATOM 0 HE2 LYS A 296 -7.873 -6.702 4.212 1.00 0.00 H new ATOM 0 HE3 LYS A 296 -6.279 -6.935 4.903 1.00 0.00 H new ATOM 0 HZ1 LYS A 296 -7.769 -5.828 6.490 1.00 0.00 H new ATOM 0 HZ2 LYS A 296 -6.497 -4.789 6.059 1.00 0.00 H new ATOM 0 HZ3 LYS A 296 -8.042 -4.564 5.390 1.00 0.00 H new ATOM 506 N ALA A 297 -4.275 -7.560 -0.477 1.00 0.00 N ATOM 507 CA ALA A 297 -3.786 -8.905 -0.886 1.00 0.00 C ATOM 508 C ALA A 297 -2.317 -8.822 -1.304 1.00 0.00 C ATOM 509 O ALA A 297 -1.470 -9.516 -0.777 1.00 0.00 O ATOM 510 CB ALA A 297 -4.661 -9.301 -2.075 1.00 0.00 C ATOM 0 H ALA A 297 -5.207 -7.317 -0.813 1.00 0.00 H new ATOM 0 HA ALA A 297 -3.848 -9.633 -0.077 1.00 0.00 H new ATOM 0 HB1 ALA A 297 -4.361 -10.285 -2.435 1.00 0.00 H new ATOM 0 HB2 ALA A 297 -5.705 -9.331 -1.764 1.00 0.00 H new ATOM 0 HB3 ALA A 297 -4.541 -8.570 -2.874 1.00 0.00 H new ATOM 516 N LYS A 298 -2.008 -7.974 -2.247 1.00 0.00 N ATOM 517 CA LYS A 298 -0.595 -7.844 -2.694 1.00 0.00 C ATOM 518 C LYS A 298 0.333 -7.747 -1.481 1.00 0.00 C ATOM 519 O LYS A 298 1.237 -8.540 -1.312 1.00 0.00 O ATOM 520 CB LYS A 298 -0.555 -6.549 -3.508 1.00 0.00 C ATOM 521 CG LYS A 298 0.289 -6.763 -4.765 1.00 0.00 C ATOM 522 CD LYS A 298 -0.541 -7.500 -5.818 1.00 0.00 C ATOM 523 CE LYS A 298 0.391 -8.264 -6.760 1.00 0.00 C ATOM 524 NZ LYS A 298 -0.433 -8.546 -7.969 1.00 0.00 N ATOM 0 H LYS A 298 -2.673 -7.367 -2.726 1.00 0.00 H new ATOM 0 HA LYS A 298 -0.264 -8.702 -3.279 1.00 0.00 H new ATOM 0 HB2 LYS A 298 -1.566 -6.248 -3.783 1.00 0.00 H new ATOM 0 HB3 LYS A 298 -0.134 -5.742 -2.908 1.00 0.00 H new ATOM 0 HG2 LYS A 298 0.625 -5.803 -5.158 1.00 0.00 H new ATOM 0 HG3 LYS A 298 1.182 -7.339 -4.522 1.00 0.00 H new ATOM 0 HD2 LYS A 298 -1.232 -8.190 -5.334 1.00 0.00 H new ATOM 0 HD3 LYS A 298 -1.144 -6.790 -6.383 1.00 0.00 H new ATOM 0 HE2 LYS A 298 1.271 -7.672 -7.011 1.00 0.00 H new ATOM 0 HE3 LYS A 298 0.748 -9.186 -6.301 1.00 0.00 H new ATOM 0 HZ1 LYS A 298 0.137 -9.069 -8.664 1.00 0.00 H new ATOM 0 HZ2 LYS A 298 -1.260 -9.117 -7.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 298 -0.753 -7.649 -8.388 1.00 0.00 H new ATOM 538 N LEU A 299 0.112 -6.778 -0.633 1.00 0.00 N ATOM 539 CA LEU A 299 0.975 -6.625 0.571 1.00 0.00 C ATOM 540 C LEU A 299 1.256 -7.993 1.201 1.00 0.00 C ATOM 541 O LEU A 299 2.377 -8.309 1.546 1.00 0.00 O ATOM 542 CB LEU A 299 0.165 -5.751 1.528 1.00 0.00 C ATOM 543 CG LEU A 299 1.077 -5.228 2.640 1.00 0.00 C ATOM 544 CD1 LEU A 299 1.994 -4.140 2.080 1.00 0.00 C ATOM 545 CD2 LEU A 299 0.222 -4.643 3.766 1.00 0.00 C ATOM 0 H LEU A 299 -0.631 -6.085 -0.724 1.00 0.00 H new ATOM 0 HA LEU A 299 1.942 -6.182 0.332 1.00 0.00 H new ATOM 0 HB2 LEU A 299 -0.280 -4.917 0.986 1.00 0.00 H new ATOM 0 HB3 LEU A 299 -0.655 -6.327 1.957 1.00 0.00 H new ATOM 0 HG LEU A 299 1.682 -6.047 3.029 1.00 0.00 H new ATOM 0 HD11 LEU A 299 2.643 -3.768 2.873 1.00 0.00 H new ATOM 0 HD12 LEU A 299 2.603 -4.555 1.277 1.00 0.00 H new ATOM 0 HD13 LEU A 299 1.390 -3.320 1.691 1.00 0.00 H new ATOM 0 HD21 LEU A 299 0.870 -4.270 4.559 1.00 0.00 H new ATOM 0 HD22 LEU A 299 -0.382 -3.824 3.376 1.00 0.00 H new ATOM 0 HD23 LEU A 299 -0.432 -5.418 4.166 1.00 0.00 H new ATOM 557 N LYS A 300 0.245 -8.805 1.353 1.00 0.00 N ATOM 558 CA LYS A 300 0.455 -10.151 1.962 1.00 0.00 C ATOM 559 C LYS A 300 1.727 -10.792 1.402 1.00 0.00 C ATOM 560 O LYS A 300 2.427 -11.509 2.090 1.00 0.00 O ATOM 561 CB LYS A 300 -0.777 -10.964 1.560 1.00 0.00 C ATOM 562 CG LYS A 300 -0.868 -12.217 2.434 1.00 0.00 C ATOM 563 CD LYS A 300 -0.343 -13.424 1.654 1.00 0.00 C ATOM 564 CE LYS A 300 -1.277 -14.617 1.868 1.00 0.00 C ATOM 565 NZ LYS A 300 -0.489 -15.580 2.687 1.00 0.00 N ATOM 0 H LYS A 300 -0.716 -8.596 1.083 1.00 0.00 H new ATOM 0 HA LYS A 300 0.575 -10.101 3.044 1.00 0.00 H new ATOM 0 HB2 LYS A 300 -1.678 -10.361 1.675 1.00 0.00 H new ATOM 0 HB3 LYS A 300 -0.714 -11.245 0.509 1.00 0.00 H new ATOM 0 HG2 LYS A 300 -0.287 -12.080 3.346 1.00 0.00 H new ATOM 0 HG3 LYS A 300 -1.901 -12.388 2.737 1.00 0.00 H new ATOM 0 HD2 LYS A 300 -0.279 -13.184 0.593 1.00 0.00 H new ATOM 0 HD3 LYS A 300 0.665 -13.674 1.985 1.00 0.00 H new ATOM 0 HE2 LYS A 300 -2.190 -14.316 2.382 1.00 0.00 H new ATOM 0 HE3 LYS A 300 -1.577 -15.059 0.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 300 -1.063 -16.426 2.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 300 0.371 -15.853 2.170 1.00 0.00 H new ATOM 0 HZ3 LYS A 300 -0.224 -15.134 3.588 1.00 0.00 H new ATOM 579 N GLY A 301 2.033 -10.540 0.159 1.00 0.00 N ATOM 580 CA GLY A 301 3.261 -11.134 -0.441 1.00 0.00 C ATOM 581 C GLY A 301 4.449 -10.201 -0.200 1.00 0.00 C ATOM 582 O GLY A 301 5.568 -10.638 -0.020 1.00 0.00 O ATOM 0 H GLY A 301 1.486 -9.949 -0.467 1.00 0.00 H new ATOM 0 HA2 GLY A 301 3.457 -12.112 -0.001 1.00 0.00 H new ATOM 0 HA3 GLY A 301 3.118 -11.289 -1.510 1.00 0.00 H new ATOM 586 N ILE A 302 4.213 -8.917 -0.193 1.00 0.00 N ATOM 587 CA ILE A 302 5.329 -7.954 0.037 1.00 0.00 C ATOM 588 C ILE A 302 5.847 -8.079 1.473 1.00 0.00 C ATOM 589 O ILE A 302 5.083 -8.130 2.416 1.00 0.00 O ATOM 590 CB ILE A 302 4.714 -6.574 -0.193 1.00 0.00 C ATOM 591 CG1 ILE A 302 4.523 -6.345 -1.694 1.00 0.00 C ATOM 592 CG2 ILE A 302 5.646 -5.499 0.370 1.00 0.00 C ATOM 593 CD1 ILE A 302 3.600 -5.145 -1.914 1.00 0.00 C ATOM 0 H ILE A 302 3.296 -8.493 -0.336 1.00 0.00 H new ATOM 0 HA ILE A 302 6.177 -8.138 -0.623 1.00 0.00 H new ATOM 0 HB ILE A 302 3.749 -6.519 0.310 1.00 0.00 H new ATOM 0 HG12 ILE A 302 5.487 -6.168 -2.171 1.00 0.00 H new ATOM 0 HG13 ILE A 302 4.097 -7.235 -2.157 1.00 0.00 H new ATOM 0 HG21 ILE A 302 5.207 -4.515 0.206 1.00 0.00 H new ATOM 0 HG22 ILE A 302 5.784 -5.661 1.439 1.00 0.00 H new ATOM 0 HG23 ILE A 302 6.611 -5.554 -0.133 1.00 0.00 H new ATOM 0 HD11 ILE A 302 3.464 -4.982 -2.983 1.00 0.00 H new ATOM 0 HD12 ILE A 302 2.633 -5.340 -1.451 1.00 0.00 H new ATOM 0 HD13 ILE A 302 4.045 -4.257 -1.465 1.00 0.00 H new ATOM 605 N ARG A 303 7.139 -8.130 1.645 1.00 0.00 N ATOM 606 CA ARG A 303 7.704 -8.251 3.020 1.00 0.00 C ATOM 607 C ARG A 303 7.074 -7.206 3.944 1.00 0.00 C ATOM 608 O ARG A 303 7.247 -7.326 5.146 1.00 0.00 O ATOM 609 CB ARG A 303 9.202 -7.990 2.857 1.00 0.00 C ATOM 610 CG ARG A 303 9.992 -9.151 3.464 1.00 0.00 C ATOM 611 CD ARG A 303 11.187 -9.479 2.566 1.00 0.00 C ATOM 612 NE ARG A 303 11.409 -10.942 2.741 1.00 0.00 N ATOM 613 CZ ARG A 303 12.173 -11.594 1.906 1.00 0.00 C ATOM 614 NH1 ARG A 303 12.747 -10.967 0.914 1.00 0.00 N ATOM 615 NH2 ARG A 303 12.364 -12.875 2.064 1.00 0.00 N ATOM 616 OXT ARG A 303 6.428 -6.305 3.434 1.00 0.00 O ATOM 0 H ARG A 303 7.828 -8.093 0.894 1.00 0.00 H new ATOM 0 HA ARG A 303 7.507 -9.227 3.464 1.00 0.00 H new ATOM 0 HB2 ARG A 303 9.450 -7.880 1.801 1.00 0.00 H new ATOM 0 HB3 ARG A 303 9.474 -7.055 3.347 1.00 0.00 H new ATOM 0 HG2 ARG A 303 10.336 -8.887 4.464 1.00 0.00 H new ATOM 0 HG3 ARG A 303 9.351 -10.026 3.568 1.00 0.00 H new ATOM 0 HD2 ARG A 303 10.978 -9.233 1.525 1.00 0.00 H new ATOM 0 HD3 ARG A 303 12.069 -8.908 2.858 1.00 0.00 H new ATOM 0 HE ARG A 303 10.963 -11.435 3.515 1.00 0.00 H new ATOM 0 HH11 ARG A 303 12.599 -9.965 0.790 1.00 0.00 H new ATOM 0 HH12 ARG A 303 13.343 -11.479 0.264 1.00 0.00 H new ATOM 0 HH21 ARG A 303 11.917 -13.366 2.839 1.00 0.00 H new ATOM 0 HH22 ARG A 303 12.960 -13.386 1.413 1.00 0.00 H new TER 630 ARG A 303