USER MOD reduce.3.24.130724 H: found=0, std=0, add=613, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 614 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 296 HIS : no HD1:sc= -1.07! C(o=-0.68!,f=-4.2!) USER MOD Set 1.2: A 298 SER OG : rot -81:sc= 0.388 USER MOD Single : A 263 THR OG1 : rot 180:sc= 0 USER MOD Single : A 268 TYR OH : rot 180:sc= 0 USER MOD Single : A 269 ASN : amide:sc= -0.445 K(o=-0.45,f=-1.9!) USER MOD Single : A 271 LYS NZ :NH3+ -122:sc= -0.481 (180deg=-3.41!) USER MOD Single : A 273 THR OG1 : rot 180:sc= 0 USER MOD Single : A 274 SER OG : rot 26:sc= 0.0196 USER MOD Single : A 276 MET CE :methyl 168:sc= -11.2! (180deg=-11.8!) USER MOD Single : A 277 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 280 CYS SG : rot 150:sc= -0.741 USER MOD Single : A 283 GLN : amide:sc= -0.523! C(o=-0.52!,f=-4.1!) USER MOD Single : A 289 LYS NZ :NH3+ -135:sc= 0.156 (180deg=-0.529) USER MOD Single : A 314 SER OG : rot 180:sc= 0 USER MOD Single : A 315 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 317 GLN :FLIP amide:sc= -0.0222 F(o=-0.61,f=-0.022) USER MOD Single : A 320 LYS NZ :NH3+ -153:sc= -0.822 (180deg=-1.68!) USER MOD Single : A 322 LYS NZ :NH3+ -122:sc= 0.402 (180deg=-2.14) USER MOD Single : A 325 SER OG : rot 180:sc= 0 USER MOD Single : A 327 THR OG1 : rot 180:sc= 0 USER MOD Single : A 329 THR OG1 : rot 180:sc= 0 USER MOD Single : A 330 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 331 THR OG1 : rot 180:sc= 0 USER MOD Single : A 332 SER OG : rot 180:sc= 0 USER MOD Single : A 334 SER OG : rot 150:sc= -1.17 USER MOD Single : A 335 MET CE :methyl 159:sc= -0.275 (180deg=-1.04) USER MOD Single : A 336 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 340 GLN : amide:sc= 1.18 K(o=1.2,f=-4.2!) USER MOD Single : A 342 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 66 N GLU A 260 8.663 14.605 -0.359 1.00 0.00 N ATOM 67 CA GLU A 260 8.795 13.901 0.911 1.00 0.00 C ATOM 68 C GLU A 260 7.538 13.091 1.217 1.00 0.00 C ATOM 69 O GLU A 260 7.602 11.877 1.408 1.00 0.00 O ATOM 70 CB GLU A 260 9.065 14.892 2.044 1.00 0.00 C ATOM 71 CG GLU A 260 10.421 15.570 1.949 1.00 0.00 C ATOM 72 CD GLU A 260 10.467 16.891 2.694 1.00 0.00 C ATOM 73 OE1 GLU A 260 9.516 17.687 2.549 1.00 0.00 O ATOM 74 OE2 GLU A 260 11.454 17.127 3.422 1.00 0.00 O ATOM 0 HA GLU A 260 9.638 13.215 0.831 1.00 0.00 H new ATOM 0 HB2 GLU A 260 8.286 15.654 2.042 1.00 0.00 H new ATOM 0 HB3 GLU A 260 8.996 14.368 2.998 1.00 0.00 H new ATOM 0 HG2 GLU A 260 11.185 14.904 2.350 1.00 0.00 H new ATOM 0 HG3 GLU A 260 10.665 15.740 0.900 1.00 0.00 H new ATOM 81 N GLU A 261 6.398 13.773 1.262 1.00 0.00 N ATOM 82 CA GLU A 261 5.127 13.117 1.547 1.00 0.00 C ATOM 83 C GLU A 261 4.560 12.462 0.291 1.00 0.00 C ATOM 84 O GLU A 261 4.682 12.980 -0.819 1.00 0.00 O ATOM 85 CB GLU A 261 4.122 14.126 2.108 1.00 0.00 C ATOM 86 CG GLU A 261 4.265 14.360 3.602 1.00 0.00 C ATOM 87 CD GLU A 261 5.631 14.900 3.981 1.00 0.00 C ATOM 88 OE1 GLU A 261 6.028 15.947 3.428 1.00 0.00 O ATOM 89 OE2 GLU A 261 6.302 14.275 4.828 1.00 0.00 O ATOM 0 H GLU A 261 6.328 14.778 1.105 1.00 0.00 H new ATOM 0 HA GLU A 261 5.306 12.341 2.291 1.00 0.00 H new ATOM 0 HB2 GLU A 261 4.244 15.076 1.587 1.00 0.00 H new ATOM 0 HB3 GLU A 261 3.112 13.775 1.899 1.00 0.00 H new ATOM 0 HG2 GLU A 261 3.498 15.061 3.931 1.00 0.00 H new ATOM 0 HG3 GLU A 261 4.089 13.423 4.131 1.00 0.00 H new ATOM 96 N PRO A 262 3.925 11.294 0.469 1.00 0.00 N ATOM 97 CA PRO A 262 3.326 10.542 -0.638 1.00 0.00 C ATOM 98 C PRO A 262 2.095 11.236 -1.211 1.00 0.00 C ATOM 99 O PRO A 262 1.381 11.945 -0.501 1.00 0.00 O ATOM 100 CB PRO A 262 2.936 9.210 0.008 1.00 0.00 C ATOM 101 CG PRO A 262 2.753 9.529 1.452 1.00 0.00 C ATOM 102 CD PRO A 262 3.742 10.618 1.764 1.00 0.00 C ATOM 0 HA PRO A 262 4.012 10.439 -1.479 1.00 0.00 H new ATOM 0 HB2 PRO A 262 2.020 8.811 -0.429 1.00 0.00 H new ATOM 0 HB3 PRO A 262 3.712 8.458 -0.136 1.00 0.00 H new ATOM 0 HG2 PRO A 262 1.734 9.858 1.653 1.00 0.00 H new ATOM 0 HG3 PRO A 262 2.932 8.650 2.072 1.00 0.00 H new ATOM 0 HD2 PRO A 262 3.361 11.301 2.523 1.00 0.00 H new ATOM 0 HD3 PRO A 262 4.681 10.212 2.142 1.00 0.00 H new ATOM 110 N THR A 263 1.851 11.028 -2.501 1.00 0.00 N ATOM 111 CA THR A 263 0.707 11.635 -3.170 1.00 0.00 C ATOM 112 C THR A 263 -0.395 10.610 -3.412 1.00 0.00 C ATOM 113 O THR A 263 -0.138 9.513 -3.909 1.00 0.00 O ATOM 114 CB THR A 263 1.112 12.263 -4.517 1.00 0.00 C ATOM 115 OG1 THR A 263 2.197 13.177 -4.325 1.00 0.00 O ATOM 116 CG2 THR A 263 -0.064 12.991 -5.150 1.00 0.00 C ATOM 0 H THR A 263 2.431 10.444 -3.103 1.00 0.00 H new ATOM 0 HA THR A 263 0.334 12.418 -2.510 1.00 0.00 H new ATOM 0 HB THR A 263 1.426 11.462 -5.186 1.00 0.00 H new ATOM 0 HG1 THR A 263 2.450 13.571 -5.186 1.00 0.00 H new ATOM 0 HG21 THR A 263 0.246 13.426 -6.100 1.00 0.00 H new ATOM 0 HG22 THR A 263 -0.878 12.287 -5.322 1.00 0.00 H new ATOM 0 HG23 THR A 263 -0.404 13.783 -4.482 1.00 0.00 H new ATOM 124 N ILE A 264 -1.623 10.974 -3.058 1.00 0.00 N ATOM 125 CA ILE A 264 -2.765 10.086 -3.238 1.00 0.00 C ATOM 126 C ILE A 264 -2.970 9.746 -4.710 1.00 0.00 C ATOM 127 O ILE A 264 -2.941 10.625 -5.571 1.00 0.00 O ATOM 128 CB ILE A 264 -4.058 10.711 -2.682 1.00 0.00 C ATOM 129 CG1 ILE A 264 -3.891 11.045 -1.198 1.00 0.00 C ATOM 130 CG2 ILE A 264 -5.233 9.768 -2.889 1.00 0.00 C ATOM 131 CD1 ILE A 264 -4.958 11.975 -0.665 1.00 0.00 C ATOM 0 H ILE A 264 -1.853 11.878 -2.645 1.00 0.00 H new ATOM 0 HA ILE A 264 -2.545 9.173 -2.684 1.00 0.00 H new ATOM 0 HB ILE A 264 -4.260 11.636 -3.223 1.00 0.00 H new ATOM 0 HG12 ILE A 264 -3.906 10.120 -0.622 1.00 0.00 H new ATOM 0 HG13 ILE A 264 -2.913 11.501 -1.044 1.00 0.00 H new ATOM 0 HG21 ILE A 264 -6.140 10.224 -2.491 1.00 0.00 H new ATOM 0 HG22 ILE A 264 -5.361 9.575 -3.954 1.00 0.00 H new ATOM 0 HG23 ILE A 264 -5.041 8.829 -2.371 1.00 0.00 H new ATOM 0 HD11 ILE A 264 -4.777 12.168 0.392 1.00 0.00 H new ATOM 0 HD12 ILE A 264 -4.930 12.915 -1.216 1.00 0.00 H new ATOM 0 HD13 ILE A 264 -5.938 11.513 -0.787 1.00 0.00 H new ATOM 143 N GLY A 265 -3.180 8.464 -4.993 1.00 0.00 N ATOM 144 CA GLY A 265 -3.389 8.031 -6.362 1.00 0.00 C ATOM 145 C GLY A 265 -2.130 7.466 -6.990 1.00 0.00 C ATOM 146 O GLY A 265 -2.197 6.566 -7.828 1.00 0.00 O ATOM 0 H GLY A 265 -3.209 7.718 -4.298 1.00 0.00 H new ATOM 0 HA2 GLY A 265 -4.174 7.275 -6.385 1.00 0.00 H new ATOM 0 HA3 GLY A 265 -3.741 8.874 -6.957 1.00 0.00 H new ATOM 150 N ASP A 266 -0.981 7.995 -6.587 1.00 0.00 N ATOM 151 CA ASP A 266 0.299 7.538 -7.116 1.00 0.00 C ATOM 152 C ASP A 266 0.703 6.208 -6.488 1.00 0.00 C ATOM 153 O ASP A 266 0.268 5.873 -5.386 1.00 0.00 O ATOM 154 CB ASP A 266 1.384 8.586 -6.862 1.00 0.00 C ATOM 155 CG ASP A 266 2.464 8.570 -7.926 1.00 0.00 C ATOM 156 OD1 ASP A 266 2.155 8.204 -9.079 1.00 0.00 O ATOM 157 OD2 ASP A 266 3.618 8.924 -7.605 1.00 0.00 O ATOM 0 H ASP A 266 -0.909 8.741 -5.895 1.00 0.00 H new ATOM 0 HA ASP A 266 0.189 7.393 -8.191 1.00 0.00 H new ATOM 0 HB2 ASP A 266 0.928 9.575 -6.826 1.00 0.00 H new ATOM 0 HB3 ASP A 266 1.836 8.408 -5.886 1.00 0.00 H new ATOM 162 N ILE A 267 1.536 5.454 -7.197 1.00 0.00 N ATOM 163 CA ILE A 267 1.998 4.160 -6.708 1.00 0.00 C ATOM 164 C ILE A 267 3.444 4.238 -6.230 1.00 0.00 C ATOM 165 O ILE A 267 4.316 4.748 -6.934 1.00 0.00 O ATOM 166 CB ILE A 267 1.887 3.075 -7.796 1.00 0.00 C ATOM 167 CG1 ILE A 267 0.432 2.914 -8.239 1.00 0.00 C ATOM 168 CG2 ILE A 267 2.440 1.754 -7.284 1.00 0.00 C ATOM 169 CD1 ILE A 267 0.275 2.141 -9.530 1.00 0.00 C ATOM 0 H ILE A 267 1.905 5.716 -8.111 1.00 0.00 H new ATOM 0 HA ILE A 267 1.355 3.891 -5.870 1.00 0.00 H new ATOM 0 HB ILE A 267 2.478 3.384 -8.659 1.00 0.00 H new ATOM 0 HG12 ILE A 267 -0.125 2.407 -7.451 1.00 0.00 H new ATOM 0 HG13 ILE A 267 -0.014 3.901 -8.360 1.00 0.00 H new ATOM 0 HG21 ILE A 267 2.355 0.997 -8.064 1.00 0.00 H new ATOM 0 HG22 ILE A 267 3.488 1.879 -7.013 1.00 0.00 H new ATOM 0 HG23 ILE A 267 1.874 1.438 -6.408 1.00 0.00 H new ATOM 0 HD11 ILE A 267 -0.783 2.066 -9.783 1.00 0.00 H new ATOM 0 HD12 ILE A 267 0.804 2.658 -10.331 1.00 0.00 H new ATOM 0 HD13 ILE A 267 0.691 1.141 -9.408 1.00 0.00 H new ATOM 181 N TYR A 268 3.692 3.728 -5.029 1.00 0.00 N ATOM 182 CA TYR A 268 5.032 3.740 -4.455 1.00 0.00 C ATOM 183 C TYR A 268 5.486 2.327 -4.101 1.00 0.00 C ATOM 184 O TYR A 268 4.677 1.403 -4.028 1.00 0.00 O ATOM 185 CB TYR A 268 5.068 4.626 -3.209 1.00 0.00 C ATOM 186 CG TYR A 268 4.924 6.101 -3.510 1.00 0.00 C ATOM 187 CD1 TYR A 268 3.669 6.686 -3.630 1.00 0.00 C ATOM 188 CD2 TYR A 268 6.042 6.909 -3.673 1.00 0.00 C ATOM 189 CE1 TYR A 268 3.533 8.033 -3.906 1.00 0.00 C ATOM 190 CE2 TYR A 268 5.915 8.257 -3.948 1.00 0.00 C ATOM 191 CZ TYR A 268 4.658 8.814 -4.064 1.00 0.00 C ATOM 192 OH TYR A 268 4.526 10.156 -4.338 1.00 0.00 O ATOM 0 H TYR A 268 2.982 3.301 -4.434 1.00 0.00 H new ATOM 0 HA TYR A 268 5.715 4.146 -5.201 1.00 0.00 H new ATOM 0 HB2 TYR A 268 4.268 4.322 -2.534 1.00 0.00 H new ATOM 0 HB3 TYR A 268 6.009 4.461 -2.683 1.00 0.00 H new ATOM 0 HD1 TYR A 268 2.785 6.078 -3.505 1.00 0.00 H new ATOM 0 HD2 TYR A 268 7.027 6.476 -3.583 1.00 0.00 H new ATOM 0 HE1 TYR A 268 2.550 8.472 -3.997 1.00 0.00 H new ATOM 0 HE2 TYR A 268 6.795 8.871 -4.071 1.00 0.00 H new ATOM 0 HH TYR A 268 5.414 10.562 -4.419 1.00 0.00 H new ATOM 202 N ASN A 269 6.787 2.168 -3.882 1.00 0.00 N ATOM 203 CA ASN A 269 7.351 0.868 -3.535 1.00 0.00 C ATOM 204 C ASN A 269 7.448 0.704 -2.022 1.00 0.00 C ATOM 205 O ASN A 269 7.770 1.649 -1.303 1.00 0.00 O ATOM 206 CB ASN A 269 8.734 0.704 -4.167 1.00 0.00 C ATOM 207 CG ASN A 269 8.810 1.306 -5.557 1.00 0.00 C ATOM 208 OD1 ASN A 269 7.794 1.458 -6.236 1.00 0.00 O ATOM 209 ND2 ASN A 269 10.018 1.650 -5.988 1.00 0.00 N ATOM 0 H ASN A 269 7.471 2.923 -3.939 1.00 0.00 H new ATOM 0 HA ASN A 269 6.687 0.096 -3.924 1.00 0.00 H new ATOM 0 HB2 ASN A 269 9.481 1.176 -3.528 1.00 0.00 H new ATOM 0 HB3 ASN A 269 8.983 -0.356 -4.219 1.00 0.00 H new ATOM 0 HD21 ASN A 269 10.131 2.058 -6.916 1.00 0.00 H new ATOM 0 HD22 ASN A 269 10.833 1.506 -5.391 1.00 0.00 H new ATOM 216 N GLY A 270 7.168 -0.505 -1.544 1.00 0.00 N ATOM 217 CA GLY A 270 7.230 -0.772 -0.119 1.00 0.00 C ATOM 218 C GLY A 270 7.660 -2.193 0.187 1.00 0.00 C ATOM 219 O GLY A 270 7.801 -3.016 -0.719 1.00 0.00 O ATOM 0 H GLY A 270 6.899 -1.304 -2.118 1.00 0.00 H new ATOM 0 HA2 GLY A 270 7.927 -0.076 0.348 1.00 0.00 H new ATOM 0 HA3 GLY A 270 6.252 -0.588 0.325 1.00 0.00 H new ATOM 223 N LYS A 271 7.871 -2.484 1.466 1.00 0.00 N ATOM 224 CA LYS A 271 8.288 -3.815 1.890 1.00 0.00 C ATOM 225 C LYS A 271 7.610 -4.207 3.198 1.00 0.00 C ATOM 226 O LYS A 271 7.368 -3.363 4.061 1.00 0.00 O ATOM 227 CB LYS A 271 9.809 -3.867 2.056 1.00 0.00 C ATOM 228 CG LYS A 271 10.294 -5.069 2.847 1.00 0.00 C ATOM 229 CD LYS A 271 10.370 -4.764 4.334 1.00 0.00 C ATOM 230 CE LYS A 271 11.565 -3.880 4.661 1.00 0.00 C ATOM 231 NZ LYS A 271 11.964 -3.995 6.091 1.00 0.00 N ATOM 0 H LYS A 271 7.760 -1.815 2.228 1.00 0.00 H new ATOM 0 HA LYS A 271 7.988 -4.525 1.119 1.00 0.00 H new ATOM 0 HB2 LYS A 271 10.273 -3.880 1.070 1.00 0.00 H new ATOM 0 HB3 LYS A 271 10.143 -2.956 2.553 1.00 0.00 H new ATOM 0 HG2 LYS A 271 9.621 -5.910 2.681 1.00 0.00 H new ATOM 0 HG3 LYS A 271 11.277 -5.371 2.486 1.00 0.00 H new ATOM 0 HD2 LYS A 271 9.452 -4.270 4.653 1.00 0.00 H new ATOM 0 HD3 LYS A 271 10.441 -5.696 4.895 1.00 0.00 H new ATOM 0 HE2 LYS A 271 12.406 -4.157 4.026 1.00 0.00 H new ATOM 0 HE3 LYS A 271 11.322 -2.842 4.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 271 11.926 -3.057 6.538 1.00 0.00 H new ATOM 0 HZ2 LYS A 271 11.312 -4.640 6.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 271 12.933 -4.369 6.152 1.00 0.00 H new ATOM 245 N VAL A 272 7.306 -5.494 3.340 1.00 0.00 N ATOM 246 CA VAL A 272 6.657 -5.998 4.545 1.00 0.00 C ATOM 247 C VAL A 272 7.631 -6.035 5.718 1.00 0.00 C ATOM 248 O VAL A 272 8.627 -6.758 5.690 1.00 0.00 O ATOM 249 CB VAL A 272 6.082 -7.409 4.324 1.00 0.00 C ATOM 250 CG1 VAL A 272 5.776 -8.076 5.656 1.00 0.00 C ATOM 251 CG2 VAL A 272 4.837 -7.346 3.452 1.00 0.00 C ATOM 0 H VAL A 272 7.499 -6.206 2.636 1.00 0.00 H new ATOM 0 HA VAL A 272 5.841 -5.314 4.776 1.00 0.00 H new ATOM 0 HB VAL A 272 6.830 -8.010 3.807 1.00 0.00 H new ATOM 0 HG11 VAL A 272 5.370 -9.072 5.479 1.00 0.00 H new ATOM 0 HG12 VAL A 272 6.692 -8.156 6.242 1.00 0.00 H new ATOM 0 HG13 VAL A 272 5.046 -7.479 6.203 1.00 0.00 H new ATOM 0 HG21 VAL A 272 4.444 -8.352 3.306 1.00 0.00 H new ATOM 0 HG22 VAL A 272 4.082 -6.729 3.939 1.00 0.00 H new ATOM 0 HG23 VAL A 272 5.092 -6.912 2.485 1.00 0.00 H new ATOM 261 N THR A 273 7.335 -5.251 6.750 1.00 0.00 N ATOM 262 CA THR A 273 8.184 -5.194 7.934 1.00 0.00 C ATOM 263 C THR A 273 7.666 -6.122 9.027 1.00 0.00 C ATOM 264 O THR A 273 8.446 -6.785 9.711 1.00 0.00 O ATOM 265 CB THR A 273 8.273 -3.761 8.492 1.00 0.00 C ATOM 266 OG1 THR A 273 6.966 -3.289 8.839 1.00 0.00 O ATOM 267 CG2 THR A 273 8.904 -2.822 7.475 1.00 0.00 C ATOM 0 H THR A 273 6.514 -4.647 6.790 1.00 0.00 H new ATOM 0 HA THR A 273 9.178 -5.519 7.627 1.00 0.00 H new ATOM 0 HB THR A 273 8.901 -3.780 9.383 1.00 0.00 H new ATOM 0 HG1 THR A 273 7.031 -2.378 9.194 1.00 0.00 H new ATOM 0 HG21 THR A 273 8.956 -1.816 7.892 1.00 0.00 H new ATOM 0 HG22 THR A 273 9.909 -3.168 7.235 1.00 0.00 H new ATOM 0 HG23 THR A 273 8.299 -2.808 6.568 1.00 0.00 H new ATOM 275 N SER A 274 6.347 -6.165 9.185 1.00 0.00 N ATOM 276 CA SER A 274 5.726 -7.011 10.197 1.00 0.00 C ATOM 277 C SER A 274 4.383 -7.545 9.709 1.00 0.00 C ATOM 278 O SER A 274 3.512 -6.780 9.295 1.00 0.00 O ATOM 279 CB SER A 274 5.534 -6.228 11.498 1.00 0.00 C ATOM 280 OG SER A 274 6.666 -6.354 12.341 1.00 0.00 O ATOM 0 H SER A 274 5.688 -5.624 8.625 1.00 0.00 H new ATOM 0 HA SER A 274 6.387 -7.857 10.384 1.00 0.00 H new ATOM 0 HB2 SER A 274 5.361 -5.176 11.271 1.00 0.00 H new ATOM 0 HB3 SER A 274 4.647 -6.592 12.018 1.00 0.00 H new ATOM 0 HG SER A 274 7.459 -6.543 11.797 1.00 0.00 H new ATOM 286 N ILE A 275 4.224 -8.863 9.762 1.00 0.00 N ATOM 287 CA ILE A 275 2.988 -9.501 9.326 1.00 0.00 C ATOM 288 C ILE A 275 2.028 -9.694 10.495 1.00 0.00 C ATOM 289 O ILE A 275 2.357 -10.358 11.478 1.00 0.00 O ATOM 290 CB ILE A 275 3.260 -10.867 8.669 1.00 0.00 C ATOM 291 CG1 ILE A 275 4.108 -10.690 7.408 1.00 0.00 C ATOM 292 CG2 ILE A 275 1.950 -11.566 8.339 1.00 0.00 C ATOM 293 CD1 ILE A 275 5.575 -10.455 7.694 1.00 0.00 C ATOM 0 H ILE A 275 4.935 -9.510 10.102 1.00 0.00 H new ATOM 0 HA ILE A 275 2.533 -8.838 8.590 1.00 0.00 H new ATOM 0 HB ILE A 275 3.814 -11.489 9.373 1.00 0.00 H new ATOM 0 HG12 ILE A 275 4.006 -11.578 6.784 1.00 0.00 H new ATOM 0 HG13 ILE A 275 3.719 -9.849 6.833 1.00 0.00 H new ATOM 0 HG21 ILE A 275 2.159 -12.530 7.875 1.00 0.00 H new ATOM 0 HG22 ILE A 275 1.379 -11.720 9.255 1.00 0.00 H new ATOM 0 HG23 ILE A 275 1.372 -10.950 7.650 1.00 0.00 H new ATOM 0 HD11 ILE A 275 6.115 -10.338 6.754 1.00 0.00 H new ATOM 0 HD12 ILE A 275 5.689 -9.551 8.292 1.00 0.00 H new ATOM 0 HD13 ILE A 275 5.980 -11.306 8.242 1.00 0.00 H new ATOM 305 N MET A 276 0.839 -9.112 10.380 1.00 0.00 N ATOM 306 CA MET A 276 -0.171 -9.223 11.426 1.00 0.00 C ATOM 307 C MET A 276 -1.338 -10.091 10.966 1.00 0.00 C ATOM 308 O MET A 276 -1.606 -10.201 9.770 1.00 0.00 O ATOM 309 CB MET A 276 -0.678 -7.836 11.824 1.00 0.00 C ATOM 310 CG MET A 276 0.352 -7.002 12.568 1.00 0.00 C ATOM 311 SD MET A 276 1.659 -6.387 11.489 1.00 0.00 S ATOM 312 CE MET A 276 0.704 -5.439 10.307 1.00 0.00 C ATOM 0 H MET A 276 0.551 -8.559 9.573 1.00 0.00 H new ATOM 0 HA MET A 276 0.291 -9.696 12.293 1.00 0.00 H new ATOM 0 HB2 MET A 276 -0.987 -7.300 10.927 1.00 0.00 H new ATOM 0 HB3 MET A 276 -1.563 -7.948 12.450 1.00 0.00 H new ATOM 0 HG2 MET A 276 -0.146 -6.158 13.046 1.00 0.00 H new ATOM 0 HG3 MET A 276 0.795 -7.603 13.362 1.00 0.00 H new ATOM 0 HE1 MET A 276 1.375 -4.826 9.705 1.00 0.00 H new ATOM 0 HE2 MET A 276 0.152 -6.118 9.657 1.00 0.00 H new ATOM 0 HE3 MET A 276 0.003 -4.795 10.838 1.00 0.00 H new ATOM 322 N GLN A 277 -2.026 -10.705 11.923 1.00 0.00 N ATOM 323 CA GLN A 277 -3.163 -11.564 11.614 1.00 0.00 C ATOM 324 C GLN A 277 -4.155 -10.848 10.703 1.00 0.00 C ATOM 325 O GLN A 277 -4.714 -11.446 9.784 1.00 0.00 O ATOM 326 CB GLN A 277 -3.861 -12.004 12.902 1.00 0.00 C ATOM 327 CG GLN A 277 -4.921 -13.073 12.685 1.00 0.00 C ATOM 328 CD GLN A 277 -5.685 -13.402 13.952 1.00 0.00 C ATOM 329 OE1 GLN A 277 -6.274 -12.523 14.582 1.00 0.00 O ATOM 330 NE2 GLN A 277 -5.681 -14.674 14.332 1.00 0.00 N ATOM 0 H GLN A 277 -1.816 -10.624 12.918 1.00 0.00 H new ATOM 0 HA GLN A 277 -2.789 -12.445 11.092 1.00 0.00 H new ATOM 0 HB2 GLN A 277 -3.114 -12.382 13.600 1.00 0.00 H new ATOM 0 HB3 GLN A 277 -4.324 -11.135 13.370 1.00 0.00 H new ATOM 0 HG2 GLN A 277 -5.621 -12.736 11.920 1.00 0.00 H new ATOM 0 HG3 GLN A 277 -4.447 -13.978 12.306 1.00 0.00 H new ATOM 0 HE21 GLN A 277 -5.180 -15.370 13.780 1.00 0.00 H new ATOM 0 HE22 GLN A 277 -6.179 -14.956 15.176 1.00 0.00 H new ATOM 339 N PHE A 278 -4.370 -9.563 10.965 1.00 0.00 N ATOM 340 CA PHE A 278 -5.296 -8.764 10.170 1.00 0.00 C ATOM 341 C PHE A 278 -4.673 -8.383 8.831 1.00 0.00 C ATOM 342 O PHE A 278 -5.212 -8.697 7.770 1.00 0.00 O ATOM 343 CB PHE A 278 -5.702 -7.503 10.935 1.00 0.00 C ATOM 344 CG PHE A 278 -4.604 -6.943 11.793 1.00 0.00 C ATOM 345 CD1 PHE A 278 -4.408 -7.410 13.083 1.00 0.00 C ATOM 346 CD2 PHE A 278 -3.767 -5.950 11.311 1.00 0.00 C ATOM 347 CE1 PHE A 278 -3.399 -6.897 13.876 1.00 0.00 C ATOM 348 CE2 PHE A 278 -2.755 -5.433 12.098 1.00 0.00 C ATOM 349 CZ PHE A 278 -2.572 -5.907 13.383 1.00 0.00 C ATOM 0 H PHE A 278 -3.915 -9.052 11.722 1.00 0.00 H new ATOM 0 HA PHE A 278 -6.185 -9.365 9.979 1.00 0.00 H new ATOM 0 HB2 PHE A 278 -6.019 -6.742 10.222 1.00 0.00 H new ATOM 0 HB3 PHE A 278 -6.563 -7.730 11.563 1.00 0.00 H new ATOM 0 HD1 PHE A 278 -5.052 -8.184 13.473 1.00 0.00 H new ATOM 0 HD2 PHE A 278 -3.907 -5.575 10.308 1.00 0.00 H new ATOM 0 HE1 PHE A 278 -3.258 -7.270 14.880 1.00 0.00 H new ATOM 0 HE2 PHE A 278 -2.109 -4.660 11.709 1.00 0.00 H new ATOM 0 HZ PHE A 278 -1.783 -5.504 14.001 1.00 0.00 H new ATOM 359 N GLY A 279 -3.533 -7.701 8.888 1.00 0.00 N ATOM 360 CA GLY A 279 -2.855 -7.286 7.673 1.00 0.00 C ATOM 361 C GLY A 279 -1.346 -7.308 7.815 1.00 0.00 C ATOM 362 O GLY A 279 -0.814 -7.876 8.770 1.00 0.00 O ATOM 0 H GLY A 279 -3.067 -7.428 9.753 1.00 0.00 H new ATOM 0 HA2 GLY A 279 -3.149 -7.942 6.854 1.00 0.00 H new ATOM 0 HA3 GLY A 279 -3.177 -6.279 7.406 1.00 0.00 H new ATOM 366 N CYS A 280 -0.655 -6.690 6.864 1.00 0.00 N ATOM 367 CA CYS A 280 0.803 -6.643 6.886 1.00 0.00 C ATOM 368 C CYS A 280 1.302 -5.205 6.789 1.00 0.00 C ATOM 369 O CYS A 280 0.781 -4.407 6.011 1.00 0.00 O ATOM 370 CB CYS A 280 1.378 -7.474 5.737 1.00 0.00 C ATOM 371 SG CYS A 280 0.909 -6.885 4.093 1.00 0.00 S ATOM 0 H CYS A 280 -1.080 -6.215 6.068 1.00 0.00 H new ATOM 0 HA CYS A 280 1.141 -7.063 7.833 1.00 0.00 H new ATOM 0 HB2 CYS A 280 2.465 -7.477 5.814 1.00 0.00 H new ATOM 0 HB3 CYS A 280 1.048 -8.507 5.849 1.00 0.00 H new ATOM 0 HG CYS A 280 1.853 -7.168 3.245 1.00 0.00 H new ATOM 377 N PHE A 281 2.315 -4.881 7.586 1.00 0.00 N ATOM 378 CA PHE A 281 2.883 -3.538 7.593 1.00 0.00 C ATOM 379 C PHE A 281 3.870 -3.360 6.443 1.00 0.00 C ATOM 380 O PHE A 281 4.851 -4.096 6.331 1.00 0.00 O ATOM 381 CB PHE A 281 3.582 -3.264 8.926 1.00 0.00 C ATOM 382 CG PHE A 281 2.636 -2.893 10.033 1.00 0.00 C ATOM 383 CD1 PHE A 281 1.723 -1.864 9.866 1.00 0.00 C ATOM 384 CD2 PHE A 281 2.661 -3.572 11.240 1.00 0.00 C ATOM 385 CE1 PHE A 281 0.851 -1.520 10.882 1.00 0.00 C ATOM 386 CE2 PHE A 281 1.791 -3.233 12.259 1.00 0.00 C ATOM 387 CZ PHE A 281 0.886 -2.205 12.081 1.00 0.00 C ATOM 0 H PHE A 281 2.759 -5.530 8.235 1.00 0.00 H new ATOM 0 HA PHE A 281 2.069 -2.825 7.464 1.00 0.00 H new ATOM 0 HB2 PHE A 281 4.145 -4.150 9.221 1.00 0.00 H new ATOM 0 HB3 PHE A 281 4.304 -2.458 8.790 1.00 0.00 H new ATOM 0 HD1 PHE A 281 1.692 -1.324 8.931 1.00 0.00 H new ATOM 0 HD2 PHE A 281 3.368 -4.375 11.386 1.00 0.00 H new ATOM 0 HE1 PHE A 281 0.143 -0.717 10.739 1.00 0.00 H new ATOM 0 HE2 PHE A 281 1.819 -3.772 13.194 1.00 0.00 H new ATOM 0 HZ PHE A 281 0.207 -1.937 12.877 1.00 0.00 H new ATOM 397 N VAL A 282 3.603 -2.377 5.589 1.00 0.00 N ATOM 398 CA VAL A 282 4.466 -2.100 4.447 1.00 0.00 C ATOM 399 C VAL A 282 5.111 -0.724 4.567 1.00 0.00 C ATOM 400 O VAL A 282 4.420 0.289 4.672 1.00 0.00 O ATOM 401 CB VAL A 282 3.686 -2.176 3.122 1.00 0.00 C ATOM 402 CG1 VAL A 282 4.588 -1.821 1.949 1.00 0.00 C ATOM 403 CG2 VAL A 282 3.080 -3.559 2.939 1.00 0.00 C ATOM 0 H VAL A 282 2.795 -1.759 5.667 1.00 0.00 H new ATOM 0 HA VAL A 282 5.244 -2.864 4.446 1.00 0.00 H new ATOM 0 HB VAL A 282 2.874 -1.450 3.157 1.00 0.00 H new ATOM 0 HG11 VAL A 282 4.019 -1.880 1.021 1.00 0.00 H new ATOM 0 HG12 VAL A 282 4.969 -0.808 2.077 1.00 0.00 H new ATOM 0 HG13 VAL A 282 5.423 -2.520 1.908 1.00 0.00 H new ATOM 0 HG21 VAL A 282 2.532 -3.595 1.997 1.00 0.00 H new ATOM 0 HG22 VAL A 282 3.874 -4.305 2.925 1.00 0.00 H new ATOM 0 HG23 VAL A 282 2.399 -3.770 3.763 1.00 0.00 H new ATOM 413 N GLN A 283 6.440 -0.695 4.549 1.00 0.00 N ATOM 414 CA GLN A 283 7.178 0.558 4.656 1.00 0.00 C ATOM 415 C GLN A 283 7.627 1.044 3.282 1.00 0.00 C ATOM 416 O GLN A 283 8.234 0.295 2.515 1.00 0.00 O ATOM 417 CB GLN A 283 8.392 0.383 5.570 1.00 0.00 C ATOM 418 CG GLN A 283 9.163 1.670 5.811 1.00 0.00 C ATOM 419 CD GLN A 283 10.580 1.422 6.287 1.00 0.00 C ATOM 420 OE1 GLN A 283 10.797 0.816 7.337 1.00 0.00 O ATOM 421 NE2 GLN A 283 11.555 1.889 5.515 1.00 0.00 N ATOM 0 H GLN A 283 7.027 -1.524 4.461 1.00 0.00 H new ATOM 0 HA GLN A 283 6.513 1.307 5.087 1.00 0.00 H new ATOM 0 HB2 GLN A 283 8.060 -0.017 6.528 1.00 0.00 H new ATOM 0 HB3 GLN A 283 9.063 -0.356 5.132 1.00 0.00 H new ATOM 0 HG2 GLN A 283 9.190 2.251 4.889 1.00 0.00 H new ATOM 0 HG3 GLN A 283 8.635 2.272 6.551 1.00 0.00 H new ATOM 0 HE21 GLN A 283 11.330 2.386 4.653 1.00 0.00 H new ATOM 0 HE22 GLN A 283 12.529 1.751 5.784 1.00 0.00 H new ATOM 430 N LEU A 284 7.324 2.300 2.976 1.00 0.00 N ATOM 431 CA LEU A 284 7.696 2.887 1.693 1.00 0.00 C ATOM 432 C LEU A 284 9.211 3.028 1.578 1.00 0.00 C ATOM 433 O LEU A 284 9.898 3.265 2.571 1.00 0.00 O ATOM 434 CB LEU A 284 7.031 4.254 1.523 1.00 0.00 C ATOM 435 CG LEU A 284 5.511 4.285 1.687 1.00 0.00 C ATOM 436 CD1 LEU A 284 5.012 5.720 1.768 1.00 0.00 C ATOM 437 CD2 LEU A 284 4.835 3.548 0.540 1.00 0.00 C ATOM 0 H LEU A 284 6.821 2.932 3.599 1.00 0.00 H new ATOM 0 HA LEU A 284 7.350 2.221 0.903 1.00 0.00 H new ATOM 0 HB2 LEU A 284 7.469 4.941 2.247 1.00 0.00 H new ATOM 0 HB3 LEU A 284 7.277 4.635 0.532 1.00 0.00 H new ATOM 0 HG LEU A 284 5.255 3.779 2.618 1.00 0.00 H new ATOM 0 HD11 LEU A 284 3.928 5.722 1.885 1.00 0.00 H new ATOM 0 HD12 LEU A 284 5.470 6.217 2.623 1.00 0.00 H new ATOM 0 HD13 LEU A 284 5.280 6.250 0.854 1.00 0.00 H new ATOM 0 HD21 LEU A 284 3.754 3.580 0.674 1.00 0.00 H new ATOM 0 HD22 LEU A 284 5.098 4.025 -0.404 1.00 0.00 H new ATOM 0 HD23 LEU A 284 5.168 2.510 0.528 1.00 0.00 H new ATOM 449 N GLU A 285 9.723 2.883 0.360 1.00 0.00 N ATOM 450 CA GLU A 285 11.156 2.996 0.116 1.00 0.00 C ATOM 451 C GLU A 285 11.443 4.028 -0.971 1.00 0.00 C ATOM 452 O GLU A 285 11.215 3.780 -2.154 1.00 0.00 O ATOM 453 CB GLU A 285 11.735 1.639 -0.289 1.00 0.00 C ATOM 454 CG GLU A 285 11.648 0.589 0.806 1.00 0.00 C ATOM 455 CD GLU A 285 12.532 -0.613 0.534 1.00 0.00 C ATOM 456 OE1 GLU A 285 12.658 -1.002 -0.646 1.00 0.00 O ATOM 457 OE2 GLU A 285 13.097 -1.164 1.502 1.00 0.00 O ATOM 0 H GLU A 285 9.167 2.687 -0.473 1.00 0.00 H new ATOM 0 HA GLU A 285 11.631 3.325 1.040 1.00 0.00 H new ATOM 0 HB2 GLU A 285 11.207 1.277 -1.171 1.00 0.00 H new ATOM 0 HB3 GLU A 285 12.779 1.769 -0.574 1.00 0.00 H new ATOM 0 HG2 GLU A 285 11.934 1.037 1.758 1.00 0.00 H new ATOM 0 HG3 GLU A 285 10.614 0.259 0.907 1.00 0.00 H new ATOM 464 N GLY A 286 11.945 5.189 -0.559 1.00 0.00 N ATOM 465 CA GLY A 286 12.254 6.241 -1.509 1.00 0.00 C ATOM 466 C GLY A 286 12.019 7.625 -0.937 1.00 0.00 C ATOM 467 O GLY A 286 12.863 8.513 -1.071 1.00 0.00 O ATOM 0 H GLY A 286 12.143 5.419 0.415 1.00 0.00 H new ATOM 0 HA2 GLY A 286 13.295 6.152 -1.820 1.00 0.00 H new ATOM 0 HA3 GLY A 286 11.642 6.111 -2.402 1.00 0.00 H new ATOM 471 N LEU A 287 10.868 7.812 -0.300 1.00 0.00 N ATOM 472 CA LEU A 287 10.522 9.099 0.294 1.00 0.00 C ATOM 473 C LEU A 287 11.384 9.383 1.520 1.00 0.00 C ATOM 474 O LEU A 287 11.436 8.582 2.453 1.00 0.00 O ATOM 475 CB LEU A 287 9.042 9.124 0.679 1.00 0.00 C ATOM 476 CG LEU A 287 8.046 8.956 -0.469 1.00 0.00 C ATOM 477 CD1 LEU A 287 6.661 8.632 0.070 1.00 0.00 C ATOM 478 CD2 LEU A 287 8.007 10.211 -1.328 1.00 0.00 C ATOM 0 H LEU A 287 10.159 7.089 -0.182 1.00 0.00 H new ATOM 0 HA LEU A 287 10.711 9.876 -0.447 1.00 0.00 H new ATOM 0 HB2 LEU A 287 8.863 8.333 1.407 1.00 0.00 H new ATOM 0 HB3 LEU A 287 8.833 10.070 1.179 1.00 0.00 H new ATOM 0 HG LEU A 287 8.374 8.124 -1.092 1.00 0.00 H new ATOM 0 HD11 LEU A 287 5.965 8.516 -0.761 1.00 0.00 H new ATOM 0 HD12 LEU A 287 6.701 7.705 0.642 1.00 0.00 H new ATOM 0 HD13 LEU A 287 6.323 9.443 0.716 1.00 0.00 H new ATOM 0 HD21 LEU A 287 7.293 10.074 -2.140 1.00 0.00 H new ATOM 0 HD22 LEU A 287 7.703 11.061 -0.717 1.00 0.00 H new ATOM 0 HD23 LEU A 287 8.997 10.399 -1.743 1.00 0.00 H new ATOM 490 N ARG A 288 12.057 10.529 1.511 1.00 0.00 N ATOM 491 CA ARG A 288 12.916 10.919 2.623 1.00 0.00 C ATOM 492 C ARG A 288 12.218 10.680 3.959 1.00 0.00 C ATOM 493 O ARG A 288 12.819 10.168 4.903 1.00 0.00 O ATOM 494 CB ARG A 288 13.312 12.391 2.498 1.00 0.00 C ATOM 495 CG ARG A 288 14.681 12.705 3.077 1.00 0.00 C ATOM 496 CD ARG A 288 14.634 12.810 4.594 1.00 0.00 C ATOM 497 NE ARG A 288 14.354 14.172 5.040 1.00 0.00 N ATOM 498 CZ ARG A 288 15.290 15.103 5.190 1.00 0.00 C ATOM 499 NH1 ARG A 288 16.559 14.820 4.932 1.00 0.00 N ATOM 500 NH2 ARG A 288 14.957 16.320 5.600 1.00 0.00 N ATOM 0 H ARG A 288 12.024 11.203 0.746 1.00 0.00 H new ATOM 0 HA ARG A 288 13.815 10.304 2.587 1.00 0.00 H new ATOM 0 HB2 ARG A 288 13.299 12.674 1.445 1.00 0.00 H new ATOM 0 HB3 ARG A 288 12.565 13.004 3.002 1.00 0.00 H new ATOM 0 HG2 ARG A 288 15.387 11.927 2.787 1.00 0.00 H new ATOM 0 HG3 ARG A 288 15.049 13.642 2.658 1.00 0.00 H new ATOM 0 HD2 ARG A 288 13.868 12.137 4.980 1.00 0.00 H new ATOM 0 HD3 ARG A 288 15.586 12.481 5.010 1.00 0.00 H new ATOM 0 HE ARG A 288 13.387 14.422 5.248 1.00 0.00 H new ATOM 0 HH11 ARG A 288 16.819 13.885 4.617 1.00 0.00 H new ATOM 0 HH12 ARG A 288 17.275 15.537 5.048 1.00 0.00 H new ATOM 0 HH21 ARG A 288 13.982 16.542 5.800 1.00 0.00 H new ATOM 0 HH22 ARG A 288 15.676 17.034 5.715 1.00 0.00 H new ATOM 514 N LYS A 289 10.945 11.055 4.031 1.00 0.00 N ATOM 515 CA LYS A 289 10.164 10.882 5.249 1.00 0.00 C ATOM 516 C LYS A 289 9.699 9.437 5.397 1.00 0.00 C ATOM 517 O LYS A 289 8.692 9.036 4.814 1.00 0.00 O ATOM 518 CB LYS A 289 8.954 11.820 5.241 1.00 0.00 C ATOM 519 CG LYS A 289 8.001 11.592 6.402 1.00 0.00 C ATOM 520 CD LYS A 289 8.370 12.447 7.602 1.00 0.00 C ATOM 521 CE LYS A 289 7.655 13.789 7.572 1.00 0.00 C ATOM 522 NZ LYS A 289 8.449 14.825 6.856 1.00 0.00 N ATOM 0 H LYS A 289 10.432 11.481 3.259 1.00 0.00 H new ATOM 0 HA LYS A 289 10.802 11.128 6.098 1.00 0.00 H new ATOM 0 HB2 LYS A 289 9.304 12.852 5.266 1.00 0.00 H new ATOM 0 HB3 LYS A 289 8.411 11.691 4.305 1.00 0.00 H new ATOM 0 HG2 LYS A 289 6.983 11.823 6.089 1.00 0.00 H new ATOM 0 HG3 LYS A 289 8.016 10.540 6.685 1.00 0.00 H new ATOM 0 HD2 LYS A 289 8.114 11.918 8.520 1.00 0.00 H new ATOM 0 HD3 LYS A 289 9.448 12.608 7.617 1.00 0.00 H new ATOM 0 HE2 LYS A 289 6.686 13.674 7.086 1.00 0.00 H new ATOM 0 HE3 LYS A 289 7.462 14.120 8.592 1.00 0.00 H new ATOM 0 HZ1 LYS A 289 8.441 15.709 7.404 1.00 0.00 H new ATOM 0 HZ2 LYS A 289 9.429 14.495 6.744 1.00 0.00 H new ATOM 0 HZ3 LYS A 289 8.032 14.996 5.919 1.00 0.00 H new ATOM 536 N ARG A 290 10.439 8.660 6.182 1.00 0.00 N ATOM 537 CA ARG A 290 10.102 7.259 6.406 1.00 0.00 C ATOM 538 C ARG A 290 8.632 7.108 6.786 1.00 0.00 C ATOM 539 O ARG A 290 8.193 7.612 7.820 1.00 0.00 O ATOM 540 CB ARG A 290 10.987 6.670 7.506 1.00 0.00 C ATOM 541 CG ARG A 290 10.865 5.161 7.642 1.00 0.00 C ATOM 542 CD ARG A 290 12.067 4.567 8.359 1.00 0.00 C ATOM 543 NE ARG A 290 11.872 3.156 8.680 1.00 0.00 N ATOM 544 CZ ARG A 290 12.517 2.528 9.657 1.00 0.00 C ATOM 545 NH1 ARG A 290 13.394 3.183 10.404 1.00 0.00 N ATOM 546 NH2 ARG A 290 12.284 1.242 9.888 1.00 0.00 N ATOM 0 H ARG A 290 11.275 8.977 6.673 1.00 0.00 H new ATOM 0 HA ARG A 290 10.277 6.716 5.478 1.00 0.00 H new ATOM 0 HB2 ARG A 290 12.027 6.925 7.300 1.00 0.00 H new ATOM 0 HB3 ARG A 290 10.727 7.134 8.457 1.00 0.00 H new ATOM 0 HG2 ARG A 290 9.955 4.916 8.191 1.00 0.00 H new ATOM 0 HG3 ARG A 290 10.771 4.712 6.653 1.00 0.00 H new ATOM 0 HD2 ARG A 290 12.953 4.677 7.733 1.00 0.00 H new ATOM 0 HD3 ARG A 290 12.254 5.125 9.277 1.00 0.00 H new ATOM 0 HE ARG A 290 11.204 2.623 8.123 1.00 0.00 H new ATOM 0 HH11 ARG A 290 13.575 4.172 10.229 1.00 0.00 H new ATOM 0 HH12 ARG A 290 13.888 2.699 11.154 1.00 0.00 H new ATOM 0 HH21 ARG A 290 11.609 0.735 9.315 1.00 0.00 H new ATOM 0 HH22 ARG A 290 12.780 0.761 10.638 1.00 0.00 H new ATOM 560 N TRP A 291 7.877 6.411 5.944 1.00 0.00 N ATOM 561 CA TRP A 291 6.457 6.194 6.191 1.00 0.00 C ATOM 562 C TRP A 291 6.156 4.710 6.371 1.00 0.00 C ATOM 563 O TRP A 291 6.849 3.857 5.819 1.00 0.00 O ATOM 564 CB TRP A 291 5.625 6.759 5.039 1.00 0.00 C ATOM 565 CG TRP A 291 5.523 8.255 5.057 1.00 0.00 C ATOM 566 CD1 TRP A 291 5.884 9.113 4.058 1.00 0.00 C ATOM 567 CD2 TRP A 291 5.030 9.067 6.128 1.00 0.00 C ATOM 568 NE1 TRP A 291 5.644 10.410 4.443 1.00 0.00 N ATOM 569 CE2 TRP A 291 5.120 10.409 5.708 1.00 0.00 C ATOM 570 CE3 TRP A 291 4.520 8.792 7.399 1.00 0.00 C ATOM 571 CZ2 TRP A 291 4.719 11.469 6.517 1.00 0.00 C ATOM 572 CZ3 TRP A 291 4.123 9.846 8.200 1.00 0.00 C ATOM 573 CH2 TRP A 291 4.224 11.171 7.757 1.00 0.00 C ATOM 0 H TRP A 291 8.225 5.987 5.084 1.00 0.00 H new ATOM 0 HA TRP A 291 6.191 6.714 7.111 1.00 0.00 H new ATOM 0 HB2 TRP A 291 6.066 6.443 4.093 1.00 0.00 H new ATOM 0 HB3 TRP A 291 4.623 6.333 5.081 1.00 0.00 H new ATOM 0 HD1 TRP A 291 6.297 8.816 3.105 1.00 0.00 H new ATOM 0 HE1 TRP A 291 5.827 11.239 3.878 1.00 0.00 H new ATOM 0 HE3 TRP A 291 4.437 7.774 7.750 1.00 0.00 H new ATOM 0 HZ2 TRP A 291 4.796 12.491 6.177 1.00 0.00 H new ATOM 0 HZ3 TRP A 291 3.728 9.644 9.185 1.00 0.00 H new ATOM 0 HH2 TRP A 291 3.905 11.973 8.407 1.00 0.00 H new ATOM 584 N GLU A 292 5.119 4.411 7.147 1.00 0.00 N ATOM 585 CA GLU A 292 4.728 3.029 7.400 1.00 0.00 C ATOM 586 C GLU A 292 3.209 2.885 7.406 1.00 0.00 C ATOM 587 O GLU A 292 2.525 3.453 8.256 1.00 0.00 O ATOM 588 CB GLU A 292 5.303 2.549 8.734 1.00 0.00 C ATOM 589 CG GLU A 292 4.896 1.130 9.097 1.00 0.00 C ATOM 590 CD GLU A 292 5.702 0.570 10.253 1.00 0.00 C ATOM 591 OE1 GLU A 292 6.945 0.521 10.140 1.00 0.00 O ATOM 592 OE2 GLU A 292 5.090 0.180 11.269 1.00 0.00 O ATOM 0 H GLU A 292 4.535 5.107 7.611 1.00 0.00 H new ATOM 0 HA GLU A 292 5.130 2.412 6.597 1.00 0.00 H new ATOM 0 HB2 GLU A 292 6.391 2.607 8.693 1.00 0.00 H new ATOM 0 HB3 GLU A 292 4.977 3.225 9.525 1.00 0.00 H new ATOM 0 HG2 GLU A 292 3.837 1.115 9.356 1.00 0.00 H new ATOM 0 HG3 GLU A 292 5.021 0.486 8.226 1.00 0.00 H new ATOM 599 N GLY A 293 2.689 2.121 6.450 1.00 0.00 N ATOM 600 CA GLY A 293 1.255 1.916 6.363 1.00 0.00 C ATOM 601 C GLY A 293 0.863 0.466 6.565 1.00 0.00 C ATOM 602 O GLY A 293 1.699 -0.432 6.457 1.00 0.00 O ATOM 0 H GLY A 293 3.235 1.641 5.735 1.00 0.00 H new ATOM 0 HA2 GLY A 293 0.757 2.531 7.112 1.00 0.00 H new ATOM 0 HA3 GLY A 293 0.902 2.252 5.388 1.00 0.00 H new ATOM 606 N LEU A 294 -0.412 0.235 6.859 1.00 0.00 N ATOM 607 CA LEU A 294 -0.914 -1.117 7.078 1.00 0.00 C ATOM 608 C LEU A 294 -1.750 -1.587 5.892 1.00 0.00 C ATOM 609 O LEU A 294 -2.459 -0.798 5.268 1.00 0.00 O ATOM 610 CB LEU A 294 -1.749 -1.171 8.359 1.00 0.00 C ATOM 611 CG LEU A 294 -2.623 -2.412 8.538 1.00 0.00 C ATOM 612 CD1 LEU A 294 -1.774 -3.612 8.928 1.00 0.00 C ATOM 613 CD2 LEU A 294 -3.702 -2.159 9.581 1.00 0.00 C ATOM 0 H LEU A 294 -1.117 0.966 6.951 1.00 0.00 H new ATOM 0 HA LEU A 294 -0.058 -1.783 7.181 1.00 0.00 H new ATOM 0 HB2 LEU A 294 -1.074 -1.100 9.212 1.00 0.00 H new ATOM 0 HB3 LEU A 294 -2.392 -0.291 8.387 1.00 0.00 H new ATOM 0 HG LEU A 294 -3.109 -2.630 7.587 1.00 0.00 H new ATOM 0 HD11 LEU A 294 -2.414 -4.486 9.051 1.00 0.00 H new ATOM 0 HD12 LEU A 294 -1.039 -3.807 8.147 1.00 0.00 H new ATOM 0 HD13 LEU A 294 -1.259 -3.404 9.866 1.00 0.00 H new ATOM 0 HD21 LEU A 294 -4.315 -3.053 9.695 1.00 0.00 H new ATOM 0 HD22 LEU A 294 -3.235 -1.915 10.535 1.00 0.00 H new ATOM 0 HD23 LEU A 294 -4.330 -1.328 9.261 1.00 0.00 H new ATOM 625 N VAL A 295 -1.662 -2.878 5.587 1.00 0.00 N ATOM 626 CA VAL A 295 -2.413 -3.454 4.478 1.00 0.00 C ATOM 627 C VAL A 295 -3.419 -4.487 4.973 1.00 0.00 C ATOM 628 O VAL A 295 -3.059 -5.626 5.271 1.00 0.00 O ATOM 629 CB VAL A 295 -1.476 -4.117 3.451 1.00 0.00 C ATOM 630 CG1 VAL A 295 -2.257 -4.557 2.222 1.00 0.00 C ATOM 631 CG2 VAL A 295 -0.350 -3.169 3.067 1.00 0.00 C ATOM 0 H VAL A 295 -1.078 -3.544 6.092 1.00 0.00 H new ATOM 0 HA VAL A 295 -2.946 -2.634 3.997 1.00 0.00 H new ATOM 0 HB VAL A 295 -1.034 -5.003 3.907 1.00 0.00 H new ATOM 0 HG11 VAL A 295 -1.579 -5.023 1.507 1.00 0.00 H new ATOM 0 HG12 VAL A 295 -3.024 -5.274 2.516 1.00 0.00 H new ATOM 0 HG13 VAL A 295 -2.729 -3.689 1.761 1.00 0.00 H new ATOM 0 HG21 VAL A 295 0.302 -3.654 2.341 1.00 0.00 H new ATOM 0 HG22 VAL A 295 -0.770 -2.263 2.630 1.00 0.00 H new ATOM 0 HG23 VAL A 295 0.226 -2.909 3.955 1.00 0.00 H new ATOM 641 N HIS A 296 -4.682 -4.081 5.058 1.00 0.00 N ATOM 642 CA HIS A 296 -5.742 -4.972 5.516 1.00 0.00 C ATOM 643 C HIS A 296 -5.795 -6.237 4.664 1.00 0.00 C ATOM 644 O HIS A 296 -5.396 -6.229 3.499 1.00 0.00 O ATOM 645 CB HIS A 296 -7.093 -4.257 5.472 1.00 0.00 C ATOM 646 CG HIS A 296 -8.159 -4.942 6.270 1.00 0.00 C ATOM 647 ND1 HIS A 296 -9.080 -5.803 5.712 1.00 0.00 N ATOM 648 CD2 HIS A 296 -8.447 -4.890 7.591 1.00 0.00 C ATOM 649 CE1 HIS A 296 -9.890 -6.250 6.656 1.00 0.00 C ATOM 650 NE2 HIS A 296 -9.527 -5.712 7.806 1.00 0.00 N ATOM 0 H HIS A 296 -4.996 -3.141 4.816 1.00 0.00 H new ATOM 0 HA HIS A 296 -5.523 -5.257 6.545 1.00 0.00 H new ATOM 0 HB2 HIS A 296 -6.969 -3.240 5.844 1.00 0.00 H new ATOM 0 HB3 HIS A 296 -7.420 -4.179 4.435 1.00 0.00 H new ATOM 0 HD2 HIS A 296 -7.925 -4.310 8.338 1.00 0.00 H new ATOM 0 HE1 HIS A 296 -10.710 -6.938 6.511 1.00 0.00 H new ATOM 0 HE2 HIS A 296 -9.975 -5.879 8.707 1.00 0.00 H new ATOM 658 N ILE A 297 -6.288 -7.321 5.253 1.00 0.00 N ATOM 659 CA ILE A 297 -6.392 -8.592 4.548 1.00 0.00 C ATOM 660 C ILE A 297 -7.075 -8.417 3.196 1.00 0.00 C ATOM 661 O ILE A 297 -6.675 -9.024 2.203 1.00 0.00 O ATOM 662 CB ILE A 297 -7.173 -9.632 5.374 1.00 0.00 C ATOM 663 CG1 ILE A 297 -7.335 -10.929 4.579 1.00 0.00 C ATOM 664 CG2 ILE A 297 -8.532 -9.077 5.775 1.00 0.00 C ATOM 665 CD1 ILE A 297 -7.626 -12.135 5.445 1.00 0.00 C ATOM 0 H ILE A 297 -6.622 -7.344 6.217 1.00 0.00 H new ATOM 0 HA ILE A 297 -5.374 -8.951 4.395 1.00 0.00 H new ATOM 0 HB ILE A 297 -6.610 -9.852 6.281 1.00 0.00 H new ATOM 0 HG12 ILE A 297 -8.143 -10.806 3.858 1.00 0.00 H new ATOM 0 HG13 ILE A 297 -6.424 -11.112 4.009 1.00 0.00 H new ATOM 0 HG21 ILE A 297 -9.072 -9.823 6.358 1.00 0.00 H new ATOM 0 HG22 ILE A 297 -8.395 -8.177 6.375 1.00 0.00 H new ATOM 0 HG23 ILE A 297 -9.104 -8.833 4.880 1.00 0.00 H new ATOM 0 HD11 ILE A 297 -7.729 -13.019 4.815 1.00 0.00 H new ATOM 0 HD12 ILE A 297 -6.807 -12.284 6.149 1.00 0.00 H new ATOM 0 HD13 ILE A 297 -8.552 -11.972 5.996 1.00 0.00 H new ATOM 677 N SER A 298 -8.108 -7.580 3.165 1.00 0.00 N ATOM 678 CA SER A 298 -8.849 -7.325 1.935 1.00 0.00 C ATOM 679 C SER A 298 -7.950 -6.682 0.884 1.00 0.00 C ATOM 680 O SER A 298 -8.169 -6.843 -0.316 1.00 0.00 O ATOM 681 CB SER A 298 -10.051 -6.422 2.217 1.00 0.00 C ATOM 682 OG SER A 298 -9.635 -5.140 2.654 1.00 0.00 O ATOM 0 H SER A 298 -8.450 -7.067 3.978 1.00 0.00 H new ATOM 0 HA SER A 298 -9.205 -8.280 1.549 1.00 0.00 H new ATOM 0 HB2 SER A 298 -10.655 -6.324 1.315 1.00 0.00 H new ATOM 0 HB3 SER A 298 -10.684 -6.881 2.977 1.00 0.00 H new ATOM 0 HG SER A 298 -9.421 -5.174 3.610 1.00 0.00 H new ATOM 688 N GLU A 299 -6.939 -5.952 1.345 1.00 0.00 N ATOM 689 CA GLU A 299 -6.007 -5.283 0.444 1.00 0.00 C ATOM 690 C GLU A 299 -4.826 -6.190 0.111 1.00 0.00 C ATOM 691 O GLU A 299 -3.682 -5.740 0.047 1.00 0.00 O ATOM 692 CB GLU A 299 -5.504 -3.981 1.070 1.00 0.00 C ATOM 693 CG GLU A 299 -6.603 -2.962 1.321 1.00 0.00 C ATOM 694 CD GLU A 299 -7.435 -2.684 0.085 1.00 0.00 C ATOM 695 OE1 GLU A 299 -6.867 -2.701 -1.028 1.00 0.00 O ATOM 696 OE2 GLU A 299 -8.653 -2.450 0.229 1.00 0.00 O ATOM 0 H GLU A 299 -6.744 -5.809 2.336 1.00 0.00 H new ATOM 0 HA GLU A 299 -6.537 -5.052 -0.480 1.00 0.00 H new ATOM 0 HB2 GLU A 299 -5.009 -4.209 2.014 1.00 0.00 H new ATOM 0 HB3 GLU A 299 -4.753 -3.539 0.415 1.00 0.00 H new ATOM 0 HG2 GLU A 299 -7.253 -3.323 2.118 1.00 0.00 H new ATOM 0 HG3 GLU A 299 -6.157 -2.031 1.671 1.00 0.00 H new ATOM 703 N LEU A 300 -5.112 -7.470 -0.100 1.00 0.00 N ATOM 704 CA LEU A 300 -4.074 -8.442 -0.426 1.00 0.00 C ATOM 705 C LEU A 300 -4.484 -9.295 -1.623 1.00 0.00 C ATOM 706 O LEU A 300 -3.644 -9.691 -2.431 1.00 0.00 O ATOM 707 CB LEU A 300 -3.791 -9.339 0.780 1.00 0.00 C ATOM 708 CG LEU A 300 -3.448 -8.620 2.085 1.00 0.00 C ATOM 709 CD1 LEU A 300 -3.380 -9.610 3.238 1.00 0.00 C ATOM 710 CD2 LEU A 300 -2.134 -7.866 1.949 1.00 0.00 C ATOM 0 H LEU A 300 -6.054 -7.859 -0.051 1.00 0.00 H new ATOM 0 HA LEU A 300 -3.167 -7.895 -0.685 1.00 0.00 H new ATOM 0 HB2 LEU A 300 -4.665 -9.967 0.953 1.00 0.00 H new ATOM 0 HB3 LEU A 300 -2.965 -10.004 0.527 1.00 0.00 H new ATOM 0 HG LEU A 300 -4.237 -7.899 2.298 1.00 0.00 H new ATOM 0 HD11 LEU A 300 -3.135 -9.080 4.158 1.00 0.00 H new ATOM 0 HD12 LEU A 300 -4.345 -10.105 3.350 1.00 0.00 H new ATOM 0 HD13 LEU A 300 -2.612 -10.355 3.033 1.00 0.00 H new ATOM 0 HD21 LEU A 300 -1.906 -7.360 2.887 1.00 0.00 H new ATOM 0 HD22 LEU A 300 -1.335 -8.568 1.711 1.00 0.00 H new ATOM 0 HD23 LEU A 300 -2.219 -7.129 1.151 1.00 0.00 H new ATOM 856 N VAL A 309 -2.902 -14.034 7.079 1.00 0.00 N ATOM 857 CA VAL A 309 -1.930 -13.166 6.424 1.00 0.00 C ATOM 858 C VAL A 309 -0.547 -13.807 6.404 1.00 0.00 C ATOM 859 O VAL A 309 0.203 -13.658 5.440 1.00 0.00 O ATOM 860 CB VAL A 309 -1.839 -11.797 7.123 1.00 0.00 C ATOM 861 CG1 VAL A 309 -0.769 -10.935 6.472 1.00 0.00 C ATOM 862 CG2 VAL A 309 -3.189 -11.095 7.097 1.00 0.00 C ATOM 0 HA VAL A 309 -2.275 -13.020 5.400 1.00 0.00 H new ATOM 0 HB VAL A 309 -1.558 -11.958 8.164 1.00 0.00 H new ATOM 0 HG11 VAL A 309 -0.719 -9.972 6.979 1.00 0.00 H new ATOM 0 HG12 VAL A 309 0.197 -11.435 6.547 1.00 0.00 H new ATOM 0 HG13 VAL A 309 -1.016 -10.780 5.422 1.00 0.00 H new ATOM 0 HG21 VAL A 309 -3.106 -10.129 7.595 1.00 0.00 H new ATOM 0 HG22 VAL A 309 -3.501 -10.945 6.064 1.00 0.00 H new ATOM 0 HG23 VAL A 309 -3.928 -11.708 7.614 1.00 0.00 H new ATOM 872 N ALA A 310 -0.216 -14.521 7.474 1.00 0.00 N ATOM 873 CA ALA A 310 1.076 -15.187 7.579 1.00 0.00 C ATOM 874 C ALA A 310 1.402 -15.957 6.303 1.00 0.00 C ATOM 875 O ALA A 310 2.464 -15.770 5.708 1.00 0.00 O ATOM 876 CB ALA A 310 1.093 -16.121 8.780 1.00 0.00 C ATOM 0 H ALA A 310 -0.825 -14.653 8.281 1.00 0.00 H new ATOM 0 HA ALA A 310 1.841 -14.422 7.717 1.00 0.00 H new ATOM 0 HB1 ALA A 310 2.064 -16.611 8.846 1.00 0.00 H new ATOM 0 HB2 ALA A 310 0.914 -15.548 9.689 1.00 0.00 H new ATOM 0 HB3 ALA A 310 0.313 -16.874 8.666 1.00 0.00 H new ATOM 882 N ASP A 311 0.483 -16.822 5.889 1.00 0.00 N ATOM 883 CA ASP A 311 0.673 -17.620 4.683 1.00 0.00 C ATOM 884 C ASP A 311 0.268 -16.832 3.441 1.00 0.00 C ATOM 885 O ASP A 311 -0.039 -17.411 2.399 1.00 0.00 O ATOM 886 CB ASP A 311 -0.139 -18.913 4.769 1.00 0.00 C ATOM 887 CG ASP A 311 0.644 -20.048 5.400 1.00 0.00 C ATOM 888 OD1 ASP A 311 1.676 -20.450 4.822 1.00 0.00 O ATOM 889 OD2 ASP A 311 0.226 -20.532 6.472 1.00 0.00 O ATOM 0 H ASP A 311 -0.401 -16.989 6.370 1.00 0.00 H new ATOM 0 HA ASP A 311 1.731 -17.869 4.604 1.00 0.00 H new ATOM 0 HB2 ASP A 311 -1.043 -18.733 5.350 1.00 0.00 H new ATOM 0 HB3 ASP A 311 -0.456 -19.207 3.768 1.00 0.00 H new ATOM 894 N VAL A 312 0.269 -15.508 3.560 1.00 0.00 N ATOM 895 CA VAL A 312 -0.098 -14.640 2.447 1.00 0.00 C ATOM 896 C VAL A 312 1.076 -13.767 2.021 1.00 0.00 C ATOM 897 O VAL A 312 1.295 -13.540 0.831 1.00 0.00 O ATOM 898 CB VAL A 312 -1.292 -13.736 2.810 1.00 0.00 C ATOM 899 CG1 VAL A 312 -1.631 -12.810 1.653 1.00 0.00 C ATOM 900 CG2 VAL A 312 -2.497 -14.578 3.201 1.00 0.00 C ATOM 0 H VAL A 312 0.520 -15.013 4.416 1.00 0.00 H new ATOM 0 HA VAL A 312 -0.383 -15.290 1.619 1.00 0.00 H new ATOM 0 HB VAL A 312 -1.014 -13.121 3.666 1.00 0.00 H new ATOM 0 HG11 VAL A 312 -2.476 -12.179 1.928 1.00 0.00 H new ATOM 0 HG12 VAL A 312 -0.769 -12.183 1.425 1.00 0.00 H new ATOM 0 HG13 VAL A 312 -1.891 -13.403 0.776 1.00 0.00 H new ATOM 0 HG21 VAL A 312 -3.331 -13.924 3.454 1.00 0.00 H new ATOM 0 HG22 VAL A 312 -2.779 -15.219 2.366 1.00 0.00 H new ATOM 0 HG23 VAL A 312 -2.245 -15.195 4.063 1.00 0.00 H new ATOM 910 N VAL A 313 1.829 -13.278 3.001 1.00 0.00 N ATOM 911 CA VAL A 313 2.984 -12.430 2.728 1.00 0.00 C ATOM 912 C VAL A 313 4.231 -12.958 3.428 1.00 0.00 C ATOM 913 O VAL A 313 4.147 -13.823 4.300 1.00 0.00 O ATOM 914 CB VAL A 313 2.732 -10.978 3.176 1.00 0.00 C ATOM 915 CG1 VAL A 313 1.757 -10.290 2.233 1.00 0.00 C ATOM 916 CG2 VAL A 313 2.216 -10.945 4.607 1.00 0.00 C ATOM 0 H VAL A 313 1.660 -13.454 3.991 1.00 0.00 H new ATOM 0 HA VAL A 313 3.142 -12.447 1.650 1.00 0.00 H new ATOM 0 HB VAL A 313 3.677 -10.436 3.142 1.00 0.00 H new ATOM 0 HG11 VAL A 313 1.591 -9.265 2.565 1.00 0.00 H new ATOM 0 HG12 VAL A 313 2.170 -10.282 1.225 1.00 0.00 H new ATOM 0 HG13 VAL A 313 0.810 -10.829 2.232 1.00 0.00 H new ATOM 0 HG21 VAL A 313 2.043 -9.912 4.908 1.00 0.00 H new ATOM 0 HG22 VAL A 313 1.281 -11.502 4.670 1.00 0.00 H new ATOM 0 HG23 VAL A 313 2.953 -11.397 5.270 1.00 0.00 H new ATOM 926 N SER A 314 5.388 -12.430 3.041 1.00 0.00 N ATOM 927 CA SER A 314 6.654 -12.850 3.629 1.00 0.00 C ATOM 928 C SER A 314 7.363 -11.672 4.291 1.00 0.00 C ATOM 929 O SER A 314 7.334 -10.550 3.784 1.00 0.00 O ATOM 930 CB SER A 314 7.558 -13.468 2.560 1.00 0.00 C ATOM 931 OG SER A 314 6.904 -14.534 1.894 1.00 0.00 O ATOM 0 H SER A 314 5.474 -11.711 2.323 1.00 0.00 H new ATOM 0 HA SER A 314 6.441 -13.599 4.392 1.00 0.00 H new ATOM 0 HB2 SER A 314 7.845 -12.705 1.837 1.00 0.00 H new ATOM 0 HB3 SER A 314 8.476 -13.832 3.021 1.00 0.00 H new ATOM 0 HG SER A 314 7.501 -14.911 1.215 1.00 0.00 H new ATOM 937 N LYS A 315 8.000 -11.935 5.427 1.00 0.00 N ATOM 938 CA LYS A 315 8.718 -10.899 6.160 1.00 0.00 C ATOM 939 C LYS A 315 9.951 -10.441 5.387 1.00 0.00 C ATOM 940 O LYS A 315 10.748 -11.259 4.930 1.00 0.00 O ATOM 941 CB LYS A 315 9.131 -11.414 7.540 1.00 0.00 C ATOM 942 CG LYS A 315 10.002 -10.443 8.317 1.00 0.00 C ATOM 943 CD LYS A 315 10.228 -10.914 9.744 1.00 0.00 C ATOM 944 CE LYS A 315 11.376 -11.909 9.826 1.00 0.00 C ATOM 945 NZ LYS A 315 12.699 -11.227 9.867 1.00 0.00 N ATOM 0 H LYS A 315 8.034 -12.858 5.860 1.00 0.00 H new ATOM 0 HA LYS A 315 8.050 -10.047 6.282 1.00 0.00 H new ATOM 0 HB2 LYS A 315 8.234 -11.629 8.121 1.00 0.00 H new ATOM 0 HB3 LYS A 315 9.668 -12.355 7.421 1.00 0.00 H new ATOM 0 HG2 LYS A 315 10.962 -10.332 7.814 1.00 0.00 H new ATOM 0 HG3 LYS A 315 9.532 -9.460 8.328 1.00 0.00 H new ATOM 0 HD2 LYS A 315 10.442 -10.056 10.382 1.00 0.00 H new ATOM 0 HD3 LYS A 315 9.317 -11.375 10.125 1.00 0.00 H new ATOM 0 HE2 LYS A 315 11.258 -12.527 10.716 1.00 0.00 H new ATOM 0 HE3 LYS A 315 11.339 -12.578 8.966 1.00 0.00 H new ATOM 0 HZ1 LYS A 315 13.455 -11.939 9.923 1.00 0.00 H new ATOM 0 HZ2 LYS A 315 12.823 -10.657 9.006 1.00 0.00 H new ATOM 0 HZ3 LYS A 315 12.745 -10.608 10.701 1.00 0.00 H new ATOM 959 N GLY A 316 10.101 -9.127 5.246 1.00 0.00 N ATOM 960 CA GLY A 316 11.240 -8.584 4.529 1.00 0.00 C ATOM 961 C GLY A 316 11.156 -8.830 3.036 1.00 0.00 C ATOM 962 O GLY A 316 12.178 -8.990 2.369 1.00 0.00 O ATOM 0 H GLY A 316 9.455 -8.430 5.615 1.00 0.00 H new ATOM 0 HA2 GLY A 316 11.305 -7.512 4.714 1.00 0.00 H new ATOM 0 HA3 GLY A 316 12.156 -9.030 4.917 1.00 0.00 H new ATOM 966 N GLN A 317 9.936 -8.861 2.510 1.00 0.00 N ATOM 967 CA GLN A 317 9.724 -9.092 1.086 1.00 0.00 C ATOM 968 C GLN A 317 9.344 -7.797 0.375 1.00 0.00 C ATOM 969 O GLN A 317 8.547 -7.009 0.885 1.00 0.00 O ATOM 970 CB GLN A 317 8.632 -10.142 0.875 1.00 0.00 C ATOM 971 CG GLN A 317 8.345 -10.436 -0.588 1.00 0.00 C ATOM 972 CD GLN A 317 6.942 -10.967 -0.813 1.00 0.00 C ATOM 973 OE1 GLN A 317 5.945 -10.211 -0.367 1.00 0.00 O flip ATOM 974 NE2 GLN A 317 6.757 -12.044 -1.380 1.00 0.00 N flip ATOM 0 H GLN A 317 9.080 -8.729 3.048 1.00 0.00 H new ATOM 0 HA GLN A 317 10.658 -9.459 0.660 1.00 0.00 H new ATOM 0 HB2 GLN A 317 8.928 -11.066 1.371 1.00 0.00 H new ATOM 0 HB3 GLN A 317 7.715 -9.802 1.355 1.00 0.00 H new ATOM 0 HG2 GLN A 317 8.483 -9.526 -1.171 1.00 0.00 H new ATOM 0 HG3 GLN A 317 9.068 -11.163 -0.957 1.00 0.00 H new ATOM 0 HE21 GLN A 317 7.553 -12.592 -1.706 1.00 0.00 H new ATOM 0 HE22 GLN A 317 5.808 -12.388 -1.523 1.00 0.00 H new ATOM 983 N ARG A 318 9.920 -7.584 -0.803 1.00 0.00 N ATOM 984 CA ARG A 318 9.643 -6.383 -1.583 1.00 0.00 C ATOM 985 C ARG A 318 8.287 -6.486 -2.275 1.00 0.00 C ATOM 986 O ARG A 318 7.980 -7.490 -2.918 1.00 0.00 O ATOM 987 CB ARG A 318 10.742 -6.160 -2.623 1.00 0.00 C ATOM 988 CG ARG A 318 10.957 -7.347 -3.547 1.00 0.00 C ATOM 989 CD ARG A 318 11.859 -6.986 -4.717 1.00 0.00 C ATOM 990 NE ARG A 318 13.274 -7.072 -4.364 1.00 0.00 N ATOM 991 CZ ARG A 318 14.242 -7.269 -5.252 1.00 0.00 C ATOM 992 NH1 ARG A 318 13.949 -7.400 -6.539 1.00 0.00 N ATOM 993 NH2 ARG A 318 15.506 -7.335 -4.854 1.00 0.00 N ATOM 0 H ARG A 318 10.581 -8.227 -1.239 1.00 0.00 H new ATOM 0 HA ARG A 318 9.620 -5.534 -0.900 1.00 0.00 H new ATOM 0 HB2 ARG A 318 10.491 -5.285 -3.222 1.00 0.00 H new ATOM 0 HB3 ARG A 318 11.677 -5.937 -2.109 1.00 0.00 H new ATOM 0 HG2 ARG A 318 11.399 -8.171 -2.986 1.00 0.00 H new ATOM 0 HG3 ARG A 318 9.995 -7.696 -3.922 1.00 0.00 H new ATOM 0 HD2 ARG A 318 11.653 -7.654 -5.553 1.00 0.00 H new ATOM 0 HD3 ARG A 318 11.630 -5.975 -5.053 1.00 0.00 H new ATOM 0 HE ARG A 318 13.533 -6.976 -3.382 1.00 0.00 H new ATOM 0 HH11 ARG A 318 12.978 -7.350 -6.849 1.00 0.00 H new ATOM 0 HH12 ARG A 318 14.694 -7.551 -7.219 1.00 0.00 H new ATOM 0 HH21 ARG A 318 15.735 -7.234 -3.865 1.00 0.00 H new ATOM 0 HH22 ARG A 318 16.248 -7.486 -5.537 1.00 0.00 H new ATOM 1007 N VAL A 319 7.478 -5.439 -2.139 1.00 0.00 N ATOM 1008 CA VAL A 319 6.155 -5.411 -2.751 1.00 0.00 C ATOM 1009 C VAL A 319 5.795 -4.004 -3.215 1.00 0.00 C ATOM 1010 O VAL A 319 6.442 -3.028 -2.836 1.00 0.00 O ATOM 1011 CB VAL A 319 5.074 -5.910 -1.774 1.00 0.00 C ATOM 1012 CG1 VAL A 319 5.334 -7.357 -1.384 1.00 0.00 C ATOM 1013 CG2 VAL A 319 5.016 -5.019 -0.543 1.00 0.00 C ATOM 0 H VAL A 319 7.716 -4.600 -1.611 1.00 0.00 H new ATOM 0 HA VAL A 319 6.190 -6.077 -3.613 1.00 0.00 H new ATOM 0 HB VAL A 319 4.107 -5.862 -2.274 1.00 0.00 H new ATOM 0 HG11 VAL A 319 4.560 -7.692 -0.693 1.00 0.00 H new ATOM 0 HG12 VAL A 319 5.320 -7.983 -2.276 1.00 0.00 H new ATOM 0 HG13 VAL A 319 6.309 -7.434 -0.902 1.00 0.00 H new ATOM 0 HG21 VAL A 319 4.247 -5.386 0.136 1.00 0.00 H new ATOM 0 HG22 VAL A 319 5.982 -5.032 -0.038 1.00 0.00 H new ATOM 0 HG23 VAL A 319 4.777 -3.999 -0.843 1.00 0.00 H new ATOM 1023 N LYS A 320 4.757 -3.907 -4.039 1.00 0.00 N ATOM 1024 CA LYS A 320 4.307 -2.619 -4.555 1.00 0.00 C ATOM 1025 C LYS A 320 2.971 -2.222 -3.936 1.00 0.00 C ATOM 1026 O LYS A 320 2.036 -3.021 -3.885 1.00 0.00 O ATOM 1027 CB LYS A 320 4.179 -2.674 -6.079 1.00 0.00 C ATOM 1028 CG LYS A 320 5.470 -3.051 -6.784 1.00 0.00 C ATOM 1029 CD LYS A 320 5.380 -2.806 -8.281 1.00 0.00 C ATOM 1030 CE LYS A 320 5.831 -1.399 -8.644 1.00 0.00 C ATOM 1031 NZ LYS A 320 4.853 -0.370 -8.195 1.00 0.00 N ATOM 0 H LYS A 320 4.211 -4.705 -4.364 1.00 0.00 H new ATOM 0 HA LYS A 320 5.050 -1.868 -4.286 1.00 0.00 H new ATOM 0 HB2 LYS A 320 3.406 -3.395 -6.345 1.00 0.00 H new ATOM 0 HB3 LYS A 320 3.847 -1.702 -6.443 1.00 0.00 H new ATOM 0 HG2 LYS A 320 6.295 -2.472 -6.369 1.00 0.00 H new ATOM 0 HG3 LYS A 320 5.693 -4.102 -6.599 1.00 0.00 H new ATOM 0 HD2 LYS A 320 5.997 -3.534 -8.808 1.00 0.00 H new ATOM 0 HD3 LYS A 320 4.353 -2.958 -8.614 1.00 0.00 H new ATOM 0 HE2 LYS A 320 6.802 -1.200 -8.190 1.00 0.00 H new ATOM 0 HE3 LYS A 320 5.964 -1.327 -9.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 320 4.921 0.466 -8.810 1.00 0.00 H new ATOM 0 HZ2 LYS A 320 3.890 -0.760 -8.247 1.00 0.00 H new ATOM 0 HZ3 LYS A 320 5.063 -0.096 -7.214 1.00 0.00 H new ATOM 1045 N VAL A 321 2.886 -0.980 -3.467 1.00 0.00 N ATOM 1046 CA VAL A 321 1.664 -0.476 -2.854 1.00 0.00 C ATOM 1047 C VAL A 321 1.289 0.890 -3.419 1.00 0.00 C ATOM 1048 O VAL A 321 2.138 1.612 -3.942 1.00 0.00 O ATOM 1049 CB VAL A 321 1.807 -0.366 -1.325 1.00 0.00 C ATOM 1050 CG1 VAL A 321 1.890 -1.748 -0.695 1.00 0.00 C ATOM 1051 CG2 VAL A 321 3.026 0.468 -0.963 1.00 0.00 C ATOM 0 H VAL A 321 3.650 -0.305 -3.501 1.00 0.00 H new ATOM 0 HA VAL A 321 0.875 -1.191 -3.086 1.00 0.00 H new ATOM 0 HB VAL A 321 0.923 0.134 -0.930 1.00 0.00 H new ATOM 0 HG11 VAL A 321 1.991 -1.650 0.386 1.00 0.00 H new ATOM 0 HG12 VAL A 321 0.984 -2.308 -0.926 1.00 0.00 H new ATOM 0 HG13 VAL A 321 2.755 -2.278 -1.093 1.00 0.00 H new ATOM 0 HG21 VAL A 321 3.112 0.535 0.122 1.00 0.00 H new ATOM 0 HG22 VAL A 321 3.922 -0.002 -1.369 1.00 0.00 H new ATOM 0 HG23 VAL A 321 2.919 1.469 -1.381 1.00 0.00 H new ATOM 1061 N LYS A 322 0.012 1.239 -3.309 1.00 0.00 N ATOM 1062 CA LYS A 322 -0.477 2.519 -3.806 1.00 0.00 C ATOM 1063 C LYS A 322 -1.056 3.359 -2.671 1.00 0.00 C ATOM 1064 O LYS A 322 -1.735 2.839 -1.786 1.00 0.00 O ATOM 1065 CB LYS A 322 -1.541 2.299 -4.885 1.00 0.00 C ATOM 1066 CG LYS A 322 -2.038 3.585 -5.521 1.00 0.00 C ATOM 1067 CD LYS A 322 -3.462 3.440 -6.031 1.00 0.00 C ATOM 1068 CE LYS A 322 -3.490 2.958 -7.474 1.00 0.00 C ATOM 1069 NZ LYS A 322 -2.802 3.909 -8.390 1.00 0.00 N ATOM 0 H LYS A 322 -0.704 0.653 -2.880 1.00 0.00 H new ATOM 0 HA LYS A 322 0.366 3.057 -4.240 1.00 0.00 H new ATOM 0 HB2 LYS A 322 -1.130 1.654 -5.662 1.00 0.00 H new ATOM 0 HB3 LYS A 322 -2.387 1.770 -4.446 1.00 0.00 H new ATOM 0 HG2 LYS A 322 -1.992 4.394 -4.792 1.00 0.00 H new ATOM 0 HG3 LYS A 322 -1.381 3.862 -6.346 1.00 0.00 H new ATOM 0 HD2 LYS A 322 -4.006 2.737 -5.400 1.00 0.00 H new ATOM 0 HD3 LYS A 322 -3.976 4.398 -5.956 1.00 0.00 H new ATOM 0 HE2 LYS A 322 -3.012 1.981 -7.540 1.00 0.00 H new ATOM 0 HE3 LYS A 322 -4.524 2.829 -7.794 1.00 0.00 H new ATOM 0 HZ1 LYS A 322 -3.466 4.223 -9.127 1.00 0.00 H new ATOM 0 HZ2 LYS A 322 -2.470 4.733 -7.849 1.00 0.00 H new ATOM 0 HZ3 LYS A 322 -1.989 3.436 -8.835 1.00 0.00 H new ATOM 1083 N VAL A 323 -0.783 4.659 -2.705 1.00 0.00 N ATOM 1084 CA VAL A 323 -1.279 5.571 -1.681 1.00 0.00 C ATOM 1085 C VAL A 323 -2.767 5.845 -1.863 1.00 0.00 C ATOM 1086 O VAL A 323 -3.167 6.602 -2.750 1.00 0.00 O ATOM 1087 CB VAL A 323 -0.515 6.908 -1.703 1.00 0.00 C ATOM 1088 CG1 VAL A 323 -1.076 7.861 -0.658 1.00 0.00 C ATOM 1089 CG2 VAL A 323 0.972 6.676 -1.481 1.00 0.00 C ATOM 0 H VAL A 323 -0.221 5.105 -3.430 1.00 0.00 H new ATOM 0 HA VAL A 323 -1.118 5.085 -0.719 1.00 0.00 H new ATOM 0 HB VAL A 323 -0.645 7.365 -2.684 1.00 0.00 H new ATOM 0 HG11 VAL A 323 -0.524 8.800 -0.688 1.00 0.00 H new ATOM 0 HG12 VAL A 323 -2.129 8.052 -0.867 1.00 0.00 H new ATOM 0 HG13 VAL A 323 -0.978 7.414 0.332 1.00 0.00 H new ATOM 0 HG21 VAL A 323 1.496 7.632 -1.500 1.00 0.00 H new ATOM 0 HG22 VAL A 323 1.125 6.197 -0.514 1.00 0.00 H new ATOM 0 HG23 VAL A 323 1.362 6.033 -2.270 1.00 0.00 H new ATOM 1099 N LEU A 324 -3.585 5.227 -1.018 1.00 0.00 N ATOM 1100 CA LEU A 324 -5.032 5.405 -1.085 1.00 0.00 C ATOM 1101 C LEU A 324 -5.447 6.730 -0.455 1.00 0.00 C ATOM 1102 O LEU A 324 -6.236 7.481 -1.029 1.00 0.00 O ATOM 1103 CB LEU A 324 -5.740 4.247 -0.380 1.00 0.00 C ATOM 1104 CG LEU A 324 -5.400 2.844 -0.884 1.00 0.00 C ATOM 1105 CD1 LEU A 324 -5.905 1.790 0.089 1.00 0.00 C ATOM 1106 CD2 LEU A 324 -5.987 2.618 -2.269 1.00 0.00 C ATOM 0 H LEU A 324 -3.271 4.598 -0.279 1.00 0.00 H new ATOM 0 HA LEU A 324 -5.325 5.416 -2.135 1.00 0.00 H new ATOM 0 HB2 LEU A 324 -5.504 4.296 0.683 1.00 0.00 H new ATOM 0 HB3 LEU A 324 -6.816 4.394 -0.474 1.00 0.00 H new ATOM 0 HG LEU A 324 -4.316 2.756 -0.952 1.00 0.00 H new ATOM 0 HD11 LEU A 324 -5.654 0.798 -0.287 1.00 0.00 H new ATOM 0 HD12 LEU A 324 -5.437 1.939 1.062 1.00 0.00 H new ATOM 0 HD13 LEU A 324 -6.987 1.877 0.190 1.00 0.00 H new ATOM 0 HD21 LEU A 324 -5.735 1.614 -2.612 1.00 0.00 H new ATOM 0 HD22 LEU A 324 -7.071 2.726 -2.227 1.00 0.00 H new ATOM 0 HD23 LEU A 324 -5.576 3.352 -2.962 1.00 0.00 H new ATOM 1118 N SER A 325 -4.909 7.012 0.727 1.00 0.00 N ATOM 1119 CA SER A 325 -5.225 8.246 1.436 1.00 0.00 C ATOM 1120 C SER A 325 -4.178 8.542 2.505 1.00 0.00 C ATOM 1121 O SER A 325 -3.669 7.632 3.161 1.00 0.00 O ATOM 1122 CB SER A 325 -6.611 8.151 2.077 1.00 0.00 C ATOM 1123 OG SER A 325 -6.569 7.393 3.274 1.00 0.00 O ATOM 0 H SER A 325 -4.252 6.402 1.214 1.00 0.00 H new ATOM 0 HA SER A 325 -5.222 9.062 0.713 1.00 0.00 H new ATOM 0 HB2 SER A 325 -6.986 9.152 2.290 1.00 0.00 H new ATOM 0 HB3 SER A 325 -7.308 7.692 1.376 1.00 0.00 H new ATOM 0 HG SER A 325 -7.467 7.349 3.665 1.00 0.00 H new ATOM 1129 N PHE A 326 -3.860 9.821 2.676 1.00 0.00 N ATOM 1130 CA PHE A 326 -2.873 10.239 3.664 1.00 0.00 C ATOM 1131 C PHE A 326 -3.437 11.330 4.569 1.00 0.00 C ATOM 1132 O PHE A 326 -3.898 12.369 4.095 1.00 0.00 O ATOM 1133 CB PHE A 326 -1.605 10.741 2.969 1.00 0.00 C ATOM 1134 CG PHE A 326 -0.695 11.521 3.874 1.00 0.00 C ATOM 1135 CD1 PHE A 326 -0.091 10.913 4.963 1.00 0.00 C ATOM 1136 CD2 PHE A 326 -0.442 12.862 3.635 1.00 0.00 C ATOM 1137 CE1 PHE A 326 0.747 11.628 5.797 1.00 0.00 C ATOM 1138 CE2 PHE A 326 0.396 13.582 4.466 1.00 0.00 C ATOM 1139 CZ PHE A 326 0.990 12.964 5.549 1.00 0.00 C ATOM 0 H PHE A 326 -4.272 10.586 2.142 1.00 0.00 H new ATOM 0 HA PHE A 326 -2.623 9.375 4.279 1.00 0.00 H new ATOM 0 HB2 PHE A 326 -1.059 9.888 2.566 1.00 0.00 H new ATOM 0 HB3 PHE A 326 -1.888 11.368 2.123 1.00 0.00 H new ATOM 0 HD1 PHE A 326 -0.277 9.868 5.162 1.00 0.00 H new ATOM 0 HD2 PHE A 326 -0.905 13.350 2.790 1.00 0.00 H new ATOM 0 HE1 PHE A 326 1.212 11.142 6.642 1.00 0.00 H new ATOM 0 HE2 PHE A 326 0.586 14.627 4.269 1.00 0.00 H new ATOM 0 HZ PHE A 326 1.643 13.525 6.201 1.00 0.00 H new ATOM 1149 N THR A 327 -3.397 11.087 5.875 1.00 0.00 N ATOM 1150 CA THR A 327 -3.905 12.047 6.847 1.00 0.00 C ATOM 1151 C THR A 327 -3.064 12.038 8.119 1.00 0.00 C ATOM 1152 O THR A 327 -2.964 11.020 8.802 1.00 0.00 O ATOM 1153 CB THR A 327 -5.372 11.753 7.213 1.00 0.00 C ATOM 1154 OG1 THR A 327 -5.841 12.714 8.165 1.00 0.00 O ATOM 1155 CG2 THR A 327 -5.516 10.351 7.786 1.00 0.00 C ATOM 0 H THR A 327 -3.018 10.233 6.284 1.00 0.00 H new ATOM 0 HA THR A 327 -3.845 13.031 6.381 1.00 0.00 H new ATOM 0 HB THR A 327 -5.971 11.820 6.305 1.00 0.00 H new ATOM 0 HG1 THR A 327 -6.775 12.521 8.391 1.00 0.00 H new ATOM 0 HG21 THR A 327 -6.560 10.166 8.037 1.00 0.00 H new ATOM 0 HG22 THR A 327 -5.185 9.620 7.048 1.00 0.00 H new ATOM 0 HG23 THR A 327 -4.905 10.261 8.684 1.00 0.00 H new ATOM 1163 N GLY A 328 -2.462 13.181 8.433 1.00 0.00 N ATOM 1164 CA GLY A 328 -1.638 13.283 9.623 1.00 0.00 C ATOM 1165 C GLY A 328 -0.673 12.122 9.762 1.00 0.00 C ATOM 1166 O GLY A 328 0.180 11.907 8.900 1.00 0.00 O ATOM 0 H GLY A 328 -2.530 14.038 7.884 1.00 0.00 H new ATOM 0 HA2 GLY A 328 -1.076 14.217 9.593 1.00 0.00 H new ATOM 0 HA3 GLY A 328 -2.280 13.325 10.503 1.00 0.00 H new ATOM 1170 N THR A 329 -0.806 11.371 10.851 1.00 0.00 N ATOM 1171 CA THR A 329 0.062 10.228 11.101 1.00 0.00 C ATOM 1172 C THR A 329 -0.576 8.934 10.607 1.00 0.00 C ATOM 1173 O THR A 329 -0.466 7.891 11.251 1.00 0.00 O ATOM 1174 CB THR A 329 0.387 10.087 12.601 1.00 0.00 C ATOM 1175 OG1 THR A 329 -0.824 10.073 13.365 1.00 0.00 O ATOM 1176 CG2 THR A 329 1.276 11.228 13.071 1.00 0.00 C ATOM 0 H THR A 329 -1.507 11.534 11.574 1.00 0.00 H new ATOM 0 HA THR A 329 0.986 10.407 10.551 1.00 0.00 H new ATOM 0 HB THR A 329 0.920 9.148 12.749 1.00 0.00 H new ATOM 0 HG1 THR A 329 -0.609 9.981 14.317 1.00 0.00 H new ATOM 0 HG21 THR A 329 1.492 11.107 14.133 1.00 0.00 H new ATOM 0 HG22 THR A 329 2.209 11.218 12.507 1.00 0.00 H new ATOM 0 HG23 THR A 329 0.765 12.177 12.910 1.00 0.00 H new ATOM 1184 N LYS A 330 -1.242 9.009 9.460 1.00 0.00 N ATOM 1185 CA LYS A 330 -1.896 7.844 8.878 1.00 0.00 C ATOM 1186 C LYS A 330 -1.619 7.756 7.380 1.00 0.00 C ATOM 1187 O LYS A 330 -1.777 8.735 6.650 1.00 0.00 O ATOM 1188 CB LYS A 330 -3.405 7.904 9.125 1.00 0.00 C ATOM 1189 CG LYS A 330 -4.113 6.581 8.888 1.00 0.00 C ATOM 1190 CD LYS A 330 -5.531 6.601 9.436 1.00 0.00 C ATOM 1191 CE LYS A 330 -6.298 5.348 9.042 1.00 0.00 C ATOM 1192 NZ LYS A 330 -6.107 4.249 10.028 1.00 0.00 N ATOM 0 H LYS A 330 -1.343 9.865 8.915 1.00 0.00 H new ATOM 0 HA LYS A 330 -1.490 6.953 9.358 1.00 0.00 H new ATOM 0 HB2 LYS A 330 -3.584 8.224 10.152 1.00 0.00 H new ATOM 0 HB3 LYS A 330 -3.841 8.662 8.474 1.00 0.00 H new ATOM 0 HG2 LYS A 330 -4.138 6.367 7.820 1.00 0.00 H new ATOM 0 HG3 LYS A 330 -3.550 5.776 9.361 1.00 0.00 H new ATOM 0 HD2 LYS A 330 -5.501 6.684 10.522 1.00 0.00 H new ATOM 0 HD3 LYS A 330 -6.054 7.482 9.063 1.00 0.00 H new ATOM 0 HE2 LYS A 330 -7.359 5.582 8.960 1.00 0.00 H new ATOM 0 HE3 LYS A 330 -5.968 5.015 8.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 330 -6.645 3.413 9.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 330 -5.097 4.008 10.088 1.00 0.00 H new ATOM 0 HZ3 LYS A 330 -6.445 4.558 10.962 1.00 0.00 H new ATOM 1206 N THR A 331 -1.206 6.577 6.927 1.00 0.00 N ATOM 1207 CA THR A 331 -0.908 6.361 5.517 1.00 0.00 C ATOM 1208 C THR A 331 -1.434 5.011 5.044 1.00 0.00 C ATOM 1209 O THR A 331 -0.892 3.964 5.398 1.00 0.00 O ATOM 1210 CB THR A 331 0.607 6.433 5.246 1.00 0.00 C ATOM 1211 OG1 THR A 331 1.175 7.554 5.931 1.00 0.00 O ATOM 1212 CG2 THR A 331 0.885 6.550 3.755 1.00 0.00 C ATOM 0 H THR A 331 -1.070 5.756 7.517 1.00 0.00 H new ATOM 0 HA THR A 331 -1.407 7.156 4.963 1.00 0.00 H new ATOM 0 HB THR A 331 1.063 5.514 5.614 1.00 0.00 H new ATOM 0 HG1 THR A 331 2.138 7.591 5.754 1.00 0.00 H new ATOM 0 HG21 THR A 331 1.961 6.599 3.588 1.00 0.00 H new ATOM 0 HG22 THR A 331 0.477 5.680 3.240 1.00 0.00 H new ATOM 0 HG23 THR A 331 0.416 7.454 3.367 1.00 0.00 H new ATOM 1220 N SER A 332 -2.493 5.042 4.241 1.00 0.00 N ATOM 1221 CA SER A 332 -3.094 3.820 3.721 1.00 0.00 C ATOM 1222 C SER A 332 -2.287 3.273 2.548 1.00 0.00 C ATOM 1223 O SER A 332 -1.656 4.029 1.807 1.00 0.00 O ATOM 1224 CB SER A 332 -4.537 4.082 3.284 1.00 0.00 C ATOM 1225 OG SER A 332 -5.429 3.977 4.379 1.00 0.00 O ATOM 0 H SER A 332 -2.952 5.900 3.937 1.00 0.00 H new ATOM 0 HA SER A 332 -3.092 3.077 4.518 1.00 0.00 H new ATOM 0 HB2 SER A 332 -4.612 5.076 2.844 1.00 0.00 H new ATOM 0 HB3 SER A 332 -4.821 3.369 2.510 1.00 0.00 H new ATOM 0 HG SER A 332 -6.344 4.150 4.073 1.00 0.00 H new ATOM 1231 N LEU A 333 -2.310 1.955 2.384 1.00 0.00 N ATOM 1232 CA LEU A 333 -1.581 1.305 1.301 1.00 0.00 C ATOM 1233 C LEU A 333 -2.377 0.135 0.734 1.00 0.00 C ATOM 1234 O LEU A 333 -2.899 -0.694 1.480 1.00 0.00 O ATOM 1235 CB LEU A 333 -0.219 0.816 1.798 1.00 0.00 C ATOM 1236 CG LEU A 333 0.764 1.902 2.237 1.00 0.00 C ATOM 1237 CD1 LEU A 333 2.015 1.279 2.837 1.00 0.00 C ATOM 1238 CD2 LEU A 333 1.125 2.801 1.064 1.00 0.00 C ATOM 0 H LEU A 333 -2.826 1.315 2.988 1.00 0.00 H new ATOM 0 HA LEU A 333 -1.431 2.037 0.507 1.00 0.00 H new ATOM 0 HB2 LEU A 333 -0.382 0.140 2.638 1.00 0.00 H new ATOM 0 HB3 LEU A 333 0.247 0.232 1.004 1.00 0.00 H new ATOM 0 HG LEU A 333 0.283 2.512 3.002 1.00 0.00 H new ATOM 0 HD11 LEU A 333 2.703 2.067 3.144 1.00 0.00 H new ATOM 0 HD12 LEU A 333 1.742 0.678 3.704 1.00 0.00 H new ATOM 0 HD13 LEU A 333 2.498 0.645 2.094 1.00 0.00 H new ATOM 0 HD21 LEU A 333 1.825 3.568 1.395 1.00 0.00 H new ATOM 0 HD22 LEU A 333 1.586 2.204 0.277 1.00 0.00 H new ATOM 0 HD23 LEU A 333 0.223 3.276 0.678 1.00 0.00 H new ATOM 1250 N SER A 334 -2.465 0.072 -0.591 1.00 0.00 N ATOM 1251 CA SER A 334 -3.199 -0.996 -1.259 1.00 0.00 C ATOM 1252 C SER A 334 -2.260 -1.862 -2.093 1.00 0.00 C ATOM 1253 O SER A 334 -1.462 -1.352 -2.879 1.00 0.00 O ATOM 1254 CB SER A 334 -4.296 -0.410 -2.150 1.00 0.00 C ATOM 1255 OG SER A 334 -3.766 0.554 -3.044 1.00 0.00 O ATOM 0 H SER A 334 -2.037 0.748 -1.223 1.00 0.00 H new ATOM 0 HA SER A 334 -3.658 -1.621 -0.493 1.00 0.00 H new ATOM 0 HB2 SER A 334 -4.776 -1.209 -2.715 1.00 0.00 H new ATOM 0 HB3 SER A 334 -5.066 0.049 -1.530 1.00 0.00 H new ATOM 0 HG SER A 334 -4.296 0.562 -3.868 1.00 0.00 H new ATOM 1261 N MET A 335 -2.361 -3.175 -1.914 1.00 0.00 N ATOM 1262 CA MET A 335 -1.521 -4.113 -2.650 1.00 0.00 C ATOM 1263 C MET A 335 -2.281 -4.713 -3.828 1.00 0.00 C ATOM 1264 O MET A 335 -1.826 -4.651 -4.971 1.00 0.00 O ATOM 1265 CB MET A 335 -1.031 -5.227 -1.723 1.00 0.00 C ATOM 1266 CG MET A 335 -0.041 -4.752 -0.672 1.00 0.00 C ATOM 1267 SD MET A 335 0.588 -6.099 0.349 1.00 0.00 S ATOM 1268 CE MET A 335 1.375 -7.125 -0.891 1.00 0.00 C ATOM 0 H MET A 335 -3.016 -3.613 -1.266 1.00 0.00 H new ATOM 0 HA MET A 335 -0.660 -3.567 -3.036 1.00 0.00 H new ATOM 0 HB2 MET A 335 -1.889 -5.677 -1.224 1.00 0.00 H new ATOM 0 HB3 MET A 335 -0.565 -6.009 -2.323 1.00 0.00 H new ATOM 0 HG2 MET A 335 0.794 -4.254 -1.164 1.00 0.00 H new ATOM 0 HG3 MET A 335 -0.522 -4.011 -0.033 1.00 0.00 H new ATOM 0 HE1 MET A 335 2.110 -7.773 -0.414 1.00 0.00 H new ATOM 0 HE2 MET A 335 0.622 -7.735 -1.390 1.00 0.00 H new ATOM 0 HE3 MET A 335 1.873 -6.491 -1.625 1.00 0.00 H new ATOM 1278 N LYS A 336 -3.441 -5.295 -3.544 1.00 0.00 N ATOM 1279 CA LYS A 336 -4.265 -5.906 -4.580 1.00 0.00 C ATOM 1280 C LYS A 336 -4.467 -4.949 -5.750 1.00 0.00 C ATOM 1281 O LYS A 336 -4.509 -5.367 -6.907 1.00 0.00 O ATOM 1282 CB LYS A 336 -5.622 -6.318 -4.004 1.00 0.00 C ATOM 1283 CG LYS A 336 -6.424 -5.156 -3.444 1.00 0.00 C ATOM 1284 CD LYS A 336 -7.911 -5.465 -3.420 1.00 0.00 C ATOM 1285 CE LYS A 336 -8.708 -4.320 -2.813 1.00 0.00 C ATOM 1286 NZ LYS A 336 -10.176 -4.548 -2.921 1.00 0.00 N ATOM 0 H LYS A 336 -3.832 -5.356 -2.604 1.00 0.00 H new ATOM 0 HA LYS A 336 -3.747 -6.793 -4.945 1.00 0.00 H new ATOM 0 HB2 LYS A 336 -6.205 -6.808 -4.784 1.00 0.00 H new ATOM 0 HB3 LYS A 336 -5.464 -7.053 -3.215 1.00 0.00 H new ATOM 0 HG2 LYS A 336 -6.082 -4.930 -2.434 1.00 0.00 H new ATOM 0 HG3 LYS A 336 -6.246 -4.266 -4.047 1.00 0.00 H new ATOM 0 HD2 LYS A 336 -8.261 -5.655 -4.435 1.00 0.00 H new ATOM 0 HD3 LYS A 336 -8.085 -6.375 -2.847 1.00 0.00 H new ATOM 0 HE2 LYS A 336 -8.435 -4.203 -1.764 1.00 0.00 H new ATOM 0 HE3 LYS A 336 -8.447 -3.389 -3.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 336 -10.684 -3.746 -2.496 1.00 0.00 H new ATOM 0 HZ2 LYS A 336 -10.441 -4.634 -3.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 336 -10.429 -5.423 -2.419 1.00 0.00 H new ATOM 1300 N ASP A 337 -4.591 -3.663 -5.441 1.00 0.00 N ATOM 1301 CA ASP A 337 -4.786 -2.645 -6.467 1.00 0.00 C ATOM 1302 C ASP A 337 -3.589 -2.589 -7.412 1.00 0.00 C ATOM 1303 O ASP A 337 -3.747 -2.433 -8.623 1.00 0.00 O ATOM 1304 CB ASP A 337 -5.007 -1.276 -5.823 1.00 0.00 C ATOM 1305 CG ASP A 337 -5.889 -0.375 -6.665 1.00 0.00 C ATOM 1306 OD1 ASP A 337 -5.763 -0.414 -7.907 1.00 0.00 O ATOM 1307 OD2 ASP A 337 -6.705 0.368 -6.082 1.00 0.00 O ATOM 0 H ASP A 337 -4.560 -3.301 -4.488 1.00 0.00 H new ATOM 0 HA ASP A 337 -5.671 -2.913 -7.045 1.00 0.00 H new ATOM 0 HB2 ASP A 337 -5.461 -1.409 -4.841 1.00 0.00 H new ATOM 0 HB3 ASP A 337 -4.043 -0.792 -5.666 1.00 0.00 H new ATOM 1312 N VAL A 338 -2.392 -2.717 -6.849 1.00 0.00 N ATOM 1313 CA VAL A 338 -1.167 -2.681 -7.641 1.00 0.00 C ATOM 1314 C VAL A 338 -0.640 -4.088 -7.901 1.00 0.00 C ATOM 1315 O VAL A 338 -0.087 -4.729 -7.008 1.00 0.00 O ATOM 1316 CB VAL A 338 -0.071 -1.855 -6.942 1.00 0.00 C ATOM 1317 CG1 VAL A 338 1.194 -1.825 -7.785 1.00 0.00 C ATOM 1318 CG2 VAL A 338 -0.567 -0.445 -6.658 1.00 0.00 C ATOM 0 H VAL A 338 -2.244 -2.847 -5.848 1.00 0.00 H new ATOM 0 HA VAL A 338 -1.417 -2.208 -8.591 1.00 0.00 H new ATOM 0 HB VAL A 338 0.167 -2.330 -5.990 1.00 0.00 H new ATOM 0 HG11 VAL A 338 1.957 -1.237 -7.275 1.00 0.00 H new ATOM 0 HG12 VAL A 338 1.558 -2.842 -7.932 1.00 0.00 H new ATOM 0 HG13 VAL A 338 0.975 -1.374 -8.753 1.00 0.00 H new ATOM 0 HG21 VAL A 338 0.220 0.125 -6.164 1.00 0.00 H new ATOM 0 HG22 VAL A 338 -0.834 0.043 -7.596 1.00 0.00 H new ATOM 0 HG23 VAL A 338 -1.443 -0.491 -6.011 1.00 0.00 H new ATOM 1328 N ASP A 339 -0.816 -4.561 -9.130 1.00 0.00 N ATOM 1329 CA ASP A 339 -0.356 -5.892 -9.510 1.00 0.00 C ATOM 1330 C ASP A 339 1.067 -6.136 -9.017 1.00 0.00 C ATOM 1331 O ASP A 339 1.961 -5.323 -9.248 1.00 0.00 O ATOM 1332 CB ASP A 339 -0.420 -6.063 -11.028 1.00 0.00 C ATOM 1333 CG ASP A 339 -0.501 -7.519 -11.444 1.00 0.00 C ATOM 1334 OD1 ASP A 339 -1.153 -8.306 -10.725 1.00 0.00 O ATOM 1335 OD2 ASP A 339 0.085 -7.871 -12.488 1.00 0.00 O ATOM 0 H ASP A 339 -1.274 -4.043 -9.880 1.00 0.00 H new ATOM 0 HA ASP A 339 -1.014 -6.624 -9.042 1.00 0.00 H new ATOM 0 HB2 ASP A 339 -1.288 -5.529 -11.415 1.00 0.00 H new ATOM 0 HB3 ASP A 339 0.461 -5.608 -11.479 1.00 0.00 H new ATOM 1340 N GLN A 340 1.268 -7.261 -8.338 1.00 0.00 N ATOM 1341 CA GLN A 340 2.582 -7.610 -7.812 1.00 0.00 C ATOM 1342 C GLN A 340 3.455 -8.231 -8.897 1.00 0.00 C ATOM 1343 O GLN A 340 4.153 -9.216 -8.657 1.00 0.00 O ATOM 1344 CB GLN A 340 2.443 -8.579 -6.636 1.00 0.00 C ATOM 1345 CG GLN A 340 1.593 -8.037 -5.498 1.00 0.00 C ATOM 1346 CD GLN A 340 2.195 -6.801 -4.858 1.00 0.00 C ATOM 1347 OE1 GLN A 340 3.201 -6.880 -4.153 1.00 0.00 O ATOM 1348 NE2 GLN A 340 1.580 -5.650 -5.101 1.00 0.00 N ATOM 0 H GLN A 340 0.538 -7.945 -8.140 1.00 0.00 H new ATOM 0 HA GLN A 340 3.061 -6.695 -7.465 1.00 0.00 H new ATOM 0 HB2 GLN A 340 2.005 -9.511 -6.994 1.00 0.00 H new ATOM 0 HB3 GLN A 340 3.435 -8.819 -6.255 1.00 0.00 H new ATOM 0 HG2 GLN A 340 0.598 -7.799 -5.874 1.00 0.00 H new ATOM 0 HG3 GLN A 340 1.471 -8.811 -4.740 1.00 0.00 H new ATOM 0 HE21 GLN A 340 0.749 -5.631 -5.692 1.00 0.00 H new ATOM 0 HE22 GLN A 340 1.939 -4.785 -4.697 1.00 0.00 H new ATOM 1357 N GLU A 341 3.411 -7.649 -10.091 1.00 0.00 N ATOM 1358 CA GLU A 341 4.198 -8.147 -11.213 1.00 0.00 C ATOM 1359 C GLU A 341 4.957 -7.010 -11.892 1.00 0.00 C ATOM 1360 O GLU A 341 6.169 -7.091 -12.095 1.00 0.00 O ATOM 1361 CB GLU A 341 3.293 -8.848 -12.228 1.00 0.00 C ATOM 1362 CG GLU A 341 4.038 -9.386 -13.438 1.00 0.00 C ATOM 1363 CD GLU A 341 4.766 -10.684 -13.146 1.00 0.00 C ATOM 1364 OE1 GLU A 341 4.144 -11.592 -12.556 1.00 0.00 O ATOM 1365 OE2 GLU A 341 5.956 -10.791 -13.508 1.00 0.00 O ATOM 0 H GLU A 341 2.839 -6.832 -10.306 1.00 0.00 H new ATOM 0 HA GLU A 341 4.922 -8.864 -10.826 1.00 0.00 H new ATOM 0 HB2 GLU A 341 2.777 -9.671 -11.734 1.00 0.00 H new ATOM 0 HB3 GLU A 341 2.528 -8.148 -12.564 1.00 0.00 H new ATOM 0 HG2 GLU A 341 3.332 -9.545 -14.253 1.00 0.00 H new ATOM 0 HG3 GLU A 341 4.756 -8.640 -13.779 1.00 0.00 H new ATOM 1372 N THR A 342 4.235 -5.950 -12.243 1.00 0.00 N ATOM 1373 CA THR A 342 4.837 -4.798 -12.900 1.00 0.00 C ATOM 1374 C THR A 342 4.583 -3.519 -12.111 1.00 0.00 C ATOM 1375 O THR A 342 5.450 -2.651 -12.021 1.00 0.00 O ATOM 1376 CB THR A 342 4.296 -4.622 -14.332 1.00 0.00 C ATOM 1377 OG1 THR A 342 4.993 -3.559 -14.991 1.00 0.00 O ATOM 1378 CG2 THR A 342 2.805 -4.322 -14.313 1.00 0.00 C ATOM 0 H THR A 342 3.231 -5.866 -12.083 1.00 0.00 H new ATOM 0 HA THR A 342 5.910 -4.985 -12.945 1.00 0.00 H new ATOM 0 HB THR A 342 4.457 -5.553 -14.875 1.00 0.00 H new ATOM 0 HG1 THR A 342 4.645 -3.454 -15.901 1.00 0.00 H new ATOM 0 HG21 THR A 342 2.445 -4.202 -15.335 1.00 0.00 H new ATOM 0 HG22 THR A 342 2.274 -5.146 -13.836 1.00 0.00 H new ATOM 0 HG23 THR A 342 2.626 -3.403 -13.755 1.00 0.00 H new ATOM 1386 N GLY A 343 3.387 -3.409 -11.541 1.00 0.00 N ATOM 1387 CA GLY A 343 3.040 -2.232 -10.766 1.00 0.00 C ATOM 1388 C GLY A 343 2.082 -1.316 -11.501 1.00 0.00 C ATOM 1389 O GLY A 343 2.199 -0.093 -11.421 1.00 0.00 O ATOM 0 H GLY A 343 2.652 -4.114 -11.602 1.00 0.00 H new ATOM 0 HA2 GLY A 343 2.590 -2.542 -9.823 1.00 0.00 H new ATOM 0 HA3 GLY A 343 3.948 -1.681 -10.521 1.00 0.00 H new ATOM 1393 N GLU A 344 1.133 -1.907 -12.221 1.00 0.00 N ATOM 1394 CA GLU A 344 0.154 -1.134 -12.975 1.00 0.00 C ATOM 1395 C GLU A 344 -1.106 -0.897 -12.147 1.00 0.00 C ATOM 1396 O GLU A 344 -1.571 -1.787 -11.435 1.00 0.00 O ATOM 1397 CB GLU A 344 -0.206 -1.856 -14.276 1.00 0.00 C ATOM 1398 CG GLU A 344 -0.679 -0.924 -15.378 1.00 0.00 C ATOM 1399 CD GLU A 344 -1.944 -0.175 -15.006 1.00 0.00 C ATOM 1400 OE1 GLU A 344 -2.968 -0.838 -14.737 1.00 0.00 O ATOM 1401 OE2 GLU A 344 -1.912 1.073 -14.985 1.00 0.00 O ATOM 0 H GLU A 344 1.022 -2.918 -12.298 1.00 0.00 H new ATOM 0 HA GLU A 344 0.598 -0.168 -13.215 1.00 0.00 H new ATOM 0 HB2 GLU A 344 0.665 -2.409 -14.628 1.00 0.00 H new ATOM 0 HB3 GLU A 344 -0.987 -2.588 -14.071 1.00 0.00 H new ATOM 0 HG2 GLU A 344 0.110 -0.207 -15.606 1.00 0.00 H new ATOM 0 HG3 GLU A 344 -0.857 -1.501 -16.285 1.00 0.00 H new ATOM 1408 N ASP A 345 -1.652 0.310 -12.246 1.00 0.00 N ATOM 1409 CA ASP A 345 -2.858 0.666 -11.507 1.00 0.00 C ATOM 1410 C ASP A 345 -4.054 -0.147 -11.994 1.00 0.00 C ATOM 1411 O ASP A 345 -4.625 0.139 -13.047 1.00 0.00 O ATOM 1412 CB ASP A 345 -3.149 2.161 -11.653 1.00 0.00 C ATOM 1413 CG ASP A 345 -4.478 2.555 -11.040 1.00 0.00 C ATOM 1414 OD1 ASP A 345 -5.113 1.693 -10.397 1.00 0.00 O ATOM 1415 OD2 ASP A 345 -4.884 3.724 -11.203 1.00 0.00 O ATOM 0 H ASP A 345 -1.279 1.058 -12.830 1.00 0.00 H new ATOM 0 HA ASP A 345 -2.690 0.437 -10.455 1.00 0.00 H new ATOM 0 HB2 ASP A 345 -2.350 2.732 -11.179 1.00 0.00 H new ATOM 0 HB3 ASP A 345 -3.147 2.427 -12.710 1.00 0.00 H new