USER MOD reduce.3.24.130724 H: found=0, std=0, add=720, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 722 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 277 HIS :FLIP no HD1:sc= 0.369 F(o=-0.41,f=0.58) USER MOD Set 1.2: A 284 THR OG1 : rot -146:sc= 0.207 USER MOD Set 2.1: A 252 GLN :FLIP amide:sc= -1.23 F(o=-7.4!,f=-1.8) USER MOD Set 2.2: A 303 SER OG : rot -131:sc= -0.576 USER MOD Set 3.1: A 233 GLN : amide:sc= -2.14! C(o=-1.4!,f=-5.3!) USER MOD Set 3.2: A 329 SER OG : rot -66:sc= 0.767 USER MOD Single : A 227 SER OG : rot 180:sc= 0 USER MOD Single : A 229 THR OG1 : rot 180:sc= -1.09 USER MOD Single : A 231 SER OG : rot 180:sc= 0 USER MOD Single : A 236 HIS : no HD1:sc= -0.953 X(o=-0.95,f=-0.52) USER MOD Single : A 237 LYS NZ :NH3+ -112:sc= 1.27 (180deg=-0.399) USER MOD Single : A 254 THR OG1 : rot 38:sc= 0.368 USER MOD Single : A 256 THR OG1 : rot 180:sc= 0 USER MOD Single : A 258 SER OG : rot 180:sc= 0 USER MOD Single : A 260 SER OG : rot 180:sc= 0 USER MOD Single : A 263 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 269 THR OG1 : rot 180:sc= -1.04 USER MOD Single : A 274 ASN : amide:sc= -0.0541 X(o=-0.054,f=-0.52) USER MOD Single : A 275 SER OG : rot -63:sc= 0.924 USER MOD Single : A 278 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 280 THR OG1 : rot 180:sc= 0 USER MOD Single : A 281 LYS NZ :NH3+ 142:sc= -2.36 (180deg=-4.59!) USER MOD Single : A 283 THR OG1 : rot 33:sc= 0.206 USER MOD Single : A 286 GLN : amide:sc= -0.0836 X(o=-0.084,f=-0.12) USER MOD Single : A 288 GLN : amide:sc= -0.299 K(o=-0.3,f=-1.9) USER MOD Single : A 296 SER OG : rot 51:sc= 0.477 USER MOD Single : A 298 THR OG1 : rot 13:sc= 1.05 USER MOD Single : A 299 THR OG1 : rot 65:sc= 0.0803 USER MOD Single : A 301 THR OG1 : rot 180:sc= -0.696 USER MOD Single : A 305 LYS NZ :NH3+ -168:sc= -0.0265 (180deg=-0.224) USER MOD Single : A 311 ASN : amide:sc= -1.56! C(o=-1.6!,f=-8.1!) USER MOD Single : A 312 THR OG1 : rot 180:sc= 0 USER MOD Single : A 316 SER OG : rot 60:sc= 0.427 USER MOD Single : A 319 TYR OH : rot 180:sc= 0 USER MOD Single : A 321 ASN : amide:sc= 0.0995 X(o=0.099,f=-0.0057) USER MOD Single : A 325 LYS NZ :NH3+ 156:sc= 0.322 (180deg=-0.723!) USER MOD Single : A 333 THR OG1 : rot 180:sc= 0 USER MOD Single : A 336 ASN : amide:sc= 0 X(o=0,f=0.0056) USER MOD Single : A 337 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 48 N SER A 227 16.499 -5.779 3.959 1.00 0.00 N ATOM 49 CA SER A 227 17.327 -5.120 4.960 1.00 0.00 C ATOM 50 C SER A 227 16.791 -3.727 5.265 1.00 0.00 C ATOM 51 O SER A 227 16.901 -3.234 6.389 1.00 0.00 O ATOM 52 CB SER A 227 18.775 -5.039 4.463 1.00 0.00 C ATOM 53 OG SER A 227 19.629 -4.435 5.422 1.00 0.00 O ATOM 0 HA SER A 227 17.299 -5.704 5.880 1.00 0.00 H new ATOM 0 HB2 SER A 227 19.137 -6.041 4.234 1.00 0.00 H new ATOM 0 HB3 SER A 227 18.809 -4.468 3.535 1.00 0.00 H new ATOM 0 HG SER A 227 20.543 -4.402 5.071 1.00 0.00 H new ATOM 59 N LEU A 228 16.183 -3.107 4.264 1.00 0.00 N ATOM 60 CA LEU A 228 15.601 -1.787 4.431 1.00 0.00 C ATOM 61 C LEU A 228 14.220 -1.906 5.056 1.00 0.00 C ATOM 62 O LEU A 228 13.458 -2.807 4.707 1.00 0.00 O ATOM 63 CB LEU A 228 15.502 -1.087 3.078 1.00 0.00 C ATOM 64 CG LEU A 228 16.829 -0.916 2.336 1.00 0.00 C ATOM 65 CD1 LEU A 228 16.613 -0.190 1.019 1.00 0.00 C ATOM 66 CD2 LEU A 228 17.838 -0.170 3.196 1.00 0.00 C ATOM 0 H LEU A 228 16.081 -3.499 3.328 1.00 0.00 H new ATOM 0 HA LEU A 228 16.239 -1.197 5.089 1.00 0.00 H new ATOM 0 HB2 LEU A 228 14.819 -1.652 2.443 1.00 0.00 H new ATOM 0 HB3 LEU A 228 15.058 -0.103 3.227 1.00 0.00 H new ATOM 0 HG LEU A 228 17.230 -1.907 2.124 1.00 0.00 H new ATOM 0 HD11 LEU A 228 17.567 -0.077 0.505 1.00 0.00 H new ATOM 0 HD12 LEU A 228 15.930 -0.765 0.394 1.00 0.00 H new ATOM 0 HD13 LEU A 228 16.186 0.794 1.212 1.00 0.00 H new ATOM 0 HD21 LEU A 228 18.773 -0.061 2.647 1.00 0.00 H new ATOM 0 HD22 LEU A 228 17.446 0.816 3.445 1.00 0.00 H new ATOM 0 HD23 LEU A 228 18.019 -0.730 4.113 1.00 0.00 H new ATOM 78 N THR A 229 13.895 -1.021 5.987 1.00 0.00 N ATOM 79 CA THR A 229 12.594 -1.092 6.641 1.00 0.00 C ATOM 80 C THR A 229 11.870 0.245 6.549 1.00 0.00 C ATOM 81 O THR A 229 12.393 1.198 5.978 1.00 0.00 O ATOM 82 CB THR A 229 12.753 -1.539 8.099 1.00 0.00 C ATOM 83 OG1 THR A 229 13.580 -0.643 8.820 1.00 0.00 O ATOM 84 CG2 THR A 229 13.357 -2.920 8.240 1.00 0.00 C ATOM 0 H THR A 229 14.498 -0.261 6.302 1.00 0.00 H new ATOM 0 HA THR A 229 11.985 -1.834 6.124 1.00 0.00 H new ATOM 0 HB THR A 229 11.740 -1.553 8.501 1.00 0.00 H new ATOM 0 HG1 THR A 229 13.664 -0.949 9.747 1.00 0.00 H new ATOM 0 HG21 THR A 229 13.441 -3.174 9.297 1.00 0.00 H new ATOM 0 HG22 THR A 229 12.718 -3.649 7.741 1.00 0.00 H new ATOM 0 HG23 THR A 229 14.347 -2.933 7.784 1.00 0.00 H new ATOM 92 N VAL A 230 10.653 0.308 7.076 1.00 0.00 N ATOM 93 CA VAL A 230 9.854 1.528 7.019 1.00 0.00 C ATOM 94 C VAL A 230 9.047 1.696 8.307 1.00 0.00 C ATOM 95 O VAL A 230 8.654 0.705 8.939 1.00 0.00 O ATOM 96 CB VAL A 230 8.898 1.528 5.795 1.00 0.00 C ATOM 97 CG1 VAL A 230 8.048 2.789 5.750 1.00 0.00 C ATOM 98 CG2 VAL A 230 9.666 1.401 4.499 1.00 0.00 C ATOM 0 H VAL A 230 10.197 -0.472 7.549 1.00 0.00 H new ATOM 0 HA VAL A 230 10.542 2.366 6.911 1.00 0.00 H new ATOM 0 HB VAL A 230 8.243 0.664 5.909 1.00 0.00 H new ATOM 0 HG11 VAL A 230 7.391 2.754 4.881 1.00 0.00 H new ATOM 0 HG12 VAL A 230 7.447 2.855 6.657 1.00 0.00 H new ATOM 0 HG13 VAL A 230 8.696 3.662 5.680 1.00 0.00 H new ATOM 0 HG21 VAL A 230 8.969 1.404 3.661 1.00 0.00 H new ATOM 0 HG22 VAL A 230 10.355 2.240 4.401 1.00 0.00 H new ATOM 0 HG23 VAL A 230 10.229 0.467 4.499 1.00 0.00 H new ATOM 108 N SER A 231 8.783 2.945 8.676 1.00 0.00 N ATOM 109 CA SER A 231 8.001 3.245 9.861 1.00 0.00 C ATOM 110 C SER A 231 6.831 4.164 9.506 1.00 0.00 C ATOM 111 O SER A 231 7.019 5.219 8.893 1.00 0.00 O ATOM 112 CB SER A 231 8.894 3.901 10.920 1.00 0.00 C ATOM 113 OG SER A 231 8.188 4.134 12.130 1.00 0.00 O ATOM 0 H SER A 231 9.103 3.768 8.165 1.00 0.00 H new ATOM 0 HA SER A 231 7.598 2.316 10.265 1.00 0.00 H new ATOM 0 HB2 SER A 231 9.754 3.261 11.118 1.00 0.00 H new ATOM 0 HB3 SER A 231 9.280 4.845 10.536 1.00 0.00 H new ATOM 0 HG SER A 231 8.787 4.551 12.783 1.00 0.00 H new ATOM 119 N GLY A 232 5.630 3.782 9.922 1.00 0.00 N ATOM 120 CA GLY A 232 4.460 4.605 9.668 1.00 0.00 C ATOM 121 C GLY A 232 3.516 3.989 8.657 1.00 0.00 C ATOM 122 O GLY A 232 3.823 3.928 7.470 1.00 0.00 O ATOM 0 H GLY A 232 5.444 2.918 10.431 1.00 0.00 H new ATOM 0 HA2 GLY A 232 3.926 4.768 10.604 1.00 0.00 H new ATOM 0 HA3 GLY A 232 4.781 5.583 9.310 1.00 0.00 H new ATOM 126 N GLN A 233 2.357 3.548 9.122 1.00 0.00 N ATOM 127 CA GLN A 233 1.357 2.955 8.241 1.00 0.00 C ATOM 128 C GLN A 233 0.134 3.851 8.118 1.00 0.00 C ATOM 129 O GLN A 233 -0.745 3.825 8.979 1.00 0.00 O ATOM 130 CB GLN A 233 0.930 1.587 8.778 1.00 0.00 C ATOM 131 CG GLN A 233 2.038 0.549 8.782 1.00 0.00 C ATOM 132 CD GLN A 233 2.445 0.117 7.389 1.00 0.00 C ATOM 133 OE1 GLN A 233 2.867 0.928 6.565 1.00 0.00 O ATOM 134 NE2 GLN A 233 2.324 -1.174 7.119 1.00 0.00 N ATOM 0 H GLN A 233 2.084 3.589 10.104 1.00 0.00 H new ATOM 0 HA GLN A 233 1.806 2.840 7.254 1.00 0.00 H new ATOM 0 HB2 GLN A 233 0.557 1.708 9.795 1.00 0.00 H new ATOM 0 HB3 GLN A 233 0.101 1.215 8.176 1.00 0.00 H new ATOM 0 HG2 GLN A 233 2.907 0.955 9.300 1.00 0.00 H new ATOM 0 HG3 GLN A 233 1.709 -0.324 9.346 1.00 0.00 H new ATOM 0 HE21 GLN A 233 1.970 -1.813 7.831 1.00 0.00 H new ATOM 0 HE22 GLN A 233 2.585 -1.529 6.199 1.00 0.00 H new ATOM 143 N PRO A 234 0.017 4.600 7.011 1.00 0.00 N ATOM 144 CA PRO A 234 -1.154 5.432 6.754 1.00 0.00 C ATOM 145 C PRO A 234 -2.370 4.574 6.444 1.00 0.00 C ATOM 146 O PRO A 234 -2.317 3.702 5.572 1.00 0.00 O ATOM 147 CB PRO A 234 -0.758 6.264 5.523 1.00 0.00 C ATOM 148 CG PRO A 234 0.694 5.988 5.291 1.00 0.00 C ATOM 149 CD PRO A 234 0.967 4.641 5.897 1.00 0.00 C ATOM 0 HA PRO A 234 -1.424 6.047 7.613 1.00 0.00 H new ATOM 0 HB2 PRO A 234 -1.353 5.983 4.654 1.00 0.00 H new ATOM 0 HB3 PRO A 234 -0.931 7.326 5.697 1.00 0.00 H new ATOM 0 HG2 PRO A 234 0.925 5.990 4.226 1.00 0.00 H new ATOM 0 HG3 PRO A 234 1.315 6.756 5.753 1.00 0.00 H new ATOM 0 HD2 PRO A 234 0.795 3.833 5.186 1.00 0.00 H new ATOM 0 HD3 PRO A 234 1.998 4.550 6.239 1.00 0.00 H new ATOM 157 N GLU A 235 -3.452 4.789 7.173 1.00 0.00 N ATOM 158 CA GLU A 235 -4.647 3.987 6.988 1.00 0.00 C ATOM 159 C GLU A 235 -5.653 4.686 6.091 1.00 0.00 C ATOM 160 O GLU A 235 -6.074 5.814 6.349 1.00 0.00 O ATOM 161 CB GLU A 235 -5.262 3.616 8.339 1.00 0.00 C ATOM 162 CG GLU A 235 -5.516 4.795 9.259 1.00 0.00 C ATOM 163 CD GLU A 235 -6.108 4.367 10.574 1.00 0.00 C ATOM 164 OE1 GLU A 235 -7.227 3.816 10.569 1.00 0.00 O ATOM 165 OE2 GLU A 235 -5.447 4.562 11.610 1.00 0.00 O1- ATOM 0 H GLU A 235 -3.527 5.507 7.893 1.00 0.00 H new ATOM 0 HA GLU A 235 -4.358 3.064 6.485 1.00 0.00 H new ATOM 0 HB2 GLU A 235 -6.205 3.098 8.165 1.00 0.00 H new ATOM 0 HB3 GLU A 235 -4.600 2.913 8.844 1.00 0.00 H new ATOM 0 HG2 GLU A 235 -4.580 5.323 9.438 1.00 0.00 H new ATOM 0 HG3 GLU A 235 -6.190 5.498 8.770 1.00 0.00 H new ATOM 172 N HIS A 236 -6.040 3.996 5.033 1.00 0.00 N ATOM 173 CA HIS A 236 -6.998 4.527 4.089 1.00 0.00 C ATOM 174 C HIS A 236 -8.196 3.608 3.976 1.00 0.00 C ATOM 175 O HIS A 236 -8.079 2.390 4.121 1.00 0.00 O ATOM 176 CB HIS A 236 -6.377 4.737 2.703 1.00 0.00 C ATOM 177 CG HIS A 236 -5.301 5.783 2.654 1.00 0.00 C ATOM 178 ND1 HIS A 236 -4.125 5.705 3.372 1.00 0.00 N ATOM 179 CD2 HIS A 236 -5.241 6.950 1.967 1.00 0.00 C ATOM 180 CE1 HIS A 236 -3.391 6.778 3.127 1.00 0.00 C ATOM 181 NE2 HIS A 236 -4.046 7.550 2.277 1.00 0.00 N ATOM 0 H HIS A 236 -5.701 3.061 4.808 1.00 0.00 H new ATOM 0 HA HIS A 236 -7.318 5.498 4.467 1.00 0.00 H new ATOM 0 HB2 HIS A 236 -5.962 3.790 2.358 1.00 0.00 H new ATOM 0 HB3 HIS A 236 -7.166 5.013 2.003 1.00 0.00 H new ATOM 0 HD2 HIS A 236 -5.995 7.337 1.298 1.00 0.00 H new ATOM 0 HE1 HIS A 236 -2.420 6.988 3.550 1.00 0.00 H new ATOM 0 HE2 HIS A 236 -3.718 8.444 1.912 1.00 0.00 H new ATOM 190 N LYS A 237 -9.342 4.210 3.735 1.00 0.00 N ATOM 191 CA LYS A 237 -10.593 3.481 3.620 1.00 0.00 C ATOM 192 C LYS A 237 -11.477 4.163 2.585 1.00 0.00 C ATOM 193 O LYS A 237 -11.225 5.311 2.223 1.00 0.00 O ATOM 194 CB LYS A 237 -11.307 3.390 4.984 1.00 0.00 C ATOM 195 CG LYS A 237 -11.801 4.719 5.568 1.00 0.00 C ATOM 196 CD LYS A 237 -10.687 5.724 5.861 1.00 0.00 C ATOM 197 CE LYS A 237 -9.649 5.187 6.840 1.00 0.00 C ATOM 198 NZ LYS A 237 -8.656 6.233 7.218 1.00 0.00 N1+ ATOM 0 H LYS A 237 -9.435 5.218 3.613 1.00 0.00 H new ATOM 0 HA LYS A 237 -10.384 2.462 3.295 1.00 0.00 H new ATOM 0 HB2 LYS A 237 -12.161 2.720 4.882 1.00 0.00 H new ATOM 0 HB3 LYS A 237 -10.625 2.931 5.700 1.00 0.00 H new ATOM 0 HG2 LYS A 237 -12.508 5.169 4.871 1.00 0.00 H new ATOM 0 HG3 LYS A 237 -12.346 4.518 6.490 1.00 0.00 H new ATOM 0 HD2 LYS A 237 -10.193 5.995 4.928 1.00 0.00 H new ATOM 0 HD3 LYS A 237 -11.124 6.636 6.267 1.00 0.00 H new ATOM 0 HE2 LYS A 237 -10.149 4.819 7.736 1.00 0.00 H new ATOM 0 HE3 LYS A 237 -9.131 4.338 6.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 237 -7.725 5.986 6.826 1.00 0.00 H new ATOM 0 HZ2 LYS A 237 -8.959 7.152 6.838 1.00 0.00 H new ATOM 0 HZ3 LYS A 237 -8.591 6.292 8.254 1.00 0.00 H new ATOM 416 N GLN A 252 -2.624 8.316 -2.090 1.00 0.00 N ATOM 417 CA GLN A 252 -1.491 7.462 -1.788 1.00 0.00 C ATOM 418 C GLN A 252 -0.952 7.761 -0.395 1.00 0.00 C ATOM 419 O GLN A 252 -1.427 8.679 0.276 1.00 0.00 O ATOM 420 CB GLN A 252 -0.408 7.648 -2.853 1.00 0.00 C ATOM 421 CG GLN A 252 -0.933 7.484 -4.277 1.00 0.00 C ATOM 422 CD GLN A 252 -1.534 6.113 -4.553 1.00 0.00 C ATOM 423 OE1 GLN A 252 -1.366 5.183 -3.625 1.00 0.00 O flip ATOM 424 NE2 GLN A 252 -2.114 5.883 -5.615 1.00 0.00 N flip ATOM 0 HA GLN A 252 -1.813 6.421 -1.800 1.00 0.00 H new ATOM 0 HB2 GLN A 252 0.031 8.640 -2.746 1.00 0.00 H new ATOM 0 HB3 GLN A 252 0.390 6.926 -2.681 1.00 0.00 H new ATOM 0 HG2 GLN A 252 -1.688 8.247 -4.467 1.00 0.00 H new ATOM 0 HG3 GLN A 252 -0.118 7.661 -4.978 1.00 0.00 H new ATOM 0 HE21 GLN A 252 -2.225 6.624 -6.307 1.00 0.00 H new ATOM 0 HE22 GLN A 252 -2.484 4.951 -5.803 1.00 0.00 H new ATOM 433 N GLY A 253 -0.017 6.944 0.070 1.00 0.00 N ATOM 434 CA GLY A 253 0.489 7.108 1.417 1.00 0.00 C ATOM 435 C GLY A 253 1.880 7.696 1.456 1.00 0.00 C ATOM 436 O GLY A 253 2.756 7.289 0.694 1.00 0.00 O ATOM 0 H GLY A 253 0.398 6.176 -0.458 1.00 0.00 H new ATOM 0 HA2 GLY A 253 -0.188 7.752 1.978 1.00 0.00 H new ATOM 0 HA3 GLY A 253 0.495 6.140 1.918 1.00 0.00 H new ATOM 440 N THR A 254 2.100 8.611 2.389 1.00 0.00 N ATOM 441 CA THR A 254 3.411 9.206 2.587 1.00 0.00 C ATOM 442 C THR A 254 3.993 8.737 3.916 1.00 0.00 C ATOM 443 O THR A 254 3.386 8.940 4.970 1.00 0.00 O ATOM 444 CB THR A 254 3.309 10.733 2.559 1.00 0.00 C ATOM 445 OG1 THR A 254 2.415 11.196 3.558 1.00 0.00 O ATOM 446 CG2 THR A 254 2.826 11.280 1.234 1.00 0.00 C ATOM 0 H THR A 254 1.381 8.958 3.024 1.00 0.00 H new ATOM 0 HA THR A 254 4.072 8.890 1.780 1.00 0.00 H new ATOM 0 HB THR A 254 4.324 11.089 2.735 1.00 0.00 H new ATOM 0 HG1 THR A 254 2.511 10.646 4.363 1.00 0.00 H new ATOM 0 HG21 THR A 254 2.778 12.368 1.285 1.00 0.00 H new ATOM 0 HG22 THR A 254 3.517 10.984 0.445 1.00 0.00 H new ATOM 0 HG23 THR A 254 1.835 10.883 1.016 1.00 0.00 H new ATOM 454 N ILE A 255 5.119 8.041 3.865 1.00 0.00 N ATOM 455 CA ILE A 255 5.708 7.476 5.073 1.00 0.00 C ATOM 456 C ILE A 255 7.139 7.967 5.273 1.00 0.00 C ATOM 457 O ILE A 255 7.808 8.368 4.316 1.00 0.00 O ATOM 458 CB ILE A 255 5.713 5.923 5.061 1.00 0.00 C ATOM 459 CG1 ILE A 255 6.638 5.343 3.976 1.00 0.00 C ATOM 460 CG2 ILE A 255 4.301 5.402 4.854 1.00 0.00 C ATOM 461 CD1 ILE A 255 6.156 5.544 2.557 1.00 0.00 C ATOM 0 H ILE A 255 5.641 7.854 3.009 1.00 0.00 H new ATOM 0 HA ILE A 255 5.081 7.816 5.897 1.00 0.00 H new ATOM 0 HB ILE A 255 6.098 5.598 6.028 1.00 0.00 H new ATOM 0 HG12 ILE A 255 7.623 5.798 4.078 1.00 0.00 H new ATOM 0 HG13 ILE A 255 6.760 4.275 4.155 1.00 0.00 H new ATOM 0 HG21 ILE A 255 4.313 4.312 4.847 1.00 0.00 H new ATOM 0 HG22 ILE A 255 3.661 5.753 5.664 1.00 0.00 H new ATOM 0 HG23 ILE A 255 3.914 5.767 3.902 1.00 0.00 H new ATOM 0 HD11 ILE A 255 6.872 5.103 1.864 1.00 0.00 H new ATOM 0 HD12 ILE A 255 5.185 5.064 2.431 1.00 0.00 H new ATOM 0 HD13 ILE A 255 6.063 6.610 2.352 1.00 0.00 H new ATOM 473 N THR A 256 7.646 7.789 6.485 1.00 0.00 N ATOM 474 CA THR A 256 9.046 8.057 6.771 1.00 0.00 C ATOM 475 C THR A 256 9.795 6.733 6.794 1.00 0.00 C ATOM 476 O THR A 256 9.451 5.832 7.561 1.00 0.00 O ATOM 477 CB THR A 256 9.198 8.789 8.110 1.00 0.00 C ATOM 478 OG1 THR A 256 8.475 10.013 8.101 1.00 0.00 O ATOM 479 CG2 THR A 256 10.636 9.115 8.458 1.00 0.00 C ATOM 0 H THR A 256 7.107 7.460 7.286 1.00 0.00 H new ATOM 0 HA THR A 256 9.462 8.703 5.997 1.00 0.00 H new ATOM 0 HB THR A 256 8.805 8.100 8.858 1.00 0.00 H new ATOM 0 HG1 THR A 256 8.584 10.463 8.965 1.00 0.00 H new ATOM 0 HG21 THR A 256 10.670 9.632 9.417 1.00 0.00 H new ATOM 0 HG22 THR A 256 11.213 8.192 8.522 1.00 0.00 H new ATOM 0 HG23 THR A 256 11.061 9.755 7.685 1.00 0.00 H new ATOM 487 N VAL A 257 10.671 6.536 5.827 1.00 0.00 N ATOM 488 CA VAL A 257 11.263 5.233 5.640 1.00 0.00 C ATOM 489 C VAL A 257 12.547 5.052 6.438 1.00 0.00 C ATOM 490 O VAL A 257 13.405 5.937 6.494 1.00 0.00 O ATOM 491 CB VAL A 257 11.535 4.945 4.145 1.00 0.00 C ATOM 492 CG1 VAL A 257 10.234 4.945 3.359 1.00 0.00 C ATOM 493 CG2 VAL A 257 12.504 5.960 3.558 1.00 0.00 C ATOM 0 H VAL A 257 10.982 7.252 5.170 1.00 0.00 H new ATOM 0 HA VAL A 257 10.533 4.516 6.015 1.00 0.00 H new ATOM 0 HB VAL A 257 11.992 3.958 4.071 1.00 0.00 H new ATOM 0 HG11 VAL A 257 10.443 4.741 2.309 1.00 0.00 H new ATOM 0 HG12 VAL A 257 9.571 4.175 3.753 1.00 0.00 H new ATOM 0 HG13 VAL A 257 9.754 5.919 3.450 1.00 0.00 H new ATOM 0 HG21 VAL A 257 12.676 5.732 2.506 1.00 0.00 H new ATOM 0 HG22 VAL A 257 12.082 6.961 3.648 1.00 0.00 H new ATOM 0 HG23 VAL A 257 13.449 5.915 4.099 1.00 0.00 H new ATOM 503 N SER A 258 12.732 3.830 6.903 1.00 0.00 N ATOM 504 CA SER A 258 13.971 3.405 7.526 1.00 0.00 C ATOM 505 C SER A 258 14.891 2.841 6.447 1.00 0.00 C ATOM 506 O SER A 258 15.915 2.221 6.730 1.00 0.00 O ATOM 507 CB SER A 258 13.697 2.366 8.609 1.00 0.00 C ATOM 508 OG SER A 258 12.763 2.859 9.559 1.00 0.00 O ATOM 0 H SER A 258 12.021 3.100 6.858 1.00 0.00 H new ATOM 0 HA SER A 258 14.455 4.256 8.005 1.00 0.00 H new ATOM 0 HB2 SER A 258 13.312 1.453 8.154 1.00 0.00 H new ATOM 0 HB3 SER A 258 14.628 2.104 9.111 1.00 0.00 H new ATOM 0 HG SER A 258 12.601 2.176 10.243 1.00 0.00 H new ATOM 514 N ALA A 259 14.456 3.002 5.200 1.00 0.00 N ATOM 515 CA ALA A 259 15.170 2.485 4.049 1.00 0.00 C ATOM 516 C ALA A 259 16.045 3.571 3.444 1.00 0.00 C ATOM 517 O ALA A 259 15.822 4.761 3.676 1.00 0.00 O ATOM 518 CB ALA A 259 14.191 1.967 3.009 1.00 0.00 C ATOM 0 H ALA A 259 13.596 3.497 4.965 1.00 0.00 H new ATOM 0 HA ALA A 259 15.804 1.660 4.375 1.00 0.00 H new ATOM 0 HB1 ALA A 259 14.742 1.582 2.151 1.00 0.00 H new ATOM 0 HB2 ALA A 259 13.589 1.168 3.442 1.00 0.00 H new ATOM 0 HB3 ALA A 259 13.539 2.779 2.687 1.00 0.00 H new ATOM 524 N SER A 260 17.042 3.165 2.681 1.00 0.00 N ATOM 525 CA SER A 260 17.955 4.113 2.065 1.00 0.00 C ATOM 526 C SER A 260 18.078 3.871 0.565 1.00 0.00 C ATOM 527 O SER A 260 17.894 2.749 0.090 1.00 0.00 O ATOM 528 CB SER A 260 19.325 4.028 2.739 1.00 0.00 C ATOM 529 OG SER A 260 19.821 2.698 2.733 1.00 0.00 O ATOM 0 H SER A 260 17.241 2.187 2.472 1.00 0.00 H new ATOM 0 HA SER A 260 17.552 5.116 2.203 1.00 0.00 H new ATOM 0 HB2 SER A 260 20.028 4.683 2.223 1.00 0.00 H new ATOM 0 HB3 SER A 260 19.250 4.386 3.766 1.00 0.00 H new ATOM 0 HG SER A 260 20.699 2.674 3.169 1.00 0.00 H new ATOM 535 N GLY A 261 18.419 4.924 -0.168 1.00 0.00 N ATOM 536 CA GLY A 261 18.607 4.810 -1.602 1.00 0.00 C ATOM 537 C GLY A 261 17.307 4.670 -2.370 1.00 0.00 C ATOM 538 O GLY A 261 17.308 4.209 -3.512 1.00 0.00 O ATOM 0 H GLY A 261 18.569 5.860 0.208 1.00 0.00 H new ATOM 0 HA2 GLY A 261 19.140 5.690 -1.962 1.00 0.00 H new ATOM 0 HA3 GLY A 261 19.239 3.947 -1.811 1.00 0.00 H new ATOM 542 N LEU A 262 16.197 5.072 -1.760 1.00 0.00 N ATOM 543 CA LEU A 262 14.904 4.987 -2.430 1.00 0.00 C ATOM 544 C LEU A 262 14.740 6.125 -3.421 1.00 0.00 C ATOM 545 O LEU A 262 15.176 7.250 -3.168 1.00 0.00 O ATOM 546 CB LEU A 262 13.752 5.007 -1.424 1.00 0.00 C ATOM 547 CG LEU A 262 13.755 3.865 -0.406 1.00 0.00 C ATOM 548 CD1 LEU A 262 12.534 3.952 0.490 1.00 0.00 C ATOM 549 CD2 LEU A 262 13.801 2.519 -1.107 1.00 0.00 C ATOM 0 H LEU A 262 16.165 5.455 -0.815 1.00 0.00 H new ATOM 0 HA LEU A 262 14.875 4.038 -2.966 1.00 0.00 H new ATOM 0 HB2 LEU A 262 13.779 5.953 -0.884 1.00 0.00 H new ATOM 0 HB3 LEU A 262 12.811 4.980 -1.973 1.00 0.00 H new ATOM 0 HG LEU A 262 14.648 3.960 0.211 1.00 0.00 H new ATOM 0 HD11 LEU A 262 12.551 3.133 1.209 1.00 0.00 H new ATOM 0 HD12 LEU A 262 12.541 4.903 1.023 1.00 0.00 H new ATOM 0 HD13 LEU A 262 11.631 3.883 -0.117 1.00 0.00 H new ATOM 0 HD21 LEU A 262 13.802 1.722 -0.364 1.00 0.00 H new ATOM 0 HD22 LEU A 262 12.927 2.414 -1.750 1.00 0.00 H new ATOM 0 HD23 LEU A 262 14.706 2.454 -1.711 1.00 0.00 H new ATOM 561 N GLN A 263 14.112 5.827 -4.547 1.00 0.00 N ATOM 562 CA GLN A 263 13.884 6.814 -5.589 1.00 0.00 C ATOM 563 C GLN A 263 12.509 6.611 -6.200 1.00 0.00 C ATOM 564 O GLN A 263 11.837 5.621 -5.913 1.00 0.00 O ATOM 565 CB GLN A 263 14.949 6.699 -6.684 1.00 0.00 C ATOM 566 CG GLN A 263 16.376 6.869 -6.189 1.00 0.00 C ATOM 567 CD GLN A 263 17.387 6.737 -7.306 1.00 0.00 C ATOM 568 OE1 GLN A 263 17.455 5.705 -7.973 1.00 0.00 O ATOM 569 NE2 GLN A 263 18.180 7.776 -7.513 1.00 0.00 N ATOM 0 H GLN A 263 13.748 4.899 -4.763 1.00 0.00 H new ATOM 0 HA GLN A 263 13.944 7.806 -5.142 1.00 0.00 H new ATOM 0 HB2 GLN A 263 14.857 5.724 -7.163 1.00 0.00 H new ATOM 0 HB3 GLN A 263 14.750 7.450 -7.448 1.00 0.00 H new ATOM 0 HG2 GLN A 263 16.482 7.847 -5.719 1.00 0.00 H new ATOM 0 HG3 GLN A 263 16.584 6.123 -5.422 1.00 0.00 H new ATOM 0 HE21 GLN A 263 18.088 8.611 -6.935 1.00 0.00 H new ATOM 0 HE22 GLN A 263 18.884 7.742 -8.251 1.00 0.00 H new ATOM 578 N VAL A 264 12.120 7.509 -7.086 1.00 0.00 N ATOM 579 CA VAL A 264 10.856 7.370 -7.792 1.00 0.00 C ATOM 580 C VAL A 264 10.997 6.359 -8.925 1.00 0.00 C ATOM 581 O VAL A 264 11.948 6.422 -9.705 1.00 0.00 O ATOM 582 CB VAL A 264 10.379 8.714 -8.368 1.00 0.00 C ATOM 583 CG1 VAL A 264 9.013 8.567 -9.017 1.00 0.00 C ATOM 584 CG2 VAL A 264 10.348 9.776 -7.284 1.00 0.00 C ATOM 0 H VAL A 264 12.657 8.340 -7.335 1.00 0.00 H new ATOM 0 HA VAL A 264 10.115 7.021 -7.073 1.00 0.00 H new ATOM 0 HB VAL A 264 11.086 9.028 -9.136 1.00 0.00 H new ATOM 0 HG11 VAL A 264 8.695 9.530 -9.418 1.00 0.00 H new ATOM 0 HG12 VAL A 264 9.071 7.839 -9.826 1.00 0.00 H new ATOM 0 HG13 VAL A 264 8.292 8.227 -8.274 1.00 0.00 H new ATOM 0 HG21 VAL A 264 10.008 10.720 -7.709 1.00 0.00 H new ATOM 0 HG22 VAL A 264 9.665 9.468 -6.492 1.00 0.00 H new ATOM 0 HG23 VAL A 264 11.349 9.903 -6.871 1.00 0.00 H new ATOM 594 N GLY A 265 10.048 5.442 -9.025 1.00 0.00 N ATOM 595 CA GLY A 265 10.092 4.454 -10.085 1.00 0.00 C ATOM 596 C GLY A 265 10.564 3.099 -9.599 1.00 0.00 C ATOM 597 O GLY A 265 10.687 2.160 -10.389 1.00 0.00 O ATOM 0 H GLY A 265 9.250 5.363 -8.394 1.00 0.00 H new ATOM 0 HA2 GLY A 265 9.099 4.353 -10.524 1.00 0.00 H new ATOM 0 HA3 GLY A 265 10.756 4.804 -10.875 1.00 0.00 H new ATOM 601 N ASP A 266 10.777 2.979 -8.295 1.00 0.00 N ATOM 602 CA ASP A 266 11.174 1.708 -7.702 1.00 0.00 C ATOM 603 C ASP A 266 9.946 0.871 -7.385 1.00 0.00 C ATOM 604 O ASP A 266 8.864 1.406 -7.129 1.00 0.00 O ATOM 605 CB ASP A 266 12.008 1.924 -6.430 1.00 0.00 C ATOM 606 CG ASP A 266 13.366 2.535 -6.714 1.00 0.00 C ATOM 607 OD1 ASP A 266 13.422 3.641 -7.281 1.00 0.00 O ATOM 608 OD2 ASP A 266 14.384 1.905 -6.368 1.00 0.00 O1- ATOM 0 H ASP A 266 10.682 3.745 -7.628 1.00 0.00 H new ATOM 0 HA ASP A 266 11.792 1.177 -8.426 1.00 0.00 H new ATOM 0 HB2 ASP A 266 11.459 2.572 -5.747 1.00 0.00 H new ATOM 0 HB3 ASP A 266 12.143 0.968 -5.923 1.00 0.00 H new ATOM 613 N ALA A 267 10.125 -0.439 -7.361 1.00 0.00 N ATOM 614 CA ALA A 267 9.049 -1.352 -7.030 1.00 0.00 C ATOM 615 C ALA A 267 9.480 -2.244 -5.885 1.00 0.00 C ATOM 616 O ALA A 267 10.654 -2.601 -5.787 1.00 0.00 O ATOM 617 CB ALA A 267 8.658 -2.185 -8.242 1.00 0.00 C ATOM 0 H ALA A 267 11.013 -0.895 -7.569 1.00 0.00 H new ATOM 0 HA ALA A 267 8.175 -0.777 -6.725 1.00 0.00 H new ATOM 0 HB1 ALA A 267 7.849 -2.863 -7.972 1.00 0.00 H new ATOM 0 HB2 ALA A 267 8.326 -1.526 -9.045 1.00 0.00 H new ATOM 0 HB3 ALA A 267 9.518 -2.763 -8.579 1.00 0.00 H new ATOM 623 N PHE A 268 8.568 -2.557 -4.979 1.00 0.00 N ATOM 624 CA PHE A 268 8.934 -3.352 -3.824 1.00 0.00 C ATOM 625 C PHE A 268 7.722 -3.998 -3.186 1.00 0.00 C ATOM 626 O PHE A 268 6.587 -3.628 -3.477 1.00 0.00 O ATOM 627 CB PHE A 268 9.689 -2.486 -2.808 1.00 0.00 C ATOM 628 CG PHE A 268 8.945 -1.274 -2.327 1.00 0.00 C ATOM 629 CD1 PHE A 268 7.774 -1.395 -1.600 1.00 0.00 C ATOM 630 CD2 PHE A 268 9.434 -0.007 -2.596 1.00 0.00 C ATOM 631 CE1 PHE A 268 7.107 -0.281 -1.149 1.00 0.00 C ATOM 632 CE2 PHE A 268 8.768 1.112 -2.149 1.00 0.00 C ATOM 633 CZ PHE A 268 7.604 0.972 -1.424 1.00 0.00 C ATOM 0 H PHE A 268 7.588 -2.278 -5.020 1.00 0.00 H new ATOM 0 HA PHE A 268 9.590 -4.155 -4.159 1.00 0.00 H new ATOM 0 HB2 PHE A 268 9.943 -3.103 -1.946 1.00 0.00 H new ATOM 0 HB3 PHE A 268 10.628 -2.162 -3.257 1.00 0.00 H new ATOM 0 HD1 PHE A 268 7.379 -2.377 -1.384 1.00 0.00 H new ATOM 0 HD2 PHE A 268 10.347 0.105 -3.162 1.00 0.00 H new ATOM 0 HE1 PHE A 268 6.195 -0.389 -0.580 1.00 0.00 H new ATOM 0 HE2 PHE A 268 9.156 2.096 -2.366 1.00 0.00 H new ATOM 0 HZ PHE A 268 7.081 1.848 -1.071 1.00 0.00 H new ATOM 643 N THR A 269 7.973 -4.903 -2.260 1.00 0.00 N ATOM 644 CA THR A 269 6.907 -5.533 -1.509 1.00 0.00 C ATOM 645 C THR A 269 7.077 -5.224 -0.026 1.00 0.00 C ATOM 646 O THR A 269 8.201 -5.062 0.455 1.00 0.00 O ATOM 647 CB THR A 269 6.903 -7.044 -1.758 1.00 0.00 C ATOM 648 OG1 THR A 269 8.134 -7.627 -1.374 1.00 0.00 O ATOM 649 CG2 THR A 269 6.664 -7.412 -3.208 1.00 0.00 C ATOM 0 H THR A 269 8.910 -5.219 -2.010 1.00 0.00 H new ATOM 0 HA THR A 269 5.947 -5.137 -1.840 1.00 0.00 H new ATOM 0 HB THR A 269 6.079 -7.426 -1.155 1.00 0.00 H new ATOM 0 HG1 THR A 269 8.105 -8.592 -1.541 1.00 0.00 H new ATOM 0 HG21 THR A 269 6.674 -8.497 -3.314 1.00 0.00 H new ATOM 0 HG22 THR A 269 5.696 -7.025 -3.527 1.00 0.00 H new ATOM 0 HG23 THR A 269 7.450 -6.980 -3.827 1.00 0.00 H new ATOM 657 N ILE A 270 5.965 -5.082 0.678 1.00 0.00 N ATOM 658 CA ILE A 270 6.000 -4.728 2.089 1.00 0.00 C ATOM 659 C ILE A 270 5.529 -5.898 2.951 1.00 0.00 C ATOM 660 O ILE A 270 4.509 -6.523 2.661 1.00 0.00 O ATOM 661 CB ILE A 270 5.129 -3.478 2.366 1.00 0.00 C ATOM 662 CG1 ILE A 270 5.660 -2.273 1.589 1.00 0.00 C ATOM 663 CG2 ILE A 270 5.076 -3.161 3.852 1.00 0.00 C ATOM 664 CD1 ILE A 270 4.881 -0.999 1.836 1.00 0.00 C ATOM 0 H ILE A 270 5.027 -5.206 0.296 1.00 0.00 H new ATOM 0 HA ILE A 270 7.032 -4.495 2.350 1.00 0.00 H new ATOM 0 HB ILE A 270 4.116 -3.697 2.030 1.00 0.00 H new ATOM 0 HG12 ILE A 270 6.703 -2.109 1.859 1.00 0.00 H new ATOM 0 HG13 ILE A 270 5.639 -2.501 0.523 1.00 0.00 H new ATOM 0 HG21 ILE A 270 4.457 -2.278 4.014 1.00 0.00 H new ATOM 0 HG22 ILE A 270 4.649 -4.007 4.390 1.00 0.00 H new ATOM 0 HG23 ILE A 270 6.084 -2.969 4.219 1.00 0.00 H new ATOM 0 HD11 ILE A 270 5.315 -0.188 1.252 1.00 0.00 H new ATOM 0 HD12 ILE A 270 3.842 -1.144 1.539 1.00 0.00 H new ATOM 0 HD13 ILE A 270 4.924 -0.746 2.895 1.00 0.00 H new ATOM 676 N ALA A 271 6.294 -6.208 3.994 1.00 0.00 N ATOM 677 CA ALA A 271 5.973 -7.324 4.878 1.00 0.00 C ATOM 678 C ALA A 271 4.680 -7.068 5.651 1.00 0.00 C ATOM 679 O ALA A 271 4.573 -6.093 6.396 1.00 0.00 O ATOM 680 CB ALA A 271 7.125 -7.585 5.840 1.00 0.00 C ATOM 0 H ALA A 271 7.142 -5.701 4.248 1.00 0.00 H new ATOM 0 HA ALA A 271 5.822 -8.209 4.260 1.00 0.00 H new ATOM 0 HB1 ALA A 271 6.871 -8.420 6.493 1.00 0.00 H new ATOM 0 HB2 ALA A 271 8.024 -7.827 5.274 1.00 0.00 H new ATOM 0 HB3 ALA A 271 7.305 -6.695 6.442 1.00 0.00 H new ATOM 686 N GLY A 272 3.700 -7.942 5.463 1.00 0.00 N ATOM 687 CA GLY A 272 2.422 -7.792 6.143 1.00 0.00 C ATOM 688 C GLY A 272 1.359 -7.208 5.236 1.00 0.00 C ATOM 689 O GLY A 272 0.165 -7.423 5.441 1.00 0.00 O ATOM 0 H GLY A 272 3.765 -8.755 4.851 1.00 0.00 H new ATOM 0 HA2 GLY A 272 2.091 -8.764 6.510 1.00 0.00 H new ATOM 0 HA3 GLY A 272 2.548 -7.149 7.014 1.00 0.00 H new ATOM 693 N VAL A 273 1.804 -6.520 4.199 1.00 0.00 N ATOM 694 CA VAL A 273 0.909 -5.952 3.201 1.00 0.00 C ATOM 695 C VAL A 273 0.933 -6.809 1.940 1.00 0.00 C ATOM 696 O VAL A 273 1.921 -6.815 1.204 1.00 0.00 O ATOM 697 CB VAL A 273 1.338 -4.521 2.839 1.00 0.00 C ATOM 698 CG1 VAL A 273 0.379 -3.895 1.838 1.00 0.00 C ATOM 699 CG2 VAL A 273 1.451 -3.657 4.087 1.00 0.00 C ATOM 0 H VAL A 273 2.792 -6.339 4.024 1.00 0.00 H new ATOM 0 HA VAL A 273 -0.098 -5.929 3.618 1.00 0.00 H new ATOM 0 HB VAL A 273 2.321 -4.578 2.371 1.00 0.00 H new ATOM 0 HG11 VAL A 273 0.709 -2.883 1.602 1.00 0.00 H new ATOM 0 HG12 VAL A 273 0.362 -4.493 0.927 1.00 0.00 H new ATOM 0 HG13 VAL A 273 -0.622 -3.859 2.267 1.00 0.00 H new ATOM 0 HG21 VAL A 273 1.756 -2.649 3.805 1.00 0.00 H new ATOM 0 HG22 VAL A 273 0.485 -3.617 4.590 1.00 0.00 H new ATOM 0 HG23 VAL A 273 2.193 -4.086 4.760 1.00 0.00 H new ATOM 709 N ASN A 274 -0.093 -7.621 1.747 1.00 0.00 N ATOM 710 CA ASN A 274 -0.079 -8.563 0.640 1.00 0.00 C ATOM 711 C ASN A 274 -1.235 -8.311 -0.311 1.00 0.00 C ATOM 712 O ASN A 274 -2.197 -7.639 0.042 1.00 0.00 O ATOM 713 CB ASN A 274 -0.102 -9.997 1.165 1.00 0.00 C ATOM 714 CG ASN A 274 0.987 -10.220 2.198 1.00 0.00 C ATOM 715 OD1 ASN A 274 0.887 -9.746 3.329 1.00 0.00 O ATOM 716 ND2 ASN A 274 2.058 -10.883 1.807 1.00 0.00 N ATOM 0 H ASN A 274 -0.930 -7.648 2.329 1.00 0.00 H new ATOM 0 HA ASN A 274 0.844 -8.416 0.078 1.00 0.00 H new ATOM 0 HB2 ASN A 274 -1.075 -10.210 1.607 1.00 0.00 H new ATOM 0 HB3 ASN A 274 0.031 -10.693 0.336 1.00 0.00 H new ATOM 0 HD21 ASN A 274 2.838 -11.017 2.450 1.00 0.00 H new ATOM 0 HD22 ASN A 274 2.106 -11.262 0.861 1.00 0.00 H new ATOM 723 N SER A 275 -1.073 -8.749 -1.552 1.00 0.00 N ATOM 724 CA SER A 275 -2.042 -8.464 -2.602 1.00 0.00 C ATOM 725 C SER A 275 -3.296 -9.315 -2.480 1.00 0.00 C ATOM 726 O SER A 275 -3.302 -10.356 -1.819 1.00 0.00 O ATOM 727 CB SER A 275 -1.416 -8.676 -3.982 1.00 0.00 C ATOM 728 OG SER A 275 -0.886 -9.988 -4.115 1.00 0.00 O ATOM 0 H SER A 275 -0.275 -9.306 -1.858 1.00 0.00 H new ATOM 0 HA SER A 275 -2.333 -7.420 -2.484 1.00 0.00 H new ATOM 0 HB2 SER A 275 -2.167 -8.505 -4.754 1.00 0.00 H new ATOM 0 HB3 SER A 275 -0.624 -7.944 -4.140 1.00 0.00 H new ATOM 0 HG SER A 275 -0.166 -10.117 -3.463 1.00 0.00 H new ATOM 734 N VAL A 276 -4.314 -8.918 -3.227 1.00 0.00 N ATOM 735 CA VAL A 276 -5.542 -9.680 -3.327 1.00 0.00 C ATOM 736 C VAL A 276 -5.834 -10.000 -4.785 1.00 0.00 C ATOM 737 O VAL A 276 -5.417 -9.270 -5.686 1.00 0.00 O ATOM 738 CB VAL A 276 -6.745 -8.922 -2.724 1.00 0.00 C ATOM 739 CG1 VAL A 276 -6.524 -8.646 -1.248 1.00 0.00 C ATOM 740 CG2 VAL A 276 -7.005 -7.623 -3.472 1.00 0.00 C ATOM 0 H VAL A 276 -4.309 -8.060 -3.779 1.00 0.00 H new ATOM 0 HA VAL A 276 -5.402 -10.599 -2.758 1.00 0.00 H new ATOM 0 HB VAL A 276 -7.624 -9.558 -2.829 1.00 0.00 H new ATOM 0 HG11 VAL A 276 -7.384 -8.111 -0.845 1.00 0.00 H new ATOM 0 HG12 VAL A 276 -6.401 -9.589 -0.716 1.00 0.00 H new ATOM 0 HG13 VAL A 276 -5.628 -8.039 -1.122 1.00 0.00 H new ATOM 0 HG21 VAL A 276 -7.857 -7.111 -3.026 1.00 0.00 H new ATOM 0 HG22 VAL A 276 -6.124 -6.984 -3.409 1.00 0.00 H new ATOM 0 HG23 VAL A 276 -7.220 -7.842 -4.518 1.00 0.00 H new ATOM 750 N HIS A 277 -6.554 -11.080 -5.015 1.00 0.00 N ATOM 751 CA HIS A 277 -6.910 -11.481 -6.367 1.00 0.00 C ATOM 752 C HIS A 277 -8.400 -11.284 -6.580 1.00 0.00 C ATOM 753 O HIS A 277 -9.205 -12.115 -6.169 1.00 0.00 O ATOM 754 CB HIS A 277 -6.504 -12.939 -6.614 1.00 0.00 C ATOM 755 CG HIS A 277 -5.020 -13.161 -6.544 1.00 0.00 C ATOM 756 ND1 HIS A 277 -4.001 -12.278 -6.391 1.00 0.00 N flip ATOM 757 CD2 HIS A 277 -4.430 -14.403 -6.654 1.00 0.00 C flip ATOM 758 CE1 HIS A 277 -2.832 -12.991 -6.410 1.00 0.00 C flip ATOM 759 NE2 HIS A 277 -3.115 -14.269 -6.568 1.00 0.00 N flip ATOM 0 H HIS A 277 -6.906 -11.698 -4.284 1.00 0.00 H new ATOM 0 HA HIS A 277 -6.372 -10.860 -7.083 1.00 0.00 H new ATOM 0 HB2 HIS A 277 -6.995 -13.576 -5.878 1.00 0.00 H new ATOM 0 HB3 HIS A 277 -6.865 -13.249 -7.595 1.00 0.00 H new ATOM 0 HD2 HIS A 277 -4.957 -15.336 -6.789 1.00 0.00 H new ATOM 0 HE1 HIS A 277 -1.840 -12.575 -6.312 1.00 0.00 H new ATOM 0 HE2 HIS A 277 -2.435 -15.028 -6.616 1.00 0.00 H new ATOM 768 N GLN A 278 -8.765 -10.107 -7.074 1.00 0.00 N ATOM 769 CA GLN A 278 -10.169 -9.715 -7.171 1.00 0.00 C ATOM 770 C GLN A 278 -10.866 -10.339 -8.377 1.00 0.00 C ATOM 771 O GLN A 278 -12.089 -10.298 -8.477 1.00 0.00 O ATOM 772 CB GLN A 278 -10.287 -8.189 -7.223 1.00 0.00 C ATOM 773 CG GLN A 278 -9.495 -7.552 -8.353 1.00 0.00 C ATOM 774 CD GLN A 278 -9.592 -6.042 -8.352 1.00 0.00 C ATOM 775 OE1 GLN A 278 -9.253 -5.386 -7.364 1.00 0.00 O ATOM 776 NE2 GLN A 278 -10.052 -5.478 -9.457 1.00 0.00 N ATOM 0 H GLN A 278 -8.108 -9.405 -7.415 1.00 0.00 H new ATOM 0 HA GLN A 278 -10.672 -10.091 -6.280 1.00 0.00 H new ATOM 0 HB2 GLN A 278 -11.337 -7.918 -7.330 1.00 0.00 H new ATOM 0 HB3 GLN A 278 -9.946 -7.775 -6.274 1.00 0.00 H new ATOM 0 HG2 GLN A 278 -8.449 -7.845 -8.269 1.00 0.00 H new ATOM 0 HG3 GLN A 278 -9.858 -7.935 -9.307 1.00 0.00 H new ATOM 0 HE21 GLN A 278 -10.321 -6.058 -10.252 1.00 0.00 H new ATOM 0 HE22 GLN A 278 -10.137 -4.463 -9.514 1.00 0.00 H new ATOM 785 N ILE A 279 -10.098 -10.934 -9.279 1.00 0.00 N ATOM 786 CA ILE A 279 -10.676 -11.576 -10.452 1.00 0.00 C ATOM 787 C ILE A 279 -11.291 -12.917 -10.062 1.00 0.00 C ATOM 788 O ILE A 279 -12.469 -13.172 -10.318 1.00 0.00 O ATOM 789 CB ILE A 279 -9.639 -11.796 -11.591 1.00 0.00 C ATOM 790 CG1 ILE A 279 -9.094 -10.467 -12.144 1.00 0.00 C ATOM 791 CG2 ILE A 279 -10.249 -12.604 -12.725 1.00 0.00 C ATOM 792 CD1 ILE A 279 -8.228 -9.684 -11.182 1.00 0.00 C ATOM 0 H ILE A 279 -9.081 -10.986 -9.223 1.00 0.00 H new ATOM 0 HA ILE A 279 -11.443 -10.903 -10.834 1.00 0.00 H new ATOM 0 HB ILE A 279 -8.806 -12.348 -11.155 1.00 0.00 H new ATOM 0 HG12 ILE A 279 -8.515 -10.675 -13.044 1.00 0.00 H new ATOM 0 HG13 ILE A 279 -9.936 -9.842 -12.443 1.00 0.00 H new ATOM 0 HG21 ILE A 279 -9.507 -12.746 -13.511 1.00 0.00 H new ATOM 0 HG22 ILE A 279 -10.569 -13.575 -12.348 1.00 0.00 H new ATOM 0 HG23 ILE A 279 -11.109 -12.071 -13.130 1.00 0.00 H new ATOM 0 HD11 ILE A 279 -7.892 -8.764 -11.661 1.00 0.00 H new ATOM 0 HD12 ILE A 279 -8.805 -9.439 -10.290 1.00 0.00 H new ATOM 0 HD13 ILE A 279 -7.363 -10.284 -10.901 1.00 0.00 H new ATOM 804 N THR A 280 -10.483 -13.775 -9.460 1.00 0.00 N ATOM 805 CA THR A 280 -10.933 -15.100 -9.056 1.00 0.00 C ATOM 806 C THR A 280 -11.358 -15.127 -7.589 1.00 0.00 C ATOM 807 O THR A 280 -11.755 -16.175 -7.074 1.00 0.00 O ATOM 808 CB THR A 280 -9.821 -16.121 -9.310 1.00 0.00 C ATOM 809 OG1 THR A 280 -8.621 -15.731 -8.659 1.00 0.00 O ATOM 810 CG2 THR A 280 -9.504 -16.313 -10.778 1.00 0.00 C ATOM 0 H THR A 280 -9.507 -13.577 -9.239 1.00 0.00 H new ATOM 0 HA THR A 280 -11.807 -15.360 -9.653 1.00 0.00 H new ATOM 0 HB THR A 280 -10.200 -17.062 -8.911 1.00 0.00 H new ATOM 0 HG1 THR A 280 -7.923 -16.397 -8.832 1.00 0.00 H new ATOM 0 HG21 THR A 280 -8.708 -17.049 -10.885 1.00 0.00 H new ATOM 0 HG22 THR A 280 -10.395 -16.663 -11.300 1.00 0.00 H new ATOM 0 HG23 THR A 280 -9.181 -15.365 -11.208 1.00 0.00 H new ATOM 818 N LYS A 281 -11.229 -13.981 -6.916 1.00 0.00 N ATOM 819 CA LYS A 281 -11.550 -13.860 -5.489 1.00 0.00 C ATOM 820 C LYS A 281 -10.823 -14.922 -4.672 1.00 0.00 C ATOM 821 O LYS A 281 -11.443 -15.679 -3.926 1.00 0.00 O ATOM 822 CB LYS A 281 -13.061 -13.953 -5.251 1.00 0.00 C ATOM 823 CG LYS A 281 -13.866 -12.839 -5.910 1.00 0.00 C ATOM 824 CD LYS A 281 -13.480 -11.438 -5.423 1.00 0.00 C ATOM 825 CE LYS A 281 -13.798 -11.198 -3.943 1.00 0.00 C ATOM 826 NZ LYS A 281 -12.929 -11.979 -3.017 1.00 0.00 N1+ ATOM 0 H LYS A 281 -10.901 -13.114 -7.341 1.00 0.00 H new ATOM 0 HA LYS A 281 -11.210 -12.878 -5.160 1.00 0.00 H new ATOM 0 HB2 LYS A 281 -13.418 -14.913 -5.623 1.00 0.00 H new ATOM 0 HB3 LYS A 281 -13.250 -13.937 -4.178 1.00 0.00 H new ATOM 0 HG2 LYS A 281 -13.728 -12.891 -6.990 1.00 0.00 H new ATOM 0 HG3 LYS A 281 -14.926 -13.004 -5.716 1.00 0.00 H new ATOM 0 HD2 LYS A 281 -12.413 -11.286 -5.587 1.00 0.00 H new ATOM 0 HD3 LYS A 281 -14.004 -10.695 -6.025 1.00 0.00 H new ATOM 0 HE2 LYS A 281 -13.689 -10.136 -3.723 1.00 0.00 H new ATOM 0 HE3 LYS A 281 -14.840 -11.457 -3.756 1.00 0.00 H new ATOM 0 HZ1 LYS A 281 -12.699 -11.399 -2.185 1.00 0.00 H new ATOM 0 HZ2 LYS A 281 -13.430 -12.838 -2.713 1.00 0.00 H new ATOM 0 HZ3 LYS A 281 -12.051 -12.245 -3.507 1.00 0.00 H new ATOM 840 N ASP A 282 -9.512 -14.999 -4.854 1.00 0.00 N ATOM 841 CA ASP A 282 -8.707 -16.005 -4.177 1.00 0.00 C ATOM 842 C ASP A 282 -7.793 -15.340 -3.151 1.00 0.00 C ATOM 843 O ASP A 282 -7.288 -14.239 -3.382 1.00 0.00 O ATOM 844 CB ASP A 282 -7.875 -16.777 -5.204 1.00 0.00 C ATOM 845 CG ASP A 282 -7.200 -18.003 -4.629 1.00 0.00 C ATOM 846 OD1 ASP A 282 -6.413 -18.636 -5.359 1.00 0.00 O ATOM 847 OD2 ASP A 282 -7.491 -18.366 -3.474 1.00 0.00 O1- ATOM 0 H ASP A 282 -8.983 -14.376 -5.465 1.00 0.00 H new ATOM 0 HA ASP A 282 -9.366 -16.701 -3.658 1.00 0.00 H new ATOM 0 HB2 ASP A 282 -8.519 -17.079 -6.030 1.00 0.00 H new ATOM 0 HB3 ASP A 282 -7.116 -16.114 -5.618 1.00 0.00 H new ATOM 852 N THR A 283 -7.532 -16.036 -2.056 1.00 0.00 N ATOM 853 CA THR A 283 -6.620 -15.551 -1.035 1.00 0.00 C ATOM 854 C THR A 283 -5.317 -16.333 -1.074 1.00 0.00 C ATOM 855 O THR A 283 -5.289 -17.531 -0.791 1.00 0.00 O ATOM 856 CB THR A 283 -7.271 -15.635 0.349 1.00 0.00 C ATOM 857 OG1 THR A 283 -7.772 -16.938 0.602 1.00 0.00 O ATOM 858 CG2 THR A 283 -8.412 -14.661 0.530 1.00 0.00 C ATOM 0 H THR A 283 -7.944 -16.947 -1.852 1.00 0.00 H new ATOM 0 HA THR A 283 -6.393 -14.504 -1.238 1.00 0.00 H new ATOM 0 HB THR A 283 -6.478 -15.381 1.052 1.00 0.00 H new ATOM 0 HG1 THR A 283 -7.201 -17.600 0.159 1.00 0.00 H new ATOM 0 HG21 THR A 283 -8.829 -14.772 1.531 1.00 0.00 H new ATOM 0 HG22 THR A 283 -8.045 -13.643 0.400 1.00 0.00 H new ATOM 0 HG23 THR A 283 -9.186 -14.865 -0.210 1.00 0.00 H new ATOM 866 N THR A 284 -4.256 -15.671 -1.493 1.00 0.00 N ATOM 867 CA THR A 284 -2.969 -16.323 -1.642 1.00 0.00 C ATOM 868 C THR A 284 -1.929 -15.677 -0.733 1.00 0.00 C ATOM 869 O THR A 284 -0.988 -16.330 -0.281 1.00 0.00 O ATOM 870 CB THR A 284 -2.538 -16.258 -3.105 1.00 0.00 C ATOM 871 OG1 THR A 284 -2.420 -14.909 -3.533 1.00 0.00 O ATOM 872 CG2 THR A 284 -3.516 -16.953 -4.032 1.00 0.00 C ATOM 0 H THR A 284 -4.260 -14.681 -1.737 1.00 0.00 H new ATOM 0 HA THR A 284 -3.057 -17.368 -1.346 1.00 0.00 H new ATOM 0 HB THR A 284 -1.577 -16.769 -3.157 1.00 0.00 H new ATOM 0 HG1 THR A 284 -2.674 -14.842 -4.477 1.00 0.00 H new ATOM 0 HG21 THR A 284 -3.161 -16.876 -5.060 1.00 0.00 H new ATOM 0 HG22 THR A 284 -3.597 -18.004 -3.754 1.00 0.00 H new ATOM 0 HG23 THR A 284 -4.494 -16.479 -3.950 1.00 0.00 H new ATOM 880 N GLY A 285 -2.143 -14.405 -0.416 1.00 0.00 N ATOM 881 CA GLY A 285 -1.259 -13.710 0.498 1.00 0.00 C ATOM 882 C GLY A 285 0.098 -13.417 -0.103 1.00 0.00 C ATOM 883 O GLY A 285 1.100 -13.379 0.611 1.00 0.00 O ATOM 0 H GLY A 285 -2.914 -13.843 -0.777 1.00 0.00 H new ATOM 0 HA2 GLY A 285 -1.725 -12.773 0.804 1.00 0.00 H new ATOM 0 HA3 GLY A 285 -1.130 -14.311 1.398 1.00 0.00 H new ATOM 887 N GLN A 286 0.139 -13.193 -1.408 1.00 0.00 N ATOM 888 CA GLN A 286 1.395 -12.886 -2.076 1.00 0.00 C ATOM 889 C GLN A 286 1.716 -11.406 -1.926 1.00 0.00 C ATOM 890 O GLN A 286 0.837 -10.565 -2.091 1.00 0.00 O ATOM 891 CB GLN A 286 1.324 -13.269 -3.557 1.00 0.00 C ATOM 892 CG GLN A 286 1.005 -14.739 -3.787 1.00 0.00 C ATOM 893 CD GLN A 286 1.994 -15.659 -3.102 1.00 0.00 C ATOM 894 OE1 GLN A 286 3.195 -15.607 -3.367 1.00 0.00 O ATOM 895 NE2 GLN A 286 1.499 -16.507 -2.213 1.00 0.00 N ATOM 0 H GLN A 286 -0.676 -13.218 -2.021 1.00 0.00 H new ATOM 0 HA GLN A 286 2.190 -13.468 -1.610 1.00 0.00 H new ATOM 0 HB2 GLN A 286 0.564 -12.659 -4.046 1.00 0.00 H new ATOM 0 HB3 GLN A 286 2.276 -13.033 -4.032 1.00 0.00 H new ATOM 0 HG2 GLN A 286 0.001 -14.952 -3.420 1.00 0.00 H new ATOM 0 HG3 GLN A 286 1.003 -14.944 -4.857 1.00 0.00 H new ATOM 0 HE21 GLN A 286 0.497 -16.519 -2.022 1.00 0.00 H new ATOM 0 HE22 GLN A 286 2.120 -17.148 -1.719 1.00 0.00 H new ATOM 904 N PRO A 287 2.966 -11.073 -1.557 1.00 0.00 N ATOM 905 CA PRO A 287 3.387 -9.683 -1.325 1.00 0.00 C ATOM 906 C PRO A 287 2.994 -8.745 -2.467 1.00 0.00 C ATOM 907 O PRO A 287 3.145 -9.082 -3.644 1.00 0.00 O ATOM 908 CB PRO A 287 4.906 -9.796 -1.218 1.00 0.00 C ATOM 909 CG PRO A 287 5.149 -11.173 -0.707 1.00 0.00 C ATOM 910 CD PRO A 287 4.055 -12.032 -1.282 1.00 0.00 C ATOM 0 HA PRO A 287 2.910 -9.254 -0.444 1.00 0.00 H new ATOM 0 HB2 PRO A 287 5.383 -9.643 -2.186 1.00 0.00 H new ATOM 0 HB3 PRO A 287 5.312 -9.045 -0.540 1.00 0.00 H new ATOM 0 HG2 PRO A 287 6.130 -11.535 -1.014 1.00 0.00 H new ATOM 0 HG3 PRO A 287 5.128 -11.193 0.383 1.00 0.00 H new ATOM 0 HD2 PRO A 287 4.380 -12.540 -2.190 1.00 0.00 H new ATOM 0 HD3 PRO A 287 3.741 -12.804 -0.580 1.00 0.00 H new ATOM 918 N GLN A 288 2.430 -7.597 -2.107 1.00 0.00 N ATOM 919 CA GLN A 288 1.941 -6.634 -3.089 1.00 0.00 C ATOM 920 C GLN A 288 3.112 -5.764 -3.558 1.00 0.00 C ATOM 921 O GLN A 288 3.949 -5.364 -2.749 1.00 0.00 O ATOM 922 CB GLN A 288 0.826 -5.788 -2.443 1.00 0.00 C ATOM 923 CG GLN A 288 -0.122 -5.085 -3.415 1.00 0.00 C ATOM 924 CD GLN A 288 0.524 -3.995 -4.237 1.00 0.00 C ATOM 925 OE1 GLN A 288 1.034 -3.017 -3.701 1.00 0.00 O ATOM 926 NE2 GLN A 288 0.495 -4.154 -5.548 1.00 0.00 N ATOM 0 H GLN A 288 2.299 -7.309 -1.137 1.00 0.00 H new ATOM 0 HA GLN A 288 1.524 -7.140 -3.960 1.00 0.00 H new ATOM 0 HB2 GLN A 288 0.236 -6.434 -1.793 1.00 0.00 H new ATOM 0 HB3 GLN A 288 1.290 -5.034 -1.807 1.00 0.00 H new ATOM 0 HG2 GLN A 288 -0.548 -5.828 -4.089 1.00 0.00 H new ATOM 0 HG3 GLN A 288 -0.949 -4.656 -2.850 1.00 0.00 H new ATOM 0 HE21 GLN A 288 0.060 -4.984 -5.952 1.00 0.00 H new ATOM 0 HE22 GLN A 288 0.908 -3.447 -6.157 1.00 0.00 H new ATOM 935 N VAL A 289 3.216 -5.549 -4.868 1.00 0.00 N ATOM 936 CA VAL A 289 4.341 -4.807 -5.435 1.00 0.00 C ATOM 937 C VAL A 289 3.954 -3.351 -5.696 1.00 0.00 C ATOM 938 O VAL A 289 2.921 -3.069 -6.302 1.00 0.00 O ATOM 939 CB VAL A 289 4.831 -5.455 -6.748 1.00 0.00 C ATOM 940 CG1 VAL A 289 6.075 -4.755 -7.276 1.00 0.00 C ATOM 941 CG2 VAL A 289 5.095 -6.938 -6.545 1.00 0.00 C ATOM 0 H VAL A 289 2.537 -5.877 -5.555 1.00 0.00 H new ATOM 0 HA VAL A 289 5.152 -4.836 -4.707 1.00 0.00 H new ATOM 0 HB VAL A 289 4.043 -5.343 -7.493 1.00 0.00 H new ATOM 0 HG11 VAL A 289 6.397 -5.233 -8.201 1.00 0.00 H new ATOM 0 HG12 VAL A 289 5.848 -3.707 -7.469 1.00 0.00 H new ATOM 0 HG13 VAL A 289 6.873 -4.823 -6.536 1.00 0.00 H new ATOM 0 HG21 VAL A 289 5.440 -7.378 -7.481 1.00 0.00 H new ATOM 0 HG22 VAL A 289 5.859 -7.070 -5.779 1.00 0.00 H new ATOM 0 HG23 VAL A 289 4.176 -7.431 -6.229 1.00 0.00 H new ATOM 951 N PHE A 290 4.729 -2.431 -5.142 1.00 0.00 N ATOM 952 CA PHE A 290 4.388 -1.017 -5.206 1.00 0.00 C ATOM 953 C PHE A 290 5.134 -0.296 -6.319 1.00 0.00 C ATOM 954 O PHE A 290 6.159 -0.765 -6.803 1.00 0.00 O ATOM 955 CB PHE A 290 4.689 -0.322 -3.873 1.00 0.00 C ATOM 956 CG PHE A 290 3.909 -0.860 -2.709 1.00 0.00 C ATOM 957 CD1 PHE A 290 4.097 -2.159 -2.265 1.00 0.00 C ATOM 958 CD2 PHE A 290 2.979 -0.066 -2.063 1.00 0.00 C ATOM 959 CE1 PHE A 290 3.377 -2.652 -1.203 1.00 0.00 C ATOM 960 CE2 PHE A 290 2.254 -0.557 -0.997 1.00 0.00 C ATOM 961 CZ PHE A 290 2.455 -1.852 -0.569 1.00 0.00 C ATOM 0 H PHE A 290 5.595 -2.636 -4.645 1.00 0.00 H new ATOM 0 HA PHE A 290 3.320 -0.966 -5.417 1.00 0.00 H new ATOM 0 HB2 PHE A 290 5.753 -0.418 -3.658 1.00 0.00 H new ATOM 0 HB3 PHE A 290 4.479 0.743 -3.976 1.00 0.00 H new ATOM 0 HD1 PHE A 290 4.819 -2.792 -2.760 1.00 0.00 H new ATOM 0 HD2 PHE A 290 2.819 0.949 -2.396 1.00 0.00 H new ATOM 0 HE1 PHE A 290 3.535 -3.666 -0.867 1.00 0.00 H new ATOM 0 HE2 PHE A 290 1.531 0.072 -0.499 1.00 0.00 H new ATOM 0 HZ PHE A 290 1.888 -2.239 0.265 1.00 0.00 H new ATOM 971 N ARG A 291 4.658 0.903 -6.624 1.00 0.00 N ATOM 972 CA ARG A 291 5.303 1.799 -7.566 1.00 0.00 C ATOM 973 C ARG A 291 5.453 3.170 -6.915 1.00 0.00 C ATOM 974 O ARG A 291 4.476 3.752 -6.445 1.00 0.00 O ATOM 975 CB ARG A 291 4.477 1.934 -8.851 1.00 0.00 C ATOM 976 CG ARG A 291 4.209 0.622 -9.574 1.00 0.00 C ATOM 977 CD ARG A 291 5.502 -0.077 -9.980 1.00 0.00 C ATOM 978 NE ARG A 291 5.257 -1.316 -10.723 1.00 0.00 N ATOM 979 CZ ARG A 291 4.628 -2.384 -10.225 1.00 0.00 C ATOM 980 NH1 ARG A 291 4.231 -2.397 -8.959 1.00 0.00 N1+ ATOM 981 NH2 ARG A 291 4.417 -3.449 -10.984 1.00 0.00 N ATOM 0 H ARG A 291 3.803 1.283 -6.218 1.00 0.00 H new ATOM 0 HA ARG A 291 6.279 1.391 -7.829 1.00 0.00 H new ATOM 0 HB2 ARG A 291 3.523 2.400 -8.606 1.00 0.00 H new ATOM 0 HB3 ARG A 291 4.996 2.609 -9.531 1.00 0.00 H new ATOM 0 HG2 ARG A 291 3.628 -0.036 -8.928 1.00 0.00 H new ATOM 0 HG3 ARG A 291 3.605 0.813 -10.461 1.00 0.00 H new ATOM 0 HD2 ARG A 291 6.100 0.598 -10.592 1.00 0.00 H new ATOM 0 HD3 ARG A 291 6.087 -0.301 -9.088 1.00 0.00 H new ATOM 0 HE ARG A 291 5.589 -1.366 -11.686 1.00 0.00 H new ATOM 0 HH11 ARG A 291 4.406 -1.589 -8.361 1.00 0.00 H new ATOM 0 HH12 ARG A 291 3.751 -3.215 -8.583 1.00 0.00 H new ATOM 0 HH21 ARG A 291 4.735 -3.456 -11.953 1.00 0.00 H new ATOM 0 HH22 ARG A 291 3.936 -4.262 -10.599 1.00 0.00 H new ATOM 995 N VAL A 292 6.680 3.628 -6.797 1.00 0.00 N ATOM 996 CA VAL A 292 6.968 4.877 -6.092 1.00 0.00 C ATOM 997 C VAL A 292 6.645 6.105 -6.944 1.00 0.00 C ATOM 998 O VAL A 292 7.018 6.174 -8.117 1.00 0.00 O ATOM 999 CB VAL A 292 8.445 4.936 -5.651 1.00 0.00 C ATOM 1000 CG1 VAL A 292 8.730 6.214 -4.881 1.00 0.00 C ATOM 1001 CG2 VAL A 292 8.800 3.720 -4.811 1.00 0.00 C ATOM 0 H VAL A 292 7.502 3.160 -7.178 1.00 0.00 H new ATOM 0 HA VAL A 292 6.326 4.892 -5.211 1.00 0.00 H new ATOM 0 HB VAL A 292 9.066 4.932 -6.547 1.00 0.00 H new ATOM 0 HG11 VAL A 292 9.778 6.232 -4.581 1.00 0.00 H new ATOM 0 HG12 VAL A 292 8.519 7.075 -5.515 1.00 0.00 H new ATOM 0 HG13 VAL A 292 8.098 6.253 -3.994 1.00 0.00 H new ATOM 0 HG21 VAL A 292 9.846 3.779 -4.509 1.00 0.00 H new ATOM 0 HG22 VAL A 292 8.167 3.693 -3.924 1.00 0.00 H new ATOM 0 HG23 VAL A 292 8.642 2.814 -5.397 1.00 0.00 H new ATOM 1011 N LEU A 293 5.998 7.097 -6.325 1.00 0.00 N ATOM 1012 CA LEU A 293 5.678 8.350 -7.007 1.00 0.00 C ATOM 1013 C LEU A 293 6.630 9.469 -6.604 1.00 0.00 C ATOM 1014 O LEU A 293 6.939 10.345 -7.412 1.00 0.00 O ATOM 1015 CB LEU A 293 4.248 8.804 -6.705 1.00 0.00 C ATOM 1016 CG LEU A 293 3.136 7.854 -7.137 1.00 0.00 C ATOM 1017 CD1 LEU A 293 1.783 8.480 -6.855 1.00 0.00 C ATOM 1018 CD2 LEU A 293 3.263 7.501 -8.610 1.00 0.00 C ATOM 0 H LEU A 293 5.687 7.055 -5.355 1.00 0.00 H new ATOM 0 HA LEU A 293 5.782 8.150 -8.073 1.00 0.00 H new ATOM 0 HB2 LEU A 293 4.160 8.969 -5.631 1.00 0.00 H new ATOM 0 HB3 LEU A 293 4.084 9.766 -7.190 1.00 0.00 H new ATOM 0 HG LEU A 293 3.227 6.932 -6.563 1.00 0.00 H new ATOM 0 HD11 LEU A 293 0.994 7.796 -7.166 1.00 0.00 H new ATOM 0 HD12 LEU A 293 1.690 8.680 -5.788 1.00 0.00 H new ATOM 0 HD13 LEU A 293 1.692 9.415 -7.408 1.00 0.00 H new ATOM 0 HD21 LEU A 293 2.458 6.822 -8.892 1.00 0.00 H new ATOM 0 HD22 LEU A 293 3.198 8.410 -9.209 1.00 0.00 H new ATOM 0 HD23 LEU A 293 4.224 7.017 -8.787 1.00 0.00 H new ATOM 1030 N ALA A 294 7.014 9.504 -5.333 1.00 0.00 N ATOM 1031 CA ALA A 294 7.839 10.596 -4.827 1.00 0.00 C ATOM 1032 C ALA A 294 8.707 10.147 -3.665 1.00 0.00 C ATOM 1033 O ALA A 294 8.237 9.455 -2.766 1.00 0.00 O ATOM 1034 CB ALA A 294 6.967 11.766 -4.395 1.00 0.00 C ATOM 0 H ALA A 294 6.771 8.797 -4.640 1.00 0.00 H new ATOM 0 HA ALA A 294 8.494 10.914 -5.638 1.00 0.00 H new ATOM 0 HB1 ALA A 294 7.598 12.572 -4.020 1.00 0.00 H new ATOM 0 HB2 ALA A 294 6.390 12.124 -5.248 1.00 0.00 H new ATOM 0 HB3 ALA A 294 6.287 11.442 -3.607 1.00 0.00 H new ATOM 1040 N VAL A 295 9.945 10.622 -3.647 1.00 0.00 N ATOM 1041 CA VAL A 295 10.861 10.359 -2.543 1.00 0.00 C ATOM 1042 C VAL A 295 11.622 11.633 -2.195 1.00 0.00 C ATOM 1043 O VAL A 295 12.407 12.135 -2.999 1.00 0.00 O ATOM 1044 CB VAL A 295 11.870 9.235 -2.879 1.00 0.00 C ATOM 1045 CG1 VAL A 295 12.801 8.971 -1.706 1.00 0.00 C ATOM 1046 CG2 VAL A 295 11.151 7.958 -3.268 1.00 0.00 C ATOM 0 H VAL A 295 10.341 11.196 -4.391 1.00 0.00 H new ATOM 0 HA VAL A 295 10.264 10.029 -1.693 1.00 0.00 H new ATOM 0 HB VAL A 295 12.466 9.571 -3.728 1.00 0.00 H new ATOM 0 HG11 VAL A 295 13.500 8.177 -1.968 1.00 0.00 H new ATOM 0 HG12 VAL A 295 13.355 9.879 -1.470 1.00 0.00 H new ATOM 0 HG13 VAL A 295 12.216 8.667 -0.838 1.00 0.00 H new ATOM 0 HG21 VAL A 295 11.883 7.184 -3.499 1.00 0.00 H new ATOM 0 HG22 VAL A 295 10.523 7.628 -2.441 1.00 0.00 H new ATOM 0 HG23 VAL A 295 10.529 8.143 -4.144 1.00 0.00 H new ATOM 1056 N SER A 296 11.317 12.198 -1.038 1.00 0.00 N ATOM 1057 CA SER A 296 11.903 13.465 -0.632 1.00 0.00 C ATOM 1058 C SER A 296 12.254 13.459 0.854 1.00 0.00 C ATOM 1059 O SER A 296 11.373 13.575 1.706 1.00 0.00 O ATOM 1060 CB SER A 296 10.931 14.606 -0.946 1.00 0.00 C ATOM 1061 OG SER A 296 9.666 14.390 -0.333 1.00 0.00 O ATOM 0 H SER A 296 10.666 11.798 -0.362 1.00 0.00 H new ATOM 0 HA SER A 296 12.827 13.614 -1.191 1.00 0.00 H new ATOM 0 HB2 SER A 296 11.350 15.550 -0.597 1.00 0.00 H new ATOM 0 HB3 SER A 296 10.805 14.692 -2.025 1.00 0.00 H new ATOM 0 HG SER A 296 9.793 14.191 0.618 1.00 0.00 H new ATOM 1067 N GLY A 297 13.542 13.321 1.159 1.00 0.00 N ATOM 1068 CA GLY A 297 13.986 13.301 2.546 1.00 0.00 C ATOM 1069 C GLY A 297 13.386 12.150 3.328 1.00 0.00 C ATOM 1070 O GLY A 297 12.676 12.369 4.314 1.00 0.00 O ATOM 0 H GLY A 297 14.288 13.222 0.471 1.00 0.00 H new ATOM 0 HA2 GLY A 297 15.073 13.229 2.576 1.00 0.00 H new ATOM 0 HA3 GLY A 297 13.716 14.242 3.025 1.00 0.00 H new ATOM 1074 N THR A 298 13.612 10.932 2.830 1.00 0.00 N ATOM 1075 CA THR A 298 13.048 9.695 3.394 1.00 0.00 C ATOM 1076 C THR A 298 11.523 9.761 3.547 1.00 0.00 C ATOM 1077 O THR A 298 10.919 8.903 4.190 1.00 0.00 O ATOM 1078 CB THR A 298 13.719 9.315 4.730 1.00 0.00 C ATOM 1079 OG1 THR A 298 13.570 10.330 5.710 1.00 0.00 O ATOM 1080 CG2 THR A 298 15.200 9.030 4.598 1.00 0.00 C ATOM 0 H THR A 298 14.200 10.771 2.012 1.00 0.00 H new ATOM 0 HA THR A 298 13.266 8.907 2.673 1.00 0.00 H new ATOM 0 HB THR A 298 13.204 8.405 5.039 1.00 0.00 H new ATOM 0 HG1 THR A 298 12.898 10.977 5.411 1.00 0.00 H new ATOM 0 HG21 THR A 298 15.609 8.769 5.574 1.00 0.00 H new ATOM 0 HG22 THR A 298 15.351 8.200 3.908 1.00 0.00 H new ATOM 0 HG23 THR A 298 15.708 9.916 4.217 1.00 0.00 H new ATOM 1088 N THR A 299 10.898 10.707 2.859 1.00 0.00 N ATOM 1089 CA THR A 299 9.450 10.797 2.818 1.00 0.00 C ATOM 1090 C THR A 299 8.967 10.313 1.461 1.00 0.00 C ATOM 1091 O THR A 299 9.260 10.929 0.434 1.00 0.00 O ATOM 1092 CB THR A 299 9.001 12.238 3.067 1.00 0.00 C ATOM 1093 OG1 THR A 299 9.485 12.704 4.316 1.00 0.00 O ATOM 1094 CG2 THR A 299 7.498 12.411 3.063 1.00 0.00 C ATOM 0 H THR A 299 11.378 11.427 2.319 1.00 0.00 H new ATOM 0 HA THR A 299 9.020 10.171 3.600 1.00 0.00 H new ATOM 0 HB THR A 299 9.416 12.815 2.240 1.00 0.00 H new ATOM 0 HG1 THR A 299 10.464 12.747 4.292 1.00 0.00 H new ATOM 0 HG21 THR A 299 7.252 13.457 3.246 1.00 0.00 H new ATOM 0 HG22 THR A 299 7.099 12.108 2.095 1.00 0.00 H new ATOM 0 HG23 THR A 299 7.059 11.793 3.846 1.00 0.00 H new ATOM 1102 N VAL A 300 8.357 9.143 1.440 1.00 0.00 N ATOM 1103 CA VAL A 300 7.993 8.517 0.184 1.00 0.00 C ATOM 1104 C VAL A 300 6.480 8.494 -0.007 1.00 0.00 C ATOM 1105 O VAL A 300 5.740 8.054 0.869 1.00 0.00 O ATOM 1106 CB VAL A 300 8.552 7.075 0.106 1.00 0.00 C ATOM 1107 CG1 VAL A 300 8.255 6.439 -1.242 1.00 0.00 C ATOM 1108 CG2 VAL A 300 10.049 7.067 0.375 1.00 0.00 C ATOM 0 H VAL A 300 8.105 8.610 2.272 1.00 0.00 H new ATOM 0 HA VAL A 300 8.433 9.113 -0.616 1.00 0.00 H new ATOM 0 HB VAL A 300 8.054 6.484 0.874 1.00 0.00 H new ATOM 0 HG11 VAL A 300 8.661 5.427 -1.264 1.00 0.00 H new ATOM 0 HG12 VAL A 300 7.177 6.401 -1.397 1.00 0.00 H new ATOM 0 HG13 VAL A 300 8.714 7.032 -2.033 1.00 0.00 H new ATOM 0 HG21 VAL A 300 10.424 6.045 0.316 1.00 0.00 H new ATOM 0 HG22 VAL A 300 10.556 7.683 -0.368 1.00 0.00 H new ATOM 0 HG23 VAL A 300 10.242 7.467 1.370 1.00 0.00 H new ATOM 1118 N THR A 301 6.046 8.848 -1.206 1.00 0.00 N ATOM 1119 CA THR A 301 4.649 8.734 -1.579 1.00 0.00 C ATOM 1120 C THR A 301 4.479 7.464 -2.401 1.00 0.00 C ATOM 1121 O THR A 301 5.166 7.281 -3.412 1.00 0.00 O ATOM 1122 CB THR A 301 4.211 9.964 -2.375 1.00 0.00 C ATOM 1123 OG1 THR A 301 4.461 11.147 -1.635 1.00 0.00 O ATOM 1124 CG2 THR A 301 2.741 9.958 -2.736 1.00 0.00 C ATOM 0 H THR A 301 6.648 9.219 -1.941 1.00 0.00 H new ATOM 0 HA THR A 301 4.023 8.680 -0.689 1.00 0.00 H new ATOM 0 HB THR A 301 4.793 9.934 -3.296 1.00 0.00 H new ATOM 0 HG1 THR A 301 4.177 11.926 -2.158 1.00 0.00 H new ATOM 0 HG21 THR A 301 2.501 10.860 -3.299 1.00 0.00 H new ATOM 0 HG22 THR A 301 2.519 9.081 -3.344 1.00 0.00 H new ATOM 0 HG23 THR A 301 2.143 9.929 -1.825 1.00 0.00 H new ATOM 1132 N ILE A 302 3.745 6.505 -1.857 1.00 0.00 N ATOM 1133 CA ILE A 302 3.720 5.175 -2.441 1.00 0.00 C ATOM 1134 C ILE A 302 2.383 4.829 -3.081 1.00 0.00 C ATOM 1135 O ILE A 302 1.321 4.956 -2.465 1.00 0.00 O ATOM 1136 CB ILE A 302 4.076 4.094 -1.396 1.00 0.00 C ATOM 1137 CG1 ILE A 302 3.106 4.129 -0.211 1.00 0.00 C ATOM 1138 CG2 ILE A 302 5.501 4.286 -0.910 1.00 0.00 C ATOM 1139 CD1 ILE A 302 3.409 3.094 0.849 1.00 0.00 C ATOM 0 H ILE A 302 3.167 6.621 -1.024 1.00 0.00 H new ATOM 0 HA ILE A 302 4.474 5.189 -3.228 1.00 0.00 H new ATOM 0 HB ILE A 302 3.990 3.119 -1.875 1.00 0.00 H new ATOM 0 HG12 ILE A 302 3.134 5.120 0.242 1.00 0.00 H new ATOM 0 HG13 ILE A 302 2.091 3.975 -0.578 1.00 0.00 H new ATOM 0 HG21 ILE A 302 5.741 3.519 -0.174 1.00 0.00 H new ATOM 0 HG22 ILE A 302 6.187 4.207 -1.753 1.00 0.00 H new ATOM 0 HG23 ILE A 302 5.600 5.271 -0.453 1.00 0.00 H new ATOM 0 HD11 ILE A 302 2.682 3.177 1.657 1.00 0.00 H new ATOM 0 HD12 ILE A 302 3.352 2.097 0.411 1.00 0.00 H new ATOM 0 HD13 ILE A 302 4.411 3.260 1.244 1.00 0.00 H new ATOM 1151 N SER A 303 2.487 4.222 -4.248 1.00 0.00 N ATOM 1152 CA SER A 303 1.353 3.631 -4.930 1.00 0.00 C ATOM 1153 C SER A 303 1.635 2.150 -5.092 1.00 0.00 C ATOM 1154 O SER A 303 2.788 1.755 -5.059 1.00 0.00 O ATOM 1155 CB SER A 303 1.167 4.270 -6.306 1.00 0.00 C ATOM 1156 OG SER A 303 0.965 5.664 -6.198 1.00 0.00 O ATOM 0 H SER A 303 3.368 4.125 -4.753 1.00 0.00 H new ATOM 0 HA SER A 303 0.443 3.793 -4.353 1.00 0.00 H new ATOM 0 HB2 SER A 303 2.044 4.074 -6.923 1.00 0.00 H new ATOM 0 HB3 SER A 303 0.315 3.814 -6.810 1.00 0.00 H new ATOM 0 HG SER A 303 0.185 5.924 -6.732 1.00 0.00 H new ATOM 1162 N PRO A 304 0.620 1.298 -5.266 1.00 0.00 N ATOM 1163 CA PRO A 304 -0.788 1.690 -5.313 1.00 0.00 C ATOM 1164 C PRO A 304 -1.329 2.019 -3.925 1.00 0.00 C ATOM 1165 O PRO A 304 -0.579 2.068 -2.950 1.00 0.00 O ATOM 1166 CB PRO A 304 -1.496 0.450 -5.882 1.00 0.00 C ATOM 1167 CG PRO A 304 -0.413 -0.516 -6.254 1.00 0.00 C ATOM 1168 CD PRO A 304 0.789 -0.142 -5.436 1.00 0.00 C ATOM 0 HA PRO A 304 -0.942 2.588 -5.911 1.00 0.00 H new ATOM 0 HB2 PRO A 304 -2.170 0.014 -5.145 1.00 0.00 H new ATOM 0 HB3 PRO A 304 -2.100 0.711 -6.751 1.00 0.00 H new ATOM 0 HG2 PRO A 304 -0.720 -1.541 -6.047 1.00 0.00 H new ATOM 0 HG3 PRO A 304 -0.191 -0.459 -7.320 1.00 0.00 H new ATOM 0 HD2 PRO A 304 0.807 -0.664 -4.479 1.00 0.00 H new ATOM 0 HD3 PRO A 304 1.720 -0.384 -5.949 1.00 0.00 H new ATOM 1176 N LYS A 305 -2.631 2.237 -3.830 1.00 0.00 N ATOM 1177 CA LYS A 305 -3.246 2.547 -2.546 1.00 0.00 C ATOM 1178 C LYS A 305 -3.496 1.292 -1.721 1.00 0.00 C ATOM 1179 O LYS A 305 -3.679 0.199 -2.259 1.00 0.00 O ATOM 1180 CB LYS A 305 -4.518 3.387 -2.732 1.00 0.00 C ATOM 1181 CG LYS A 305 -5.418 2.948 -3.884 1.00 0.00 C ATOM 1182 CD LYS A 305 -6.067 1.593 -3.664 1.00 0.00 C ATOM 1183 CE LYS A 305 -6.879 1.177 -4.883 1.00 0.00 C ATOM 1184 NZ LYS A 305 -7.926 2.179 -5.233 1.00 0.00 N1+ ATOM 0 H LYS A 305 -3.278 2.206 -4.618 1.00 0.00 H new ATOM 0 HA LYS A 305 -2.541 3.153 -1.977 1.00 0.00 H new ATOM 0 HB2 LYS A 305 -5.095 3.355 -1.808 1.00 0.00 H new ATOM 0 HB3 LYS A 305 -4.229 4.426 -2.892 1.00 0.00 H new ATOM 0 HG2 LYS A 305 -6.197 3.696 -4.031 1.00 0.00 H new ATOM 0 HG3 LYS A 305 -4.830 2.916 -4.802 1.00 0.00 H new ATOM 0 HD2 LYS A 305 -5.300 0.846 -3.461 1.00 0.00 H new ATOM 0 HD3 LYS A 305 -6.713 1.633 -2.787 1.00 0.00 H new ATOM 0 HE2 LYS A 305 -6.211 1.041 -5.733 1.00 0.00 H new ATOM 0 HE3 LYS A 305 -7.351 0.213 -4.691 1.00 0.00 H new ATOM 0 HZ1 LYS A 305 -8.579 1.769 -5.931 1.00 0.00 H new ATOM 0 HZ2 LYS A 305 -8.454 2.443 -4.377 1.00 0.00 H new ATOM 0 HZ3 LYS A 305 -7.476 3.025 -5.636 1.00 0.00 H new ATOM 1198 N ILE A 306 -3.356 1.433 -0.412 1.00 0.00 N ATOM 1199 CA ILE A 306 -3.412 0.286 0.479 1.00 0.00 C ATOM 1200 C ILE A 306 -4.791 0.183 1.129 1.00 0.00 C ATOM 1201 O ILE A 306 -5.090 0.890 2.095 1.00 0.00 O ATOM 1202 CB ILE A 306 -2.317 0.345 1.591 1.00 0.00 C ATOM 1203 CG1 ILE A 306 -0.895 0.414 1.006 1.00 0.00 C ATOM 1204 CG2 ILE A 306 -2.415 -0.860 2.510 1.00 0.00 C ATOM 1205 CD1 ILE A 306 -0.534 1.733 0.355 1.00 0.00 C ATOM 0 H ILE A 306 -3.203 2.327 0.055 1.00 0.00 H new ATOM 0 HA ILE A 306 -3.223 -0.597 -0.131 1.00 0.00 H new ATOM 0 HB ILE A 306 -2.501 1.258 2.157 1.00 0.00 H new ATOM 0 HG12 ILE A 306 -0.180 0.212 1.804 1.00 0.00 H new ATOM 0 HG13 ILE A 306 -0.783 -0.381 0.268 1.00 0.00 H new ATOM 0 HG21 ILE A 306 -1.642 -0.797 3.276 1.00 0.00 H new ATOM 0 HG22 ILE A 306 -3.396 -0.877 2.984 1.00 0.00 H new ATOM 0 HG23 ILE A 306 -2.277 -1.772 1.930 1.00 0.00 H new ATOM 0 HD11 ILE A 306 0.486 1.683 -0.026 1.00 0.00 H new ATOM 0 HD12 ILE A 306 -1.220 1.932 -0.468 1.00 0.00 H new ATOM 0 HD13 ILE A 306 -0.608 2.534 1.091 1.00 0.00 H new ATOM 1217 N LEU A 307 -5.624 -0.705 0.599 1.00 0.00 N ATOM 1218 CA LEU A 307 -6.969 -0.904 1.131 1.00 0.00 C ATOM 1219 C LEU A 307 -7.124 -2.315 1.662 1.00 0.00 C ATOM 1220 O LEU A 307 -6.907 -3.275 0.932 1.00 0.00 O ATOM 1221 CB LEU A 307 -8.010 -0.652 0.046 1.00 0.00 C ATOM 1222 CG LEU A 307 -7.934 0.726 -0.588 1.00 0.00 C ATOM 1223 CD1 LEU A 307 -8.968 0.863 -1.690 1.00 0.00 C ATOM 1224 CD2 LEU A 307 -8.131 1.804 0.462 1.00 0.00 C ATOM 0 H LEU A 307 -5.393 -1.299 -0.198 1.00 0.00 H new ATOM 0 HA LEU A 307 -7.122 -0.197 1.946 1.00 0.00 H new ATOM 0 HB2 LEU A 307 -7.894 -1.404 -0.734 1.00 0.00 H new ATOM 0 HB3 LEU A 307 -9.003 -0.787 0.474 1.00 0.00 H new ATOM 0 HG LEU A 307 -6.944 0.849 -1.028 1.00 0.00 H new ATOM 0 HD11 LEU A 307 -8.899 1.857 -2.133 1.00 0.00 H new ATOM 0 HD12 LEU A 307 -8.784 0.111 -2.457 1.00 0.00 H new ATOM 0 HD13 LEU A 307 -9.965 0.720 -1.273 1.00 0.00 H new ATOM 0 HD21 LEU A 307 -8.074 2.785 -0.009 1.00 0.00 H new ATOM 0 HD22 LEU A 307 -9.108 1.682 0.929 1.00 0.00 H new ATOM 0 HD23 LEU A 307 -7.353 1.720 1.221 1.00 0.00 H new ATOM 1236 N PRO A 308 -7.423 -2.453 2.959 1.00 0.00 N ATOM 1237 CA PRO A 308 -7.520 -3.755 3.626 1.00 0.00 C ATOM 1238 C PRO A 308 -8.846 -4.463 3.381 1.00 0.00 C ATOM 1239 O PRO A 308 -9.912 -3.886 3.600 1.00 0.00 O ATOM 1240 CB PRO A 308 -7.409 -3.403 5.121 1.00 0.00 C ATOM 1241 CG PRO A 308 -7.052 -1.955 5.172 1.00 0.00 C ATOM 1242 CD PRO A 308 -7.607 -1.358 3.913 1.00 0.00 C ATOM 0 HA PRO A 308 -6.754 -4.436 3.255 1.00 0.00 H new ATOM 0 HB2 PRO A 308 -8.350 -3.592 5.638 1.00 0.00 H new ATOM 0 HB3 PRO A 308 -6.648 -4.011 5.610 1.00 0.00 H new ATOM 0 HG2 PRO A 308 -7.479 -1.477 6.054 1.00 0.00 H new ATOM 0 HG3 PRO A 308 -5.972 -1.819 5.227 1.00 0.00 H new ATOM 0 HD2 PRO A 308 -8.656 -1.080 4.020 1.00 0.00 H new ATOM 0 HD3 PRO A 308 -7.068 -0.459 3.614 1.00 0.00 H new ATOM 1250 N VAL A 309 -8.770 -5.770 3.178 1.00 0.00 N ATOM 1251 CA VAL A 309 -9.959 -6.603 3.205 1.00 0.00 C ATOM 1252 C VAL A 309 -10.285 -6.924 4.659 1.00 0.00 C ATOM 1253 O VAL A 309 -11.446 -7.061 5.045 1.00 0.00 O ATOM 1254 CB VAL A 309 -9.763 -7.920 2.418 1.00 0.00 C ATOM 1255 CG1 VAL A 309 -11.051 -8.729 2.388 1.00 0.00 C ATOM 1256 CG2 VAL A 309 -9.279 -7.638 1.005 1.00 0.00 C ATOM 0 H VAL A 309 -7.902 -6.273 2.994 1.00 0.00 H new ATOM 0 HA VAL A 309 -10.775 -6.058 2.730 1.00 0.00 H new ATOM 0 HB VAL A 309 -9.001 -8.508 2.930 1.00 0.00 H new ATOM 0 HG11 VAL A 309 -10.889 -9.651 1.829 1.00 0.00 H new ATOM 0 HG12 VAL A 309 -11.353 -8.971 3.407 1.00 0.00 H new ATOM 0 HG13 VAL A 309 -11.836 -8.146 1.906 1.00 0.00 H new ATOM 0 HG21 VAL A 309 -9.148 -8.579 0.471 1.00 0.00 H new ATOM 0 HG22 VAL A 309 -10.014 -7.024 0.484 1.00 0.00 H new ATOM 0 HG23 VAL A 309 -8.327 -7.108 1.045 1.00 0.00 H new ATOM 1266 N GLU A 310 -9.233 -6.981 5.472 1.00 0.00 N ATOM 1267 CA GLU A 310 -9.367 -7.224 6.900 1.00 0.00 C ATOM 1268 C GLU A 310 -9.649 -5.924 7.658 1.00 0.00 C ATOM 1269 O GLU A 310 -9.344 -5.811 8.846 1.00 0.00 O ATOM 1270 CB GLU A 310 -8.087 -7.863 7.439 1.00 0.00 C ATOM 1271 CG GLU A 310 -7.715 -9.163 6.744 1.00 0.00 C ATOM 1272 CD GLU A 310 -6.433 -9.756 7.276 1.00 0.00 C ATOM 1273 OE1 GLU A 310 -6.015 -10.817 6.770 1.00 0.00 O ATOM 1274 OE2 GLU A 310 -5.840 -9.165 8.198 1.00 0.00 O1- ATOM 0 H GLU A 310 -8.270 -6.860 5.159 1.00 0.00 H new ATOM 0 HA GLU A 310 -10.209 -7.900 7.051 1.00 0.00 H new ATOM 0 HB2 GLU A 310 -7.265 -7.155 7.332 1.00 0.00 H new ATOM 0 HB3 GLU A 310 -8.207 -8.053 8.506 1.00 0.00 H new ATOM 0 HG2 GLU A 310 -8.524 -9.883 6.869 1.00 0.00 H new ATOM 0 HG3 GLU A 310 -7.612 -8.983 5.674 1.00 0.00 H new ATOM 1281 N ASN A 311 -10.237 -4.951 6.971 1.00 0.00 N ATOM 1282 CA ASN A 311 -10.561 -3.672 7.591 1.00 0.00 C ATOM 1283 C ASN A 311 -11.938 -3.757 8.234 1.00 0.00 C ATOM 1284 O ASN A 311 -12.836 -4.410 7.701 1.00 0.00 O ATOM 1285 CB ASN A 311 -10.532 -2.548 6.545 1.00 0.00 C ATOM 1286 CG ASN A 311 -10.627 -1.157 7.153 1.00 0.00 C ATOM 1287 OD1 ASN A 311 -11.600 -0.815 7.817 1.00 0.00 O ATOM 1288 ND2 ASN A 311 -9.606 -0.345 6.929 1.00 0.00 N ATOM 0 H ASN A 311 -10.498 -5.023 5.988 1.00 0.00 H new ATOM 0 HA ASN A 311 -9.818 -3.447 8.356 1.00 0.00 H new ATOM 0 HB2 ASN A 311 -9.610 -2.622 5.968 1.00 0.00 H new ATOM 0 HB3 ASN A 311 -11.358 -2.689 5.847 1.00 0.00 H new ATOM 0 HD21 ASN A 311 -9.612 0.600 7.314 1.00 0.00 H new ATOM 0 HD22 ASN A 311 -8.813 -0.664 6.372 1.00 0.00 H new ATOM 1295 N THR A 312 -12.087 -3.133 9.395 1.00 0.00 N ATOM 1296 CA THR A 312 -13.338 -3.167 10.142 1.00 0.00 C ATOM 1297 C THR A 312 -14.487 -2.566 9.326 1.00 0.00 C ATOM 1298 O THR A 312 -15.640 -2.977 9.463 1.00 0.00 O ATOM 1299 CB THR A 312 -13.160 -2.409 11.459 1.00 0.00 C ATOM 1300 OG1 THR A 312 -12.049 -2.921 12.174 1.00 0.00 O ATOM 1301 CG2 THR A 312 -14.358 -2.494 12.376 1.00 0.00 C ATOM 0 H THR A 312 -11.348 -2.592 9.844 1.00 0.00 H new ATOM 0 HA THR A 312 -13.594 -4.205 10.352 1.00 0.00 H new ATOM 0 HB THR A 312 -13.017 -1.367 11.173 1.00 0.00 H new ATOM 0 HG1 THR A 312 -11.945 -2.427 13.014 1.00 0.00 H new ATOM 0 HG21 THR A 312 -14.158 -1.933 13.289 1.00 0.00 H new ATOM 0 HG22 THR A 312 -15.230 -2.073 11.875 1.00 0.00 H new ATOM 0 HG23 THR A 312 -14.551 -3.537 12.626 1.00 0.00 H new ATOM 1309 N ASP A 313 -14.159 -1.636 8.436 1.00 0.00 N ATOM 1310 CA ASP A 313 -15.155 -1.038 7.560 1.00 0.00 C ATOM 1311 C ASP A 313 -15.465 -1.974 6.401 1.00 0.00 C ATOM 1312 O ASP A 313 -14.600 -2.265 5.570 1.00 0.00 O ATOM 1313 CB ASP A 313 -14.674 0.318 7.038 1.00 0.00 C ATOM 1314 CG ASP A 313 -15.685 0.970 6.128 1.00 0.00 C ATOM 1315 OD1 ASP A 313 -16.835 1.170 6.565 1.00 0.00 O ATOM 1316 OD2 ASP A 313 -15.331 1.295 4.982 1.00 0.00 O1- ATOM 0 H ASP A 313 -13.212 -1.281 8.304 1.00 0.00 H new ATOM 0 HA ASP A 313 -16.067 -0.877 8.134 1.00 0.00 H new ATOM 0 HB2 ASP A 313 -14.468 0.978 7.881 1.00 0.00 H new ATOM 0 HB3 ASP A 313 -13.735 0.186 6.500 1.00 0.00 H new ATOM 1321 N VAL A 314 -16.691 -2.477 6.381 1.00 0.00 N ATOM 1322 CA VAL A 314 -17.122 -3.429 5.365 1.00 0.00 C ATOM 1323 C VAL A 314 -17.222 -2.757 3.991 1.00 0.00 C ATOM 1324 O VAL A 314 -17.205 -3.424 2.961 1.00 0.00 O ATOM 1325 CB VAL A 314 -18.484 -4.059 5.746 1.00 0.00 C ATOM 1326 CG1 VAL A 314 -18.892 -5.141 4.756 1.00 0.00 C ATOM 1327 CG2 VAL A 314 -18.437 -4.624 7.159 1.00 0.00 C ATOM 0 H VAL A 314 -17.411 -2.239 7.063 1.00 0.00 H new ATOM 0 HA VAL A 314 -16.373 -4.219 5.311 1.00 0.00 H new ATOM 0 HB VAL A 314 -19.235 -3.270 5.709 1.00 0.00 H new ATOM 0 HG11 VAL A 314 -19.852 -5.562 5.053 1.00 0.00 H new ATOM 0 HG12 VAL A 314 -18.978 -4.708 3.759 1.00 0.00 H new ATOM 0 HG13 VAL A 314 -18.138 -5.928 4.746 1.00 0.00 H new ATOM 0 HG21 VAL A 314 -19.403 -5.062 7.408 1.00 0.00 H new ATOM 0 HG22 VAL A 314 -17.665 -5.391 7.219 1.00 0.00 H new ATOM 0 HG23 VAL A 314 -18.209 -3.824 7.863 1.00 0.00 H new ATOM 1337 N ALA A 315 -17.320 -1.432 3.984 1.00 0.00 N ATOM 1338 CA ALA A 315 -17.423 -0.680 2.736 1.00 0.00 C ATOM 1339 C ALA A 315 -16.084 -0.594 2.000 1.00 0.00 C ATOM 1340 O ALA A 315 -16.042 -0.233 0.824 1.00 0.00 O ATOM 1341 CB ALA A 315 -17.962 0.716 3.006 1.00 0.00 C ATOM 0 H ALA A 315 -17.330 -0.856 4.826 1.00 0.00 H new ATOM 0 HA ALA A 315 -18.116 -1.219 2.090 1.00 0.00 H new ATOM 0 HB1 ALA A 315 -18.034 1.266 2.068 1.00 0.00 H new ATOM 0 HB2 ALA A 315 -18.950 0.643 3.460 1.00 0.00 H new ATOM 0 HB3 ALA A 315 -17.289 1.241 3.684 1.00 0.00 H new ATOM 1347 N SER A 316 -14.989 -0.853 2.704 1.00 0.00 N ATOM 1348 CA SER A 316 -13.660 -0.721 2.111 1.00 0.00 C ATOM 1349 C SER A 316 -13.113 -2.054 1.604 1.00 0.00 C ATOM 1350 O SER A 316 -12.180 -2.081 0.803 1.00 0.00 O ATOM 1351 CB SER A 316 -12.688 -0.122 3.127 1.00 0.00 C ATOM 1352 OG SER A 316 -13.110 1.168 3.533 1.00 0.00 O ATOM 0 H SER A 316 -14.992 -1.153 3.679 1.00 0.00 H new ATOM 0 HA SER A 316 -13.758 -0.057 1.252 1.00 0.00 H new ATOM 0 HB2 SER A 316 -12.616 -0.776 3.996 1.00 0.00 H new ATOM 0 HB3 SER A 316 -11.691 -0.062 2.690 1.00 0.00 H new ATOM 0 HG SER A 316 -13.997 1.107 3.945 1.00 0.00 H new ATOM 1358 N ARG A 317 -13.632 -3.157 2.134 1.00 0.00 N ATOM 1359 CA ARG A 317 -13.112 -4.480 1.788 1.00 0.00 C ATOM 1360 C ARG A 317 -13.509 -4.989 0.380 1.00 0.00 C ATOM 1361 O ARG A 317 -12.741 -5.752 -0.207 1.00 0.00 O ATOM 1362 CB ARG A 317 -13.475 -5.515 2.864 1.00 0.00 C ATOM 1363 CG ARG A 317 -14.962 -5.646 3.153 1.00 0.00 C ATOM 1364 CD ARG A 317 -15.220 -6.709 4.210 1.00 0.00 C ATOM 1365 NE ARG A 317 -14.567 -6.392 5.480 1.00 0.00 N ATOM 1366 CZ ARG A 317 -14.590 -7.195 6.545 1.00 0.00 C ATOM 1367 NH1 ARG A 317 -15.192 -8.374 6.475 1.00 0.00 N1+ ATOM 1368 NH2 ARG A 317 -13.996 -6.824 7.670 1.00 0.00 N ATOM 0 H ARG A 317 -14.405 -3.165 2.799 1.00 0.00 H new ATOM 0 HA ARG A 317 -12.030 -4.355 1.753 1.00 0.00 H new ATOM 0 HB2 ARG A 317 -13.093 -6.488 2.555 1.00 0.00 H new ATOM 0 HB3 ARG A 317 -12.962 -5.251 3.789 1.00 0.00 H new ATOM 0 HG2 ARG A 317 -15.356 -4.688 3.492 1.00 0.00 H new ATOM 0 HG3 ARG A 317 -15.493 -5.903 2.236 1.00 0.00 H new ATOM 0 HD2 ARG A 317 -16.294 -6.808 4.370 1.00 0.00 H new ATOM 0 HD3 ARG A 317 -14.861 -7.673 3.849 1.00 0.00 H new ATOM 0 HE ARG A 317 -14.066 -5.507 5.556 1.00 0.00 H new ATOM 0 HH11 ARG A 317 -15.638 -8.668 5.606 1.00 0.00 H new ATOM 0 HH12 ARG A 317 -15.209 -8.987 7.290 1.00 0.00 H new ATOM 0 HH21 ARG A 317 -13.520 -5.923 7.723 1.00 0.00 H new ATOM 0 HH22 ARG A 317 -14.015 -7.439 8.483 1.00 0.00 H new ATOM 1382 N PRO A 318 -14.699 -4.645 -0.193 1.00 0.00 N ATOM 1383 CA PRO A 318 -15.092 -5.166 -1.514 1.00 0.00 C ATOM 1384 C PRO A 318 -14.138 -4.735 -2.624 1.00 0.00 C ATOM 1385 O PRO A 318 -13.827 -5.512 -3.528 1.00 0.00 O ATOM 1386 CB PRO A 318 -16.480 -4.563 -1.761 1.00 0.00 C ATOM 1387 CG PRO A 318 -16.973 -4.147 -0.420 1.00 0.00 C ATOM 1388 CD PRO A 318 -15.755 -3.788 0.378 1.00 0.00 C ATOM 0 HA PRO A 318 -15.078 -6.256 -1.522 1.00 0.00 H new ATOM 0 HB2 PRO A 318 -16.424 -3.713 -2.440 1.00 0.00 H new ATOM 0 HB3 PRO A 318 -17.150 -5.292 -2.217 1.00 0.00 H new ATOM 0 HG2 PRO A 318 -17.651 -3.297 -0.500 1.00 0.00 H new ATOM 0 HG3 PRO A 318 -17.529 -4.954 0.058 1.00 0.00 H new ATOM 0 HD2 PRO A 318 -15.509 -2.731 0.280 1.00 0.00 H new ATOM 0 HD3 PRO A 318 -15.900 -3.985 1.440 1.00 0.00 H new ATOM 1396 N TYR A 319 -13.680 -3.493 -2.550 1.00 0.00 N ATOM 1397 CA TYR A 319 -12.767 -2.956 -3.550 1.00 0.00 C ATOM 1398 C TYR A 319 -11.394 -2.715 -2.944 1.00 0.00 C ATOM 1399 O TYR A 319 -10.747 -1.704 -3.220 1.00 0.00 O ATOM 1400 CB TYR A 319 -13.329 -1.658 -4.135 1.00 0.00 C ATOM 1401 CG TYR A 319 -14.664 -1.845 -4.820 1.00 0.00 C ATOM 1402 CD1 TYR A 319 -14.787 -2.681 -5.922 1.00 0.00 C ATOM 1403 CD2 TYR A 319 -15.800 -1.197 -4.357 1.00 0.00 C ATOM 1404 CE1 TYR A 319 -16.005 -2.865 -6.543 1.00 0.00 C ATOM 1405 CE2 TYR A 319 -17.021 -1.376 -4.976 1.00 0.00 C ATOM 1406 CZ TYR A 319 -17.119 -2.211 -6.067 1.00 0.00 C ATOM 1407 OH TYR A 319 -18.335 -2.396 -6.682 1.00 0.00 O ATOM 0 H TYR A 319 -13.926 -2.838 -1.808 1.00 0.00 H new ATOM 0 HA TYR A 319 -12.663 -3.685 -4.354 1.00 0.00 H new ATOM 0 HB2 TYR A 319 -13.437 -0.924 -3.337 1.00 0.00 H new ATOM 0 HB3 TYR A 319 -12.615 -1.249 -4.850 1.00 0.00 H new ATOM 0 HD1 TYR A 319 -13.915 -3.195 -6.299 1.00 0.00 H new ATOM 0 HD2 TYR A 319 -15.728 -0.543 -3.500 1.00 0.00 H new ATOM 0 HE1 TYR A 319 -16.084 -3.519 -7.399 1.00 0.00 H new ATOM 0 HE2 TYR A 319 -17.896 -0.863 -4.606 1.00 0.00 H new ATOM 0 HH TYR A 319 -19.018 -1.864 -6.223 1.00 0.00 H new ATOM 1417 N ALA A 320 -10.954 -3.655 -2.120 1.00 0.00 N ATOM 1418 CA ALA A 320 -9.655 -3.558 -1.474 1.00 0.00 C ATOM 1419 C ALA A 320 -8.538 -3.945 -2.435 1.00 0.00 C ATOM 1420 O ALA A 320 -8.778 -4.603 -3.450 1.00 0.00 O ATOM 1421 CB ALA A 320 -9.617 -4.435 -0.235 1.00 0.00 C ATOM 0 H ALA A 320 -11.480 -4.496 -1.883 1.00 0.00 H new ATOM 0 HA ALA A 320 -9.499 -2.521 -1.175 1.00 0.00 H new ATOM 0 HB1 ALA A 320 -8.639 -4.353 0.239 1.00 0.00 H new ATOM 0 HB2 ALA A 320 -10.387 -4.110 0.464 1.00 0.00 H new ATOM 0 HB3 ALA A 320 -9.797 -5.472 -0.518 1.00 0.00 H new ATOM 1427 N ASN A 321 -7.325 -3.512 -2.118 1.00 0.00 N ATOM 1428 CA ASN A 321 -6.166 -3.785 -2.962 1.00 0.00 C ATOM 1429 C ASN A 321 -5.204 -4.739 -2.266 1.00 0.00 C ATOM 1430 O ASN A 321 -4.439 -5.453 -2.917 1.00 0.00 O ATOM 1431 CB ASN A 321 -5.449 -2.476 -3.311 1.00 0.00 C ATOM 1432 CG ASN A 321 -4.246 -2.688 -4.210 1.00 0.00 C ATOM 1433 OD1 ASN A 321 -4.372 -3.210 -5.314 1.00 0.00 O ATOM 1434 ND2 ASN A 321 -3.073 -2.272 -3.751 1.00 0.00 N ATOM 0 H ASN A 321 -7.116 -2.969 -1.280 1.00 0.00 H new ATOM 0 HA ASN A 321 -6.513 -4.257 -3.881 1.00 0.00 H new ATOM 0 HB2 ASN A 321 -6.151 -1.802 -3.803 1.00 0.00 H new ATOM 0 HB3 ASN A 321 -5.128 -1.986 -2.392 1.00 0.00 H new ATOM 0 HD21 ASN A 321 -2.234 -2.381 -4.321 1.00 0.00 H new ATOM 0 HD22 ASN A 321 -3.010 -1.843 -2.828 1.00 0.00 H new ATOM 1441 N VAL A 322 -5.249 -4.748 -0.942 1.00 0.00 N ATOM 1442 CA VAL A 322 -4.386 -5.614 -0.153 1.00 0.00 C ATOM 1443 C VAL A 322 -5.178 -6.307 0.949 1.00 0.00 C ATOM 1444 O VAL A 322 -6.334 -5.965 1.202 1.00 0.00 O ATOM 1445 CB VAL A 322 -3.220 -4.824 0.488 1.00 0.00 C ATOM 1446 CG1 VAL A 322 -2.359 -4.160 -0.574 1.00 0.00 C ATOM 1447 CG2 VAL A 322 -3.747 -3.791 1.470 1.00 0.00 C ATOM 0 H VAL A 322 -5.876 -4.163 -0.390 1.00 0.00 H new ATOM 0 HA VAL A 322 -3.975 -6.359 -0.834 1.00 0.00 H new ATOM 0 HB VAL A 322 -2.596 -5.532 1.033 1.00 0.00 H new ATOM 0 HG11 VAL A 322 -1.548 -3.612 -0.095 1.00 0.00 H new ATOM 0 HG12 VAL A 322 -1.943 -4.922 -1.233 1.00 0.00 H new ATOM 0 HG13 VAL A 322 -2.968 -3.469 -1.157 1.00 0.00 H new ATOM 0 HG21 VAL A 322 -2.911 -3.247 1.909 1.00 0.00 H new ATOM 0 HG22 VAL A 322 -4.400 -3.092 0.947 1.00 0.00 H new ATOM 0 HG23 VAL A 322 -4.308 -4.292 2.259 1.00 0.00 H new ATOM 1457 N ASP A 323 -4.535 -7.237 1.642 1.00 0.00 N ATOM 1458 CA ASP A 323 -5.169 -7.919 2.762 1.00 0.00 C ATOM 1459 C ASP A 323 -5.409 -6.951 3.910 1.00 0.00 C ATOM 1460 O ASP A 323 -6.500 -6.909 4.477 1.00 0.00 O ATOM 1461 CB ASP A 323 -4.310 -9.085 3.267 1.00 0.00 C ATOM 1462 CG ASP A 323 -4.161 -10.202 2.261 1.00 0.00 C ATOM 1463 OD1 ASP A 323 -3.477 -11.193 2.580 1.00 0.00 O ATOM 1464 OD2 ASP A 323 -4.744 -10.107 1.167 1.00 0.00 O1- ATOM 0 H ASP A 323 -3.579 -7.536 1.450 1.00 0.00 H new ATOM 0 HA ASP A 323 -6.121 -8.311 2.404 1.00 0.00 H new ATOM 0 HB2 ASP A 323 -3.321 -8.710 3.531 1.00 0.00 H new ATOM 0 HB3 ASP A 323 -4.753 -9.485 4.179 1.00 0.00 H new ATOM 1469 N ALA A 324 -4.367 -6.210 4.276 1.00 0.00 N ATOM 1470 CA ALA A 324 -4.430 -5.283 5.399 1.00 0.00 C ATOM 1471 C ALA A 324 -3.170 -4.443 5.500 1.00 0.00 C ATOM 1472 O ALA A 324 -2.190 -4.686 4.796 1.00 0.00 O ATOM 1473 CB ALA A 324 -4.619 -6.042 6.702 1.00 0.00 C ATOM 0 H ALA A 324 -3.462 -6.235 3.806 1.00 0.00 H new ATOM 0 HA ALA A 324 -5.280 -4.623 5.225 1.00 0.00 H new ATOM 0 HB1 ALA A 324 -4.664 -5.336 7.531 1.00 0.00 H new ATOM 0 HB2 ALA A 324 -5.547 -6.612 6.660 1.00 0.00 H new ATOM 0 HB3 ALA A 324 -3.781 -6.723 6.851 1.00 0.00 H new ATOM 1479 N LYS A 325 -3.151 -3.566 6.495 1.00 0.00 N ATOM 1480 CA LYS A 325 -1.950 -2.820 6.833 1.00 0.00 C ATOM 1481 C LYS A 325 -1.634 -2.992 8.322 1.00 0.00 C ATOM 1482 O LYS A 325 -2.360 -2.499 9.186 1.00 0.00 O ATOM 1483 CB LYS A 325 -2.107 -1.334 6.469 1.00 0.00 C ATOM 1484 CG LYS A 325 -3.315 -0.650 7.104 1.00 0.00 C ATOM 1485 CD LYS A 325 -3.386 0.826 6.739 1.00 0.00 C ATOM 1486 CE LYS A 325 -3.575 1.034 5.247 1.00 0.00 C ATOM 1487 NZ LYS A 325 -4.862 0.464 4.768 1.00 0.00 N1+ ATOM 0 H LYS A 325 -3.957 -3.355 7.083 1.00 0.00 H new ATOM 0 HA LYS A 325 -1.116 -3.214 6.252 1.00 0.00 H new ATOM 0 HB2 LYS A 325 -1.205 -0.802 6.770 1.00 0.00 H new ATOM 0 HB3 LYS A 325 -2.183 -1.245 5.385 1.00 0.00 H new ATOM 0 HG2 LYS A 325 -4.228 -1.149 6.779 1.00 0.00 H new ATOM 0 HG3 LYS A 325 -3.264 -0.754 8.188 1.00 0.00 H new ATOM 0 HD2 LYS A 325 -4.210 1.293 7.278 1.00 0.00 H new ATOM 0 HD3 LYS A 325 -2.471 1.324 7.062 1.00 0.00 H new ATOM 0 HE2 LYS A 325 -3.544 2.100 5.022 1.00 0.00 H new ATOM 0 HE3 LYS A 325 -2.749 0.570 4.708 1.00 0.00 H new ATOM 0 HZ1 LYS A 325 -5.153 0.949 3.895 1.00 0.00 H new ATOM 0 HZ2 LYS A 325 -4.742 -0.551 4.577 1.00 0.00 H new ATOM 0 HZ3 LYS A 325 -5.592 0.595 5.497 1.00 0.00 H new ATOM 1501 N PRO A 326 -0.592 -3.772 8.642 1.00 0.00 N ATOM 1502 CA PRO A 326 -0.240 -4.088 10.031 1.00 0.00 C ATOM 1503 C PRO A 326 0.510 -2.952 10.715 1.00 0.00 C ATOM 1504 O PRO A 326 1.013 -2.045 10.053 1.00 0.00 O ATOM 1505 CB PRO A 326 0.664 -5.311 9.894 1.00 0.00 C ATOM 1506 CG PRO A 326 1.292 -5.170 8.549 1.00 0.00 C ATOM 1507 CD PRO A 326 0.274 -4.481 7.677 1.00 0.00 C ATOM 0 HA PRO A 326 -1.124 -4.256 10.646 1.00 0.00 H new ATOM 0 HB2 PRO A 326 1.417 -5.337 10.682 1.00 0.00 H new ATOM 0 HB3 PRO A 326 0.092 -6.236 9.969 1.00 0.00 H new ATOM 0 HG2 PRO A 326 2.211 -4.587 8.608 1.00 0.00 H new ATOM 0 HG3 PRO A 326 1.558 -6.145 8.140 1.00 0.00 H new ATOM 0 HD2 PRO A 326 0.747 -3.789 6.980 1.00 0.00 H new ATOM 0 HD3 PRO A 326 -0.293 -5.197 7.081 1.00 0.00 H new ATOM 1515 N ALA A 327 0.633 -3.042 12.037 1.00 0.00 N ATOM 1516 CA ALA A 327 1.386 -2.059 12.808 1.00 0.00 C ATOM 1517 C ALA A 327 2.850 -2.079 12.394 1.00 0.00 C ATOM 1518 O ALA A 327 3.437 -3.157 12.258 1.00 0.00 O ATOM 1519 CB ALA A 327 1.253 -2.330 14.299 1.00 0.00 C ATOM 0 H ALA A 327 0.220 -3.788 12.597 1.00 0.00 H new ATOM 0 HA ALA A 327 0.976 -1.070 12.603 1.00 0.00 H new ATOM 0 HB1 ALA A 327 1.822 -1.586 14.856 1.00 0.00 H new ATOM 0 HB2 ALA A 327 0.203 -2.274 14.587 1.00 0.00 H new ATOM 0 HB3 ALA A 327 1.639 -3.324 14.524 1.00 0.00 H new ATOM 1525 N GLU A 328 3.389 -0.892 12.097 1.00 0.00 N ATOM 1526 CA GLU A 328 4.751 -0.738 11.569 1.00 0.00 C ATOM 1527 C GLU A 328 4.817 -1.196 10.113 1.00 0.00 C ATOM 1528 O GLU A 328 4.097 -2.109 9.703 1.00 0.00 O ATOM 1529 CB GLU A 328 5.784 -1.499 12.411 1.00 0.00 C ATOM 1530 CG GLU A 328 5.839 -1.059 13.865 1.00 0.00 C ATOM 1531 CD GLU A 328 6.917 -1.777 14.638 1.00 0.00 C ATOM 1532 OE1 GLU A 328 8.096 -1.647 14.258 1.00 0.00 O ATOM 1533 OE2 GLU A 328 6.590 -2.478 15.614 1.00 0.00 O1- ATOM 0 H GLU A 328 2.893 -0.009 12.216 1.00 0.00 H new ATOM 0 HA GLU A 328 4.999 0.322 11.622 1.00 0.00 H new ATOM 0 HB2 GLU A 328 5.556 -2.564 12.372 1.00 0.00 H new ATOM 0 HB3 GLU A 328 6.770 -1.368 11.965 1.00 0.00 H new ATOM 0 HG2 GLU A 328 6.016 0.016 13.911 1.00 0.00 H new ATOM 0 HG3 GLU A 328 4.873 -1.243 14.335 1.00 0.00 H new ATOM 1540 N SER A 329 5.601 -0.497 9.308 1.00 0.00 N ATOM 1541 CA SER A 329 5.646 -0.778 7.879 1.00 0.00 C ATOM 1542 C SER A 329 6.478 -2.019 7.583 1.00 0.00 C ATOM 1543 O SER A 329 6.243 -2.688 6.580 1.00 0.00 O ATOM 1544 CB SER A 329 6.198 0.417 7.130 1.00 0.00 C ATOM 1545 OG SER A 329 5.485 1.595 7.464 1.00 0.00 O ATOM 0 H SER A 329 6.210 0.262 9.614 1.00 0.00 H new ATOM 0 HA SER A 329 4.628 -0.971 7.541 1.00 0.00 H new ATOM 0 HB2 SER A 329 7.254 0.546 7.369 1.00 0.00 H new ATOM 0 HB3 SER A 329 6.134 0.240 6.056 1.00 0.00 H new ATOM 0 HG SER A 329 4.562 1.521 7.143 1.00 0.00 H new ATOM 1551 N ALA A 330 7.374 -2.366 8.514 1.00 0.00 N ATOM 1552 CA ALA A 330 8.164 -3.603 8.434 1.00 0.00 C ATOM 1553 C ALA A 330 9.271 -3.527 7.389 1.00 0.00 C ATOM 1554 O ALA A 330 9.679 -2.443 6.969 1.00 0.00 O ATOM 1555 CB ALA A 330 7.259 -4.796 8.155 1.00 0.00 C ATOM 0 H ALA A 330 7.572 -1.802 9.340 1.00 0.00 H new ATOM 0 HA ALA A 330 8.646 -3.732 9.403 1.00 0.00 H new ATOM 0 HB1 ALA A 330 7.860 -5.703 8.099 1.00 0.00 H new ATOM 0 HB2 ALA A 330 6.528 -4.894 8.958 1.00 0.00 H new ATOM 0 HB3 ALA A 330 6.740 -4.646 7.208 1.00 0.00 H new ATOM 1561 N ALA A 331 9.779 -4.699 7.011 1.00 0.00 N ATOM 1562 CA ALA A 331 10.873 -4.800 6.051 1.00 0.00 C ATOM 1563 C ALA A 331 10.358 -4.688 4.628 1.00 0.00 C ATOM 1564 O ALA A 331 9.237 -5.102 4.327 1.00 0.00 O ATOM 1565 CB ALA A 331 11.622 -6.109 6.230 1.00 0.00 C ATOM 0 H ALA A 331 9.446 -5.598 7.359 1.00 0.00 H new ATOM 0 HA ALA A 331 11.558 -3.973 6.237 1.00 0.00 H new ATOM 0 HB1 ALA A 331 12.434 -6.166 5.505 1.00 0.00 H new ATOM 0 HB2 ALA A 331 12.032 -6.159 7.239 1.00 0.00 H new ATOM 0 HB3 ALA A 331 10.938 -6.944 6.075 1.00 0.00 H new ATOM 1571 N ILE A 332 11.163 -4.085 3.770 1.00 0.00 N ATOM 1572 CA ILE A 332 10.773 -3.858 2.391 1.00 0.00 C ATOM 1573 C ILE A 332 11.676 -4.647 1.451 1.00 0.00 C ATOM 1574 O ILE A 332 12.870 -4.784 1.706 1.00 0.00 O ATOM 1575 CB ILE A 332 10.857 -2.357 2.045 1.00 0.00 C ATOM 1576 CG1 ILE A 332 10.151 -1.528 3.112 1.00 0.00 C ATOM 1577 CG2 ILE A 332 10.225 -2.086 0.695 1.00 0.00 C ATOM 1578 CD1 ILE A 332 8.685 -1.862 3.269 1.00 0.00 C ATOM 0 H ILE A 332 12.094 -3.743 4.006 1.00 0.00 H new ATOM 0 HA ILE A 332 9.743 -4.194 2.268 1.00 0.00 H new ATOM 0 HB ILE A 332 11.909 -2.075 2.008 1.00 0.00 H new ATOM 0 HG12 ILE A 332 10.653 -1.678 4.068 1.00 0.00 H new ATOM 0 HG13 ILE A 332 10.249 -0.471 2.863 1.00 0.00 H new ATOM 0 HG21 ILE A 332 10.294 -1.022 0.468 1.00 0.00 H new ATOM 0 HG22 ILE A 332 10.749 -2.655 -0.073 1.00 0.00 H new ATOM 0 HG23 ILE A 332 9.177 -2.385 0.717 1.00 0.00 H new ATOM 0 HD11 ILE A 332 8.250 -1.233 4.045 1.00 0.00 H new ATOM 0 HD12 ILE A 332 8.168 -1.685 2.326 1.00 0.00 H new ATOM 0 HD13 ILE A 332 8.579 -2.910 3.549 1.00 0.00 H new ATOM 1590 N THR A 333 11.111 -5.144 0.360 1.00 0.00 N ATOM 1591 CA THR A 333 11.891 -5.900 -0.617 1.00 0.00 C ATOM 1592 C THR A 333 12.064 -5.085 -1.892 1.00 0.00 C ATOM 1593 O THR A 333 11.153 -5.013 -2.711 1.00 0.00 O ATOM 1594 CB THR A 333 11.202 -7.229 -0.932 1.00 0.00 C ATOM 1595 OG1 THR A 333 11.004 -7.987 0.248 1.00 0.00 O ATOM 1596 CG2 THR A 333 11.979 -8.096 -1.896 1.00 0.00 C ATOM 0 H THR A 333 10.123 -5.040 0.127 1.00 0.00 H new ATOM 0 HA THR A 333 12.874 -6.108 -0.194 1.00 0.00 H new ATOM 0 HB THR A 333 10.254 -6.953 -1.393 1.00 0.00 H new ATOM 0 HG1 THR A 333 10.561 -8.832 0.024 1.00 0.00 H new ATOM 0 HG21 THR A 333 11.432 -9.022 -2.074 1.00 0.00 H new ATOM 0 HG22 THR A 333 12.110 -7.565 -2.839 1.00 0.00 H new ATOM 0 HG23 THR A 333 12.956 -8.327 -1.471 1.00 0.00 H new ATOM 1604 N ILE A 334 13.196 -4.405 -2.012 1.00 0.00 N ATOM 1605 CA ILE A 334 13.438 -3.508 -3.139 1.00 0.00 C ATOM 1606 C ILE A 334 13.909 -4.265 -4.379 1.00 0.00 C ATOM 1607 O ILE A 334 14.888 -5.012 -4.323 1.00 0.00 O ATOM 1608 CB ILE A 334 14.489 -2.436 -2.766 1.00 0.00 C ATOM 1609 CG1 ILE A 334 14.015 -1.624 -1.562 1.00 0.00 C ATOM 1610 CG2 ILE A 334 14.762 -1.509 -3.943 1.00 0.00 C ATOM 1611 CD1 ILE A 334 12.758 -0.832 -1.834 1.00 0.00 C ATOM 0 H ILE A 334 13.964 -4.456 -1.343 1.00 0.00 H new ATOM 0 HA ILE A 334 12.488 -3.026 -3.371 1.00 0.00 H new ATOM 0 HB ILE A 334 15.416 -2.948 -2.508 1.00 0.00 H new ATOM 0 HG12 ILE A 334 13.837 -2.299 -0.725 1.00 0.00 H new ATOM 0 HG13 ILE A 334 14.808 -0.941 -1.258 1.00 0.00 H new ATOM 0 HG21 ILE A 334 15.504 -0.764 -3.655 1.00 0.00 H new ATOM 0 HG22 ILE A 334 15.139 -2.091 -4.784 1.00 0.00 H new ATOM 0 HG23 ILE A 334 13.839 -1.008 -4.233 1.00 0.00 H new ATOM 0 HD11 ILE A 334 12.476 -0.278 -0.938 1.00 0.00 H new ATOM 0 HD12 ILE A 334 12.938 -0.133 -2.651 1.00 0.00 H new ATOM 0 HD13 ILE A 334 11.952 -1.512 -2.109 1.00 0.00 H new ATOM 1623 N LEU A 335 13.272 -3.989 -5.517 1.00 0.00 N ATOM 1624 CA LEU A 335 13.700 -4.557 -6.790 1.00 0.00 C ATOM 1625 C LEU A 335 13.231 -3.693 -7.960 1.00 0.00 C ATOM 1626 O LEU A 335 12.054 -3.339 -8.066 1.00 0.00 O ATOM 1627 CB LEU A 335 13.210 -6.007 -6.983 1.00 0.00 C ATOM 1628 CG LEU A 335 11.688 -6.237 -7.078 1.00 0.00 C ATOM 1629 CD1 LEU A 335 11.399 -7.683 -7.436 1.00 0.00 C ATOM 1630 CD2 LEU A 335 10.980 -5.892 -5.779 1.00 0.00 C ATOM 0 H LEU A 335 12.459 -3.376 -5.581 1.00 0.00 H new ATOM 0 HA LEU A 335 14.790 -4.575 -6.769 1.00 0.00 H new ATOM 0 HB2 LEU A 335 13.667 -6.398 -7.892 1.00 0.00 H new ATOM 0 HB3 LEU A 335 13.589 -6.604 -6.153 1.00 0.00 H new ATOM 0 HG LEU A 335 11.309 -5.576 -7.858 1.00 0.00 H new ATOM 0 HD11 LEU A 335 10.321 -7.834 -7.500 1.00 0.00 H new ATOM 0 HD12 LEU A 335 11.856 -7.918 -8.397 1.00 0.00 H new ATOM 0 HD13 LEU A 335 11.812 -8.337 -6.668 1.00 0.00 H new ATOM 0 HD21 LEU A 335 9.910 -6.068 -5.890 1.00 0.00 H new ATOM 0 HD22 LEU A 335 11.370 -6.517 -4.975 1.00 0.00 H new ATOM 0 HD23 LEU A 335 11.152 -4.843 -5.539 1.00 0.00 H new ATOM 1642 N ASN A 336 14.149 -3.414 -8.872 1.00 0.00 N ATOM 1643 CA ASN A 336 13.825 -2.660 -10.076 1.00 0.00 C ATOM 1644 C ASN A 336 13.514 -3.603 -11.225 1.00 0.00 C ATOM 1645 O ASN A 336 14.097 -3.499 -12.306 1.00 0.00 O ATOM 1646 CB ASN A 336 14.969 -1.726 -10.469 1.00 0.00 C ATOM 1647 CG ASN A 336 15.219 -0.657 -9.433 1.00 0.00 C ATOM 1648 OD1 ASN A 336 14.331 0.140 -9.125 1.00 0.00 O ATOM 1649 ND2 ASN A 336 16.426 -0.628 -8.894 1.00 0.00 N ATOM 0 H ASN A 336 15.126 -3.698 -8.802 1.00 0.00 H new ATOM 0 HA ASN A 336 12.945 -2.054 -9.861 1.00 0.00 H new ATOM 0 HB2 ASN A 336 15.878 -2.310 -10.612 1.00 0.00 H new ATOM 0 HB3 ASN A 336 14.739 -1.255 -11.425 1.00 0.00 H new ATOM 0 HD21 ASN A 336 16.654 0.075 -8.191 1.00 0.00 H new ATOM 0 HD22 ASN A 336 17.129 -1.309 -9.181 1.00 0.00 H new ATOM 1656 N LYS A 337 12.599 -4.527 -10.983 1.00 0.00 N ATOM 1657 CA LYS A 337 12.210 -5.495 -11.993 1.00 0.00 C ATOM 1658 C LYS A 337 10.914 -5.044 -12.659 1.00 0.00 C ATOM 1659 O LYS A 337 10.141 -4.316 -12.007 1.00 0.00 O ATOM 1660 CB LYS A 337 12.037 -6.880 -11.360 1.00 0.00 C ATOM 1661 CG LYS A 337 11.781 -7.997 -12.361 1.00 0.00 C ATOM 1662 CD LYS A 337 12.942 -8.146 -13.333 1.00 0.00 C ATOM 1663 CE LYS A 337 12.703 -9.273 -14.325 1.00 0.00 C ATOM 1664 NZ LYS A 337 13.824 -9.405 -15.296 1.00 0.00 N1+ ATOM 0 H LYS A 337 12.111 -4.627 -10.093 1.00 0.00 H new ATOM 0 HA LYS A 337 12.992 -5.561 -12.749 1.00 0.00 H new ATOM 0 HB2 LYS A 337 12.933 -7.119 -10.787 1.00 0.00 H new ATOM 0 HB3 LYS A 337 11.207 -6.843 -10.654 1.00 0.00 H new ATOM 0 HG2 LYS A 337 11.626 -8.936 -11.829 1.00 0.00 H new ATOM 0 HG3 LYS A 337 10.865 -7.789 -12.914 1.00 0.00 H new ATOM 0 HD2 LYS A 337 13.087 -7.210 -13.873 1.00 0.00 H new ATOM 0 HD3 LYS A 337 13.860 -8.339 -12.777 1.00 0.00 H new ATOM 0 HE2 LYS A 337 12.578 -10.212 -13.785 1.00 0.00 H new ATOM 0 HE3 LYS A 337 11.774 -9.090 -14.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 337 13.623 -10.184 -15.955 1.00 0.00 H new ATOM 0 HZ2 LYS A 337 13.927 -8.518 -15.830 1.00 0.00 H new ATOM 0 HZ3 LYS A 337 14.706 -9.605 -14.783 1.00 0.00 H new