USER MOD reduce.3.24.130724 H: found=0, std=0, add=590, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 498 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 Single : A 81 HIS : no HD1:sc= -17.5! C(o=-18!,f=-17!) USER MOD Single : A 85 SER OG : rot 108:sc= 0.224 USER MOD Single : A 87 MET CE :methyl -116:sc= 0 (180deg=-0.0459) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 TYR OH : rot -169:sc=0.000842 USER MOD Single : A 94 THR OG1 : rot 117:sc= 0.48 USER MOD Single : A 96 SER OG : rot -151:sc= -1.09 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 ASN : amide:sc= -1.36 K(o=-1.4,f=-9.7!) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0.00574 USER MOD Single : A 116 CYS SG : rot -140:sc= -2.65 USER MOD Single : A 121 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 124 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 125 ASN :FLIP amide:sc= -0.083 F(o=-0.63,f=-0.083) USER MOD Single : A 126 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 131 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0122) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 134 THR OG1 : rot 180:sc= -0.234 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD Single : A 144 GLN :FLIP amide:sc= -1.23 F(o=-5,f=-1.2) USER MOD ----------------------------------------------------------------- ATOM 130 N HIS A 81 -5.466 8.082 2.483 1.00 1.00 N ATOM 131 CA HIS A 81 -5.620 6.971 3.407 1.00 1.00 C ATOM 132 C HIS A 81 -4.242 6.451 3.819 1.00 1.00 C ATOM 133 O HIS A 81 -3.244 6.737 3.159 1.00 1.00 O ATOM 134 CB HIS A 81 -6.510 5.883 2.804 1.00 1.00 C ATOM 135 CG HIS A 81 -5.792 4.960 1.849 1.00 1.00 C ATOM 136 ND1 HIS A 81 -4.679 4.223 2.214 1.00 1.00 N ATOM 137 CD2 HIS A 81 -6.038 4.664 0.540 1.00 1.00 C ATOM 138 CE1 HIS A 81 -4.282 3.518 1.164 1.00 1.00 C ATOM 139 NE2 HIS A 81 -5.124 3.794 0.128 1.00 1.00 N ATOM 0 HA HIS A 81 -6.125 7.312 4.311 1.00 1.00 H new ATOM 0 HB2 HIS A 81 -6.939 5.290 3.612 1.00 1.00 H new ATOM 0 HB3 HIS A 81 -7.340 6.356 2.280 1.00 1.00 H new ATOM 0 HD2 HIS A 81 -6.840 5.069 -0.059 1.00 1.00 H new ATOM 0 HE1 HIS A 81 -3.439 2.843 1.134 1.00 1.00 H new ATOM 0 HE2 HIS A 81 -5.062 3.397 -0.810 1.00 1.00 H new ATOM 146 N ILE A 82 -4.231 5.694 4.906 1.00 1.00 N ATOM 147 CA ILE A 82 -2.992 5.131 5.413 1.00 1.00 C ATOM 148 C ILE A 82 -3.151 3.617 5.567 1.00 1.00 C ATOM 149 O ILE A 82 -4.059 3.151 6.253 1.00 1.00 O ATOM 150 CB ILE A 82 -2.568 5.838 6.701 1.00 1.00 C ATOM 151 CG1 ILE A 82 -2.580 7.357 6.521 1.00 1.00 C ATOM 152 CG2 ILE A 82 -1.209 5.330 7.186 1.00 1.00 C ATOM 153 CD1 ILE A 82 -1.434 7.811 5.615 1.00 1.00 C ATOM 0 H ILE A 82 -5.061 5.457 5.450 1.00 1.00 H new ATOM 0 HA ILE A 82 -2.181 5.297 4.704 1.00 1.00 H new ATOM 0 HB ILE A 82 -3.296 5.598 7.476 1.00 1.00 H new ATOM 0 HG12 ILE A 82 -3.532 7.668 6.092 1.00 1.00 H new ATOM 0 HG13 ILE A 82 -2.494 7.843 7.493 1.00 1.00 H new ATOM 0 HG21 ILE A 82 -0.932 5.850 8.103 1.00 1.00 H new ATOM 0 HG22 ILE A 82 -1.269 4.259 7.380 1.00 1.00 H new ATOM 0 HG23 ILE A 82 -0.456 5.519 6.421 1.00 1.00 H new ATOM 0 HD11 ILE A 82 -1.466 8.895 5.504 1.00 1.00 H new ATOM 0 HD12 ILE A 82 -0.482 7.519 6.059 1.00 1.00 H new ATOM 0 HD13 ILE A 82 -1.537 7.343 4.636 1.00 1.00 H new ATOM 164 N VAL A 83 -2.253 2.890 4.916 1.00 1.00 N ATOM 165 CA VAL A 83 -2.282 1.438 4.972 1.00 1.00 C ATOM 166 C VAL A 83 -1.334 0.955 6.073 1.00 1.00 C ATOM 167 O VAL A 83 -0.131 1.203 6.012 1.00 1.00 O ATOM 168 CB VAL A 83 -1.950 0.855 3.598 1.00 1.00 C ATOM 169 CG1 VAL A 83 -1.492 -0.600 3.716 1.00 1.00 C ATOM 170 CG2 VAL A 83 -3.142 0.979 2.647 1.00 1.00 C ATOM 0 H VAL A 83 -1.501 3.280 4.347 1.00 1.00 H new ATOM 0 HA VAL A 83 -3.281 1.085 5.226 1.00 1.00 H new ATOM 0 HB VAL A 83 -1.126 1.433 3.179 1.00 1.00 H new ATOM 0 HG11 VAL A 83 -1.262 -0.991 2.725 1.00 1.00 H new ATOM 0 HG12 VAL A 83 -0.601 -0.651 4.342 1.00 1.00 H new ATOM 0 HG13 VAL A 83 -2.286 -1.196 4.166 1.00 1.00 H new ATOM 0 HG21 VAL A 83 -2.879 0.557 1.677 1.00 1.00 H new ATOM 0 HG22 VAL A 83 -3.994 0.438 3.059 1.00 1.00 H new ATOM 0 HG23 VAL A 83 -3.403 2.030 2.526 1.00 1.00 H new ATOM 180 N ARG A 84 -1.913 0.276 7.052 1.00 1.00 N ATOM 181 CA ARG A 84 -1.134 -0.244 8.162 1.00 1.00 C ATOM 182 C ARG A 84 -1.040 -1.769 8.078 1.00 1.00 C ATOM 183 O ARG A 84 -2.052 -2.449 7.916 1.00 1.00 O ATOM 184 CB ARG A 84 -1.759 0.147 9.504 1.00 1.00 C ATOM 185 CG ARG A 84 -1.803 1.668 9.665 1.00 1.00 C ATOM 186 CD ARG A 84 -2.151 2.057 11.103 1.00 1.00 C ATOM 187 NE ARG A 84 -3.589 1.812 11.360 1.00 1.00 N ATOM 188 CZ ARG A 84 -4.588 2.542 10.823 1.00 1.00 C ATOM 189 NH1 ARG A 84 -4.316 3.572 9.994 1.00 1.00 N ATOM 190 NH2 ARG A 84 -5.837 2.235 11.121 1.00 1.00 N ATOM 0 H ARG A 84 -2.912 0.074 7.099 1.00 1.00 H new ATOM 0 HA ARG A 84 -0.136 0.189 8.097 1.00 1.00 H new ATOM 0 HB2 ARG A 84 -2.768 -0.259 9.571 1.00 1.00 H new ATOM 0 HB3 ARG A 84 -1.184 -0.292 10.319 1.00 1.00 H new ATOM 0 HG2 ARG A 84 -0.837 2.094 9.393 1.00 1.00 H new ATOM 0 HG3 ARG A 84 -2.541 2.088 8.982 1.00 1.00 H new ATOM 0 HD2 ARG A 84 -1.545 1.480 11.801 1.00 1.00 H new ATOM 0 HD3 ARG A 84 -1.917 3.108 11.271 1.00 1.00 H new ATOM 0 HE ARG A 84 -3.839 1.043 11.982 1.00 1.00 H new ATOM 0 HH11 ARG A 84 -3.349 3.804 9.769 1.00 1.00 H new ATOM 0 HH12 ARG A 84 -5.078 4.118 9.593 1.00 1.00 H new ATOM 0 HH21 ARG A 84 -6.035 1.456 11.749 1.00 1.00 H new ATOM 0 HH22 ARG A 84 -6.604 2.777 10.723 1.00 1.00 H new ATOM 199 N SER A 85 0.185 -2.260 8.191 1.00 1.00 N ATOM 200 CA SER A 85 0.425 -3.692 8.129 1.00 1.00 C ATOM 201 C SER A 85 -0.511 -4.423 9.094 1.00 1.00 C ATOM 202 O SER A 85 -0.320 -4.371 10.307 1.00 1.00 O ATOM 203 CB SER A 85 1.883 -4.021 8.453 1.00 1.00 C ATOM 204 OG SER A 85 2.581 -2.895 8.975 1.00 1.00 O ATOM 0 H SER A 85 1.022 -1.692 8.325 1.00 1.00 H new ATOM 0 HA SER A 85 0.222 -4.028 7.112 1.00 1.00 H new ATOM 0 HB2 SER A 85 1.919 -4.836 9.175 1.00 1.00 H new ATOM 0 HB3 SER A 85 2.384 -4.372 7.551 1.00 1.00 H new ATOM 0 HG SER A 85 2.749 -3.029 9.931 1.00 1.00 H new ATOM 209 N PRO A 86 -1.530 -5.103 8.503 1.00 1.00 N ATOM 210 CA PRO A 86 -2.496 -5.842 9.297 1.00 1.00 C ATOM 211 C PRO A 86 -1.890 -7.142 9.827 1.00 1.00 C ATOM 212 O PRO A 86 -2.560 -7.909 10.517 1.00 1.00 O ATOM 213 CB PRO A 86 -3.676 -6.073 8.367 1.00 1.00 C ATOM 214 CG PRO A 86 -3.143 -5.866 6.958 1.00 1.00 C ATOM 215 CD PRO A 86 -1.787 -5.185 7.068 1.00 1.00 C ATOM 0 HA PRO A 86 -2.809 -5.300 10.189 1.00 1.00 H new ATOM 0 HB2 PRO A 86 -4.078 -7.079 8.489 1.00 1.00 H new ATOM 0 HB3 PRO A 86 -4.487 -5.377 8.584 1.00 1.00 H new ATOM 0 HG2 PRO A 86 -3.050 -6.821 6.441 1.00 1.00 H new ATOM 0 HG3 PRO A 86 -3.832 -5.254 6.375 1.00 1.00 H new ATOM 0 HD2 PRO A 86 -1.013 -5.759 6.559 1.00 1.00 H new ATOM 0 HD3 PRO A 86 -1.802 -4.196 6.611 1.00 1.00 H new ATOM 220 N MET A 87 -0.627 -7.352 9.485 1.00 1.00 N ATOM 221 CA MET A 87 0.078 -8.546 9.918 1.00 1.00 C ATOM 222 C MET A 87 1.590 -8.312 9.946 1.00 1.00 C ATOM 223 O MET A 87 2.167 -7.843 8.966 1.00 1.00 O ATOM 224 CB MET A 87 -0.242 -9.701 8.967 1.00 1.00 C ATOM 225 CG MET A 87 -1.706 -10.124 9.091 1.00 1.00 C ATOM 226 SD MET A 87 -2.050 -10.651 10.761 1.00 1.00 S ATOM 227 CE MET A 87 -1.388 -12.308 10.707 1.00 1.00 C ATOM 0 H MET A 87 -0.074 -6.715 8.912 1.00 1.00 H new ATOM 0 HA MET A 87 -0.251 -8.792 10.928 1.00 1.00 H new ATOM 0 HB2 MET A 87 -0.032 -9.400 7.941 1.00 1.00 H new ATOM 0 HB3 MET A 87 0.405 -10.549 9.189 1.00 1.00 H new ATOM 0 HG2 MET A 87 -2.357 -9.292 8.822 1.00 1.00 H new ATOM 0 HG3 MET A 87 -1.919 -10.934 8.394 1.00 1.00 H new ATOM 0 HE1 MET A 87 -2.194 -13.027 10.856 1.00 1.00 H new ATOM 0 HE2 MET A 87 -0.921 -12.482 9.738 1.00 1.00 H new ATOM 0 HE3 MET A 87 -0.644 -12.429 11.495 1.00 1.00 H new ATOM 235 N VAL A 88 2.188 -8.648 11.080 1.00 1.00 N ATOM 236 CA VAL A 88 3.620 -8.479 11.249 1.00 1.00 C ATOM 237 C VAL A 88 4.356 -9.403 10.276 1.00 1.00 C ATOM 238 O VAL A 88 3.950 -10.546 10.073 1.00 1.00 O ATOM 239 CB VAL A 88 4.008 -8.720 12.710 1.00 1.00 C ATOM 240 CG1 VAL A 88 5.446 -8.270 12.976 1.00 1.00 C ATOM 241 CG2 VAL A 88 3.029 -8.021 13.657 1.00 1.00 C ATOM 0 H VAL A 88 1.706 -9.037 11.891 1.00 1.00 H new ATOM 0 HA VAL A 88 3.914 -7.456 11.013 1.00 1.00 H new ATOM 0 HB VAL A 88 3.953 -9.792 12.901 1.00 1.00 H new ATOM 0 HG11 VAL A 88 5.697 -8.452 14.021 1.00 1.00 H new ATOM 0 HG12 VAL A 88 6.127 -8.831 12.336 1.00 1.00 H new ATOM 0 HG13 VAL A 88 5.540 -7.206 12.760 1.00 1.00 H new ATOM 0 HG21 VAL A 88 3.326 -8.207 14.689 1.00 1.00 H new ATOM 0 HG22 VAL A 88 3.039 -6.948 13.464 1.00 1.00 H new ATOM 0 HG23 VAL A 88 2.024 -8.409 13.493 1.00 1.00 H new ATOM 251 N GLY A 89 5.426 -8.873 9.700 1.00 1.00 N ATOM 252 CA GLY A 89 6.221 -9.635 8.754 1.00 1.00 C ATOM 253 C GLY A 89 7.055 -8.709 7.866 1.00 1.00 C ATOM 254 O GLY A 89 7.821 -7.886 8.366 1.00 1.00 O ATOM 0 H GLY A 89 5.760 -7.925 9.871 1.00 1.00 H new ATOM 0 HA2 GLY A 89 6.879 -10.317 9.293 1.00 1.00 H new ATOM 0 HA3 GLY A 89 5.566 -10.247 8.134 1.00 1.00 H new ATOM 258 N THR A 90 6.875 -8.872 6.564 1.00 1.00 N ATOM 259 CA THR A 90 7.601 -8.060 5.601 1.00 1.00 C ATOM 260 C THR A 90 6.628 -7.377 4.639 1.00 1.00 C ATOM 261 O THR A 90 5.439 -7.690 4.627 1.00 1.00 O ATOM 262 CB THR A 90 8.620 -8.959 4.897 1.00 1.00 C ATOM 263 OG1 THR A 90 9.396 -9.502 5.961 1.00 1.00 O ATOM 264 CG2 THR A 90 9.630 -8.162 4.069 1.00 1.00 C ATOM 0 H THR A 90 6.237 -9.554 6.153 1.00 1.00 H new ATOM 0 HA THR A 90 8.143 -7.253 6.094 1.00 1.00 H new ATOM 0 HB THR A 90 8.097 -9.664 4.251 1.00 1.00 H new ATOM 0 HG1 THR A 90 10.081 -10.099 5.594 1.00 1.00 H new ATOM 0 HG21 THR A 90 10.330 -8.847 3.591 1.00 1.00 H new ATOM 0 HG22 THR A 90 9.103 -7.590 3.305 1.00 1.00 H new ATOM 0 HG23 THR A 90 10.177 -7.480 4.720 1.00 1.00 H new ATOM 272 N PHE A 91 7.169 -6.455 3.856 1.00 1.00 N ATOM 273 CA PHE A 91 6.363 -5.724 2.894 1.00 1.00 C ATOM 274 C PHE A 91 7.134 -5.500 1.590 1.00 1.00 C ATOM 275 O PHE A 91 8.342 -5.272 1.611 1.00 1.00 O ATOM 276 CB PHE A 91 6.039 -4.366 3.519 1.00 1.00 C ATOM 277 CG PHE A 91 5.407 -3.368 2.547 1.00 1.00 C ATOM 278 CD1 PHE A 91 6.151 -2.835 1.541 1.00 1.00 C ATOM 279 CD2 PHE A 91 4.102 -3.012 2.690 1.00 1.00 C ATOM 280 CE1 PHE A 91 5.565 -1.907 0.640 1.00 1.00 C ATOM 281 CE2 PHE A 91 3.516 -2.086 1.788 1.00 1.00 C ATOM 282 CZ PHE A 91 4.261 -1.553 0.782 1.00 1.00 C ATOM 0 H PHE A 91 8.156 -6.198 3.869 1.00 1.00 H new ATOM 0 HA PHE A 91 5.461 -6.290 2.660 1.00 1.00 H new ATOM 0 HB2 PHE A 91 5.362 -4.517 4.360 1.00 1.00 H new ATOM 0 HB3 PHE A 91 6.956 -3.935 3.921 1.00 1.00 H new ATOM 0 HD1 PHE A 91 7.187 -3.117 1.427 1.00 1.00 H new ATOM 0 HD2 PHE A 91 3.512 -3.434 3.490 1.00 1.00 H new ATOM 0 HE1 PHE A 91 6.156 -1.483 -0.158 1.00 1.00 H new ATOM 0 HE2 PHE A 91 2.479 -1.805 1.900 1.00 1.00 H new ATOM 0 HZ PHE A 91 3.815 -0.848 0.096 1.00 1.00 H new ATOM 291 N TYR A 92 6.403 -5.575 0.487 1.00 1.00 N ATOM 292 CA TYR A 92 7.003 -5.383 -0.822 1.00 1.00 C ATOM 293 C TYR A 92 6.125 -4.490 -1.702 1.00 1.00 C ATOM 294 O TYR A 92 4.916 -4.402 -1.493 1.00 1.00 O ATOM 295 CB TYR A 92 7.089 -6.774 -1.454 1.00 1.00 C ATOM 296 CG TYR A 92 8.156 -7.675 -0.830 1.00 1.00 C ATOM 297 CD1 TYR A 92 9.490 -7.458 -1.104 1.00 1.00 C ATOM 298 CD2 TYR A 92 7.783 -8.708 0.007 1.00 1.00 C ATOM 299 CE1 TYR A 92 10.494 -8.307 -0.518 1.00 1.00 C ATOM 300 CE2 TYR A 92 8.788 -9.556 0.595 1.00 1.00 C ATOM 301 CZ TYR A 92 10.094 -9.314 0.303 1.00 1.00 C ATOM 302 OH TYR A 92 11.042 -10.115 0.858 1.00 1.00 O ATOM 0 H TYR A 92 5.401 -5.766 0.473 1.00 1.00 H new ATOM 0 HA TYR A 92 7.978 -4.904 -0.731 1.00 1.00 H new ATOM 0 HB2 TYR A 92 6.119 -7.263 -1.366 1.00 1.00 H new ATOM 0 HB3 TYR A 92 7.296 -6.666 -2.519 1.00 1.00 H new ATOM 0 HD1 TYR A 92 9.782 -6.650 -1.759 1.00 1.00 H new ATOM 0 HD2 TYR A 92 6.738 -8.880 0.221 1.00 1.00 H new ATOM 0 HE1 TYR A 92 11.542 -8.148 -0.726 1.00 1.00 H new ATOM 0 HE2 TYR A 92 8.511 -10.366 1.253 1.00 1.00 H new ATOM 0 HH TYR A 92 10.612 -10.890 1.276 1.00 1.00 H new ATOM 311 N ARG A 93 6.769 -3.850 -2.667 1.00 1.00 N ATOM 312 CA ARG A 93 6.062 -2.967 -3.579 1.00 1.00 C ATOM 313 C ARG A 93 5.814 -3.671 -4.914 1.00 1.00 C ATOM 314 O ARG A 93 4.991 -3.225 -5.712 1.00 1.00 O ATOM 315 CB ARG A 93 6.856 -1.682 -3.828 1.00 1.00 C ATOM 316 CG ARG A 93 7.179 -0.974 -2.511 1.00 1.00 C ATOM 317 CD ARG A 93 6.031 -0.055 -2.087 1.00 1.00 C ATOM 318 NE ARG A 93 5.841 1.015 -3.091 1.00 1.00 N ATOM 319 CZ ARG A 93 4.673 1.656 -3.300 1.00 1.00 C ATOM 320 NH1 ARG A 93 3.578 1.341 -2.576 1.00 1.00 N ATOM 321 NH2 ARG A 93 4.616 2.598 -4.224 1.00 1.00 N ATOM 0 H ARG A 93 7.772 -3.925 -2.837 1.00 1.00 H new ATOM 0 HA ARG A 93 5.109 -2.709 -3.118 1.00 1.00 H new ATOM 0 HB2 ARG A 93 7.781 -1.918 -4.355 1.00 1.00 H new ATOM 0 HB3 ARG A 93 6.283 -1.015 -4.473 1.00 1.00 H new ATOM 0 HG2 ARG A 93 7.364 -1.714 -1.732 1.00 1.00 H new ATOM 0 HG3 ARG A 93 8.094 -0.392 -2.622 1.00 1.00 H new ATOM 0 HD2 ARG A 93 5.113 -0.632 -1.981 1.00 1.00 H new ATOM 0 HD3 ARG A 93 6.246 0.384 -1.113 1.00 1.00 H new ATOM 0 HE ARG A 93 6.643 1.285 -3.660 1.00 1.00 H new ATOM 0 HH11 ARG A 93 3.630 0.613 -1.864 1.00 1.00 H new ATOM 0 HH12 ARG A 93 2.699 1.831 -2.741 1.00 1.00 H new ATOM 0 HH21 ARG A 93 5.448 2.831 -4.767 1.00 1.00 H new ATOM 0 HH22 ARG A 93 3.740 3.093 -4.395 1.00 1.00 H new ATOM 330 N THR A 94 6.541 -4.761 -5.116 1.00 1.00 N ATOM 331 CA THR A 94 6.410 -5.531 -6.342 1.00 1.00 C ATOM 332 C THR A 94 6.303 -7.024 -6.023 1.00 1.00 C ATOM 333 O THR A 94 6.765 -7.474 -4.975 1.00 1.00 O ATOM 334 CB THR A 94 7.593 -5.185 -7.246 1.00 1.00 C ATOM 335 OG1 THR A 94 8.738 -5.494 -6.456 1.00 1.00 O ATOM 336 CG2 THR A 94 7.714 -3.682 -7.504 1.00 1.00 C ATOM 0 H THR A 94 7.222 -5.129 -4.452 1.00 1.00 H new ATOM 0 HA THR A 94 5.493 -5.278 -6.874 1.00 1.00 H new ATOM 0 HB THR A 94 7.487 -5.709 -8.196 1.00 1.00 H new ATOM 0 HG1 THR A 94 9.243 -6.218 -6.882 1.00 1.00 H new ATOM 0 HG21 THR A 94 8.570 -3.492 -8.151 1.00 1.00 H new ATOM 0 HG22 THR A 94 6.806 -3.322 -7.988 1.00 1.00 H new ATOM 0 HG23 THR A 94 7.852 -3.160 -6.557 1.00 1.00 H new ATOM 344 N PRO A 95 5.676 -7.771 -6.972 1.00 1.00 N ATOM 345 CA PRO A 95 5.504 -9.202 -6.803 1.00 1.00 C ATOM 346 C PRO A 95 6.820 -9.946 -7.040 1.00 1.00 C ATOM 347 O PRO A 95 7.019 -11.044 -6.524 1.00 1.00 O ATOM 348 CB PRO A 95 4.418 -9.588 -7.796 1.00 1.00 C ATOM 349 CG PRO A 95 4.352 -8.451 -8.802 1.00 1.00 C ATOM 350 CD PRO A 95 5.117 -7.272 -8.225 1.00 1.00 C ATOM 0 HA PRO A 95 5.213 -9.472 -5.788 1.00 1.00 H new ATOM 0 HB2 PRO A 95 4.655 -10.531 -8.288 1.00 1.00 H new ATOM 0 HB3 PRO A 95 3.460 -9.722 -7.294 1.00 1.00 H new ATOM 0 HG2 PRO A 95 4.785 -8.758 -9.754 1.00 1.00 H new ATOM 0 HG3 PRO A 95 3.316 -8.175 -8.998 1.00 1.00 H new ATOM 0 HD2 PRO A 95 5.902 -6.939 -8.904 1.00 1.00 H new ATOM 0 HD3 PRO A 95 4.460 -6.419 -8.054 1.00 1.00 H new ATOM 355 N SER A 96 7.685 -9.317 -7.822 1.00 1.00 N ATOM 356 CA SER A 96 8.978 -9.903 -8.133 1.00 1.00 C ATOM 357 C SER A 96 10.019 -8.801 -8.335 1.00 1.00 C ATOM 358 O SER A 96 9.695 -7.616 -8.263 1.00 1.00 O ATOM 359 CB SER A 96 8.894 -10.789 -9.379 1.00 1.00 C ATOM 360 OG SER A 96 9.355 -12.113 -9.124 1.00 1.00 O ATOM 0 H SER A 96 7.516 -8.407 -8.250 1.00 1.00 H new ATOM 0 HA SER A 96 9.281 -10.529 -7.293 1.00 1.00 H new ATOM 0 HB2 SER A 96 7.862 -10.825 -9.729 1.00 1.00 H new ATOM 0 HB3 SER A 96 9.487 -10.346 -10.179 1.00 1.00 H new ATOM 0 HG SER A 96 9.721 -12.496 -9.948 1.00 1.00 H new ATOM 365 N PRO A 97 11.280 -9.241 -8.588 1.00 1.00 N ATOM 366 CA PRO A 97 12.371 -8.304 -8.801 1.00 1.00 C ATOM 367 C PRO A 97 12.279 -7.661 -10.186 1.00 1.00 C ATOM 368 O PRO A 97 12.435 -6.448 -10.323 1.00 1.00 O ATOM 369 CB PRO A 97 13.636 -9.125 -8.610 1.00 1.00 C ATOM 370 CG PRO A 97 13.217 -10.578 -8.757 1.00 1.00 C ATOM 371 CD PRO A 97 11.699 -10.637 -8.680 1.00 1.00 C ATOM 0 HA PRO A 97 12.347 -7.465 -8.106 1.00 1.00 H new ATOM 0 HB2 PRO A 97 14.390 -8.859 -9.351 1.00 1.00 H new ATOM 0 HB3 PRO A 97 14.075 -8.943 -7.629 1.00 1.00 H new ATOM 0 HG2 PRO A 97 13.567 -10.982 -9.707 1.00 1.00 H new ATOM 0 HG3 PRO A 97 13.663 -11.185 -7.969 1.00 1.00 H new ATOM 0 HD2 PRO A 97 11.276 -11.121 -9.560 1.00 1.00 H new ATOM 0 HD3 PRO A 97 11.368 -11.208 -7.813 1.00 1.00 H new ATOM 376 N ASP A 98 12.027 -8.502 -11.179 1.00 1.00 N ATOM 377 CA ASP A 98 11.913 -8.029 -12.548 1.00 1.00 C ATOM 378 C ASP A 98 10.434 -7.865 -12.904 1.00 1.00 C ATOM 379 O ASP A 98 9.990 -8.327 -13.954 1.00 1.00 O ATOM 380 CB ASP A 98 12.526 -9.031 -13.529 1.00 1.00 C ATOM 381 CG ASP A 98 12.002 -10.463 -13.403 1.00 1.00 C ATOM 382 OD1 ASP A 98 10.882 -10.774 -13.835 1.00 1.00 O ATOM 383 OD2 ASP A 98 12.808 -11.290 -12.825 1.00 1.00 O ATOM 0 H ASP A 98 11.899 -9.507 -11.063 1.00 1.00 H new ATOM 0 HA ASP A 98 12.443 -7.080 -12.623 1.00 1.00 H new ATOM 0 HB2 ASP A 98 12.342 -8.681 -14.545 1.00 1.00 H new ATOM 0 HB3 ASP A 98 13.607 -9.042 -13.386 1.00 1.00 H new ATOM 388 N ALA A 99 9.713 -7.203 -12.011 1.00 1.00 N ATOM 389 CA ALA A 99 8.294 -6.971 -12.218 1.00 1.00 C ATOM 390 C ALA A 99 7.977 -5.501 -11.942 1.00 1.00 C ATOM 391 O ALA A 99 8.695 -4.836 -11.196 1.00 1.00 O ATOM 392 CB ALA A 99 7.487 -7.919 -11.328 1.00 1.00 C ATOM 0 H ALA A 99 10.085 -6.820 -11.142 1.00 1.00 H new ATOM 0 HA ALA A 99 8.017 -7.179 -13.252 1.00 1.00 H new ATOM 0 HB1 ALA A 99 6.422 -7.745 -11.483 1.00 1.00 H new ATOM 0 HB2 ALA A 99 7.727 -8.951 -11.584 1.00 1.00 H new ATOM 0 HB3 ALA A 99 7.736 -7.737 -10.283 1.00 1.00 H new ATOM 398 N LYS A 100 6.900 -5.035 -12.558 1.00 1.00 N ATOM 399 CA LYS A 100 6.479 -3.655 -12.389 1.00 1.00 C ATOM 400 C LYS A 100 6.036 -3.436 -10.941 1.00 1.00 C ATOM 401 O LYS A 100 5.836 -4.395 -10.197 1.00 1.00 O ATOM 402 CB LYS A 100 5.410 -3.290 -13.421 1.00 1.00 C ATOM 403 CG LYS A 100 5.682 -3.981 -14.759 1.00 1.00 C ATOM 404 CD LYS A 100 4.805 -5.224 -14.922 1.00 1.00 C ATOM 405 CE LYS A 100 3.918 -5.110 -16.163 1.00 1.00 C ATOM 406 NZ LYS A 100 2.927 -6.209 -16.194 1.00 1.00 N ATOM 0 H LYS A 100 6.306 -5.589 -13.175 1.00 1.00 H new ATOM 0 HA LYS A 100 7.312 -2.977 -12.575 1.00 1.00 H new ATOM 0 HB2 LYS A 100 4.427 -3.581 -13.050 1.00 1.00 H new ATOM 0 HB3 LYS A 100 5.390 -2.209 -13.563 1.00 1.00 H new ATOM 0 HG2 LYS A 100 5.490 -3.286 -15.577 1.00 1.00 H new ATOM 0 HG3 LYS A 100 6.733 -4.263 -14.820 1.00 1.00 H new ATOM 0 HD2 LYS A 100 5.435 -6.110 -15.001 1.00 1.00 H new ATOM 0 HD3 LYS A 100 4.183 -5.353 -14.036 1.00 1.00 H new ATOM 0 HE2 LYS A 100 3.404 -4.149 -16.163 1.00 1.00 H new ATOM 0 HE3 LYS A 100 4.534 -5.142 -17.062 1.00 1.00 H new ATOM 0 HZ1 LYS A 100 2.333 -6.117 -17.043 1.00 1.00 H new ATOM 0 HZ2 LYS A 100 3.423 -7.123 -16.216 1.00 1.00 H new ATOM 0 HZ3 LYS A 100 2.328 -6.160 -15.345 1.00 1.00 H new ATOM 415 N ALA A 101 5.895 -2.167 -10.584 1.00 1.00 N ATOM 416 CA ALA A 101 5.479 -1.810 -9.238 1.00 1.00 C ATOM 417 C ALA A 101 3.951 -1.790 -9.170 1.00 1.00 C ATOM 418 O ALA A 101 3.293 -1.249 -10.058 1.00 1.00 O ATOM 419 CB ALA A 101 6.098 -0.465 -8.853 1.00 1.00 C ATOM 0 H ALA A 101 6.061 -1.374 -11.203 1.00 1.00 H new ATOM 0 HA ALA A 101 5.831 -2.549 -8.518 1.00 1.00 H new ATOM 0 HB1 ALA A 101 5.786 -0.197 -7.844 1.00 1.00 H new ATOM 0 HB2 ALA A 101 7.185 -0.541 -8.889 1.00 1.00 H new ATOM 0 HB3 ALA A 101 5.765 0.302 -9.552 1.00 1.00 H new ATOM 425 N PHE A 102 3.430 -2.385 -8.107 1.00 1.00 N ATOM 426 CA PHE A 102 1.991 -2.441 -7.912 1.00 1.00 C ATOM 427 C PHE A 102 1.380 -1.038 -7.924 1.00 1.00 C ATOM 428 O PHE A 102 0.306 -0.830 -8.487 1.00 1.00 O ATOM 429 CB PHE A 102 1.750 -3.077 -6.541 1.00 1.00 C ATOM 430 CG PHE A 102 1.690 -4.605 -6.566 1.00 1.00 C ATOM 431 CD1 PHE A 102 0.651 -5.234 -7.177 1.00 1.00 C ATOM 432 CD2 PHE A 102 2.675 -5.334 -5.975 1.00 1.00 C ATOM 433 CE1 PHE A 102 0.595 -6.653 -7.200 1.00 1.00 C ATOM 434 CE2 PHE A 102 2.618 -6.753 -5.998 1.00 1.00 C ATOM 435 CZ PHE A 102 1.580 -7.383 -6.610 1.00 1.00 C ATOM 0 H PHE A 102 3.978 -2.832 -7.372 1.00 1.00 H new ATOM 0 HA PHE A 102 1.529 -3.016 -8.715 1.00 1.00 H new ATOM 0 HB2 PHE A 102 2.545 -2.766 -5.863 1.00 1.00 H new ATOM 0 HB3 PHE A 102 0.815 -2.694 -6.133 1.00 1.00 H new ATOM 0 HD1 PHE A 102 -0.131 -4.655 -7.645 1.00 1.00 H new ATOM 0 HD2 PHE A 102 3.500 -4.834 -5.489 1.00 1.00 H new ATOM 0 HE1 PHE A 102 -0.230 -7.153 -7.686 1.00 1.00 H new ATOM 0 HE2 PHE A 102 3.400 -7.332 -5.529 1.00 1.00 H new ATOM 0 HZ PHE A 102 1.537 -8.462 -6.628 1.00 1.00 H new ATOM 444 N ILE A 103 2.092 -0.112 -7.299 1.00 1.00 N ATOM 445 CA ILE A 103 1.633 1.265 -7.232 1.00 1.00 C ATOM 446 C ILE A 103 2.764 2.197 -7.672 1.00 1.00 C ATOM 447 O ILE A 103 3.499 2.725 -6.838 1.00 1.00 O ATOM 448 CB ILE A 103 1.084 1.580 -5.838 1.00 1.00 C ATOM 449 CG1 ILE A 103 0.237 0.421 -5.309 1.00 1.00 C ATOM 450 CG2 ILE A 103 0.313 2.901 -5.839 1.00 1.00 C ATOM 451 CD1 ILE A 103 -1.126 0.376 -6.002 1.00 1.00 C ATOM 0 H ILE A 103 2.983 -0.288 -6.835 1.00 1.00 H new ATOM 0 HA ILE A 103 0.802 1.423 -7.920 1.00 1.00 H new ATOM 0 HB ILE A 103 1.926 1.700 -5.157 1.00 1.00 H new ATOM 0 HG12 ILE A 103 0.762 -0.521 -5.470 1.00 1.00 H new ATOM 0 HG13 ILE A 103 0.098 0.529 -4.233 1.00 1.00 H new ATOM 0 HG21 ILE A 103 -0.067 3.102 -4.837 1.00 1.00 H new ATOM 0 HG22 ILE A 103 0.977 3.710 -6.144 1.00 1.00 H new ATOM 0 HG23 ILE A 103 -0.522 2.834 -6.537 1.00 1.00 H new ATOM 0 HD11 ILE A 103 -1.708 -0.457 -5.607 1.00 1.00 H new ATOM 0 HD12 ILE A 103 -1.658 1.309 -5.819 1.00 1.00 H new ATOM 0 HD13 ILE A 103 -0.985 0.244 -7.075 1.00 1.00 H new ATOM 462 N GLU A 104 2.868 2.371 -8.982 1.00 1.00 N ATOM 463 CA GLU A 104 3.898 3.230 -9.542 1.00 1.00 C ATOM 464 C GLU A 104 3.666 4.682 -9.120 1.00 1.00 C ATOM 465 O GLU A 104 2.673 5.294 -9.508 1.00 1.00 O ATOM 466 CB GLU A 104 3.946 3.103 -11.066 1.00 1.00 C ATOM 467 CG GLU A 104 5.386 2.941 -11.557 1.00 1.00 C ATOM 468 CD GLU A 104 5.455 3.004 -13.085 1.00 1.00 C ATOM 469 OE1 GLU A 104 6.175 3.849 -13.638 1.00 1.00 O ATOM 470 OE2 GLU A 104 4.727 2.135 -13.701 1.00 1.00 O ATOM 0 H GLU A 104 2.257 1.932 -9.671 1.00 1.00 H new ATOM 0 HA GLU A 104 4.864 2.909 -9.152 1.00 1.00 H new ATOM 0 HB2 GLU A 104 3.352 2.246 -11.382 1.00 1.00 H new ATOM 0 HB3 GLU A 104 3.499 3.986 -11.522 1.00 1.00 H new ATOM 0 HG2 GLU A 104 6.010 3.725 -11.129 1.00 1.00 H new ATOM 0 HG3 GLU A 104 5.787 1.989 -11.210 1.00 1.00 H new ATOM 476 N VAL A 105 4.598 5.190 -8.329 1.00 1.00 N ATOM 477 CA VAL A 105 4.509 6.558 -7.848 1.00 1.00 C ATOM 478 C VAL A 105 3.999 7.457 -8.976 1.00 1.00 C ATOM 479 O VAL A 105 4.653 7.597 -10.009 1.00 1.00 O ATOM 480 CB VAL A 105 5.861 7.007 -7.291 1.00 1.00 C ATOM 481 CG1 VAL A 105 5.884 8.521 -7.062 1.00 1.00 C ATOM 482 CG2 VAL A 105 6.202 6.253 -6.004 1.00 1.00 C ATOM 0 H VAL A 105 5.420 4.678 -8.008 1.00 1.00 H new ATOM 0 HA VAL A 105 3.796 6.629 -7.027 1.00 1.00 H new ATOM 0 HB VAL A 105 6.624 6.768 -8.031 1.00 1.00 H new ATOM 0 HG11 VAL A 105 6.856 8.814 -6.666 1.00 1.00 H new ATOM 0 HG12 VAL A 105 5.707 9.035 -8.007 1.00 1.00 H new ATOM 0 HG13 VAL A 105 5.105 8.793 -6.350 1.00 1.00 H new ATOM 0 HG21 VAL A 105 7.168 6.591 -5.629 1.00 1.00 H new ATOM 0 HG22 VAL A 105 5.434 6.446 -5.255 1.00 1.00 H new ATOM 0 HG23 VAL A 105 6.247 5.184 -6.210 1.00 1.00 H new ATOM 492 N GLY A 106 2.834 8.045 -8.742 1.00 1.00 N ATOM 493 CA GLY A 106 2.229 8.926 -9.725 1.00 1.00 C ATOM 494 C GLY A 106 1.091 8.222 -10.467 1.00 1.00 C ATOM 495 O GLY A 106 0.649 8.685 -11.516 1.00 1.00 O ATOM 0 H GLY A 106 2.294 7.928 -7.885 1.00 1.00 H new ATOM 0 HA2 GLY A 106 1.848 9.820 -9.231 1.00 1.00 H new ATOM 0 HA3 GLY A 106 2.985 9.254 -10.439 1.00 1.00 H new ATOM 499 N GLN A 107 0.649 7.112 -9.891 1.00 1.00 N ATOM 500 CA GLN A 107 -0.428 6.339 -10.484 1.00 1.00 C ATOM 501 C GLN A 107 -1.670 6.387 -9.590 1.00 1.00 C ATOM 502 O GLN A 107 -1.604 6.858 -8.456 1.00 1.00 O ATOM 503 CB GLN A 107 0.009 4.895 -10.739 1.00 1.00 C ATOM 504 CG GLN A 107 -0.917 4.213 -11.748 1.00 1.00 C ATOM 505 CD GLN A 107 -0.191 3.084 -12.482 1.00 1.00 C ATOM 506 OE1 GLN A 107 0.379 3.266 -13.545 1.00 1.00 O ATOM 507 NE2 GLN A 107 -0.245 1.910 -11.858 1.00 1.00 N ATOM 0 H GLN A 107 1.018 6.731 -9.020 1.00 1.00 H new ATOM 0 HA GLN A 107 -0.680 6.783 -11.447 1.00 1.00 H new ATOM 0 HB2 GLN A 107 1.033 4.882 -11.113 1.00 1.00 H new ATOM 0 HB3 GLN A 107 0.004 4.339 -9.802 1.00 1.00 H new ATOM 0 HG2 GLN A 107 -1.791 3.814 -11.233 1.00 1.00 H new ATOM 0 HG3 GLN A 107 -1.279 4.946 -12.469 1.00 1.00 H new ATOM 0 HE21 GLN A 107 -0.739 1.827 -10.970 1.00 1.00 H new ATOM 0 HE22 GLN A 107 0.208 1.093 -12.268 1.00 1.00 H new ATOM 514 N LYS A 108 -2.771 5.891 -10.134 1.00 1.00 N ATOM 515 CA LYS A 108 -4.024 5.871 -9.400 1.00 1.00 C ATOM 516 C LYS A 108 -4.491 4.423 -9.236 1.00 1.00 C ATOM 517 O LYS A 108 -4.140 3.559 -10.038 1.00 1.00 O ATOM 518 CB LYS A 108 -5.055 6.776 -10.078 1.00 1.00 C ATOM 519 CG LYS A 108 -6.462 6.502 -9.541 1.00 1.00 C ATOM 520 CD LYS A 108 -6.618 7.035 -8.115 1.00 1.00 C ATOM 521 CE LYS A 108 -7.589 8.216 -8.074 1.00 1.00 C ATOM 522 NZ LYS A 108 -8.934 7.768 -7.649 1.00 1.00 N ATOM 0 H LYS A 108 -2.821 5.500 -11.075 1.00 1.00 H new ATOM 0 HA LYS A 108 -3.886 6.277 -8.398 1.00 1.00 H new ATOM 0 HB2 LYS A 108 -4.794 7.821 -9.909 1.00 1.00 H new ATOM 0 HB3 LYS A 108 -5.035 6.613 -11.156 1.00 1.00 H new ATOM 0 HG2 LYS A 108 -7.201 6.971 -10.191 1.00 1.00 H new ATOM 0 HG3 LYS A 108 -6.658 5.430 -9.556 1.00 1.00 H new ATOM 0 HD2 LYS A 108 -6.980 6.240 -7.463 1.00 1.00 H new ATOM 0 HD3 LYS A 108 -5.646 7.345 -7.731 1.00 1.00 H new ATOM 0 HE2 LYS A 108 -7.218 8.975 -7.386 1.00 1.00 H new ATOM 0 HE3 LYS A 108 -7.648 8.680 -9.059 1.00 1.00 H new ATOM 0 HZ1 LYS A 108 -9.580 8.583 -7.627 1.00 1.00 H new ATOM 0 HZ2 LYS A 108 -9.292 7.060 -8.321 1.00 1.00 H new ATOM 0 HZ3 LYS A 108 -8.876 7.346 -6.700 1.00 1.00 H new ATOM 531 N VAL A 109 -5.275 4.203 -8.191 1.00 1.00 N ATOM 532 CA VAL A 109 -5.792 2.874 -7.910 1.00 1.00 C ATOM 533 C VAL A 109 -7.278 2.975 -7.560 1.00 1.00 C ATOM 534 O VAL A 109 -7.714 3.959 -6.963 1.00 1.00 O ATOM 535 CB VAL A 109 -4.962 2.210 -6.810 1.00 1.00 C ATOM 536 CG1 VAL A 109 -3.503 2.051 -7.245 1.00 1.00 C ATOM 537 CG2 VAL A 109 -5.060 2.993 -5.500 1.00 1.00 C ATOM 0 H VAL A 109 -5.565 4.922 -7.529 1.00 1.00 H new ATOM 0 HA VAL A 109 -5.707 2.237 -8.790 1.00 1.00 H new ATOM 0 HB VAL A 109 -5.371 1.215 -6.637 1.00 1.00 H new ATOM 0 HG11 VAL A 109 -2.935 1.576 -6.445 1.00 1.00 H new ATOM 0 HG12 VAL A 109 -3.456 1.432 -8.141 1.00 1.00 H new ATOM 0 HG13 VAL A 109 -3.078 3.032 -7.459 1.00 1.00 H new ATOM 0 HG21 VAL A 109 -4.461 2.499 -4.735 1.00 1.00 H new ATOM 0 HG22 VAL A 109 -4.689 4.006 -5.653 1.00 1.00 H new ATOM 0 HG23 VAL A 109 -6.100 3.032 -5.177 1.00 1.00 H new ATOM 547 N ASN A 110 -8.014 1.943 -7.943 1.00 1.00 N ATOM 548 CA ASN A 110 -9.442 1.901 -7.676 1.00 1.00 C ATOM 549 C ASN A 110 -9.780 0.613 -6.924 1.00 1.00 C ATOM 550 O ASN A 110 -9.134 -0.415 -7.125 1.00 1.00 O ATOM 551 CB ASN A 110 -10.247 1.914 -8.978 1.00 1.00 C ATOM 552 CG ASN A 110 -11.741 2.077 -8.697 1.00 1.00 C ATOM 553 OD1 ASN A 110 -12.171 2.267 -7.571 1.00 1.00 O ATOM 554 ND2 ASN A 110 -12.507 1.994 -9.781 1.00 1.00 N ATOM 0 H ASN A 110 -7.648 1.129 -8.437 1.00 1.00 H new ATOM 0 HA ASN A 110 -9.699 2.779 -7.084 1.00 1.00 H new ATOM 0 HB2 ASN A 110 -9.902 2.729 -9.615 1.00 1.00 H new ATOM 0 HB3 ASN A 110 -10.075 0.987 -9.525 1.00 1.00 H new ATOM 0 HD21 ASN A 110 -13.519 2.091 -9.699 1.00 1.00 H new ATOM 0 HD22 ASN A 110 -12.082 1.833 -10.694 1.00 1.00 H new ATOM 560 N VAL A 111 -10.791 0.710 -6.073 1.00 1.00 N ATOM 561 CA VAL A 111 -11.221 -0.435 -5.288 1.00 1.00 C ATOM 562 C VAL A 111 -11.181 -1.690 -6.164 1.00 1.00 C ATOM 563 O VAL A 111 -11.997 -1.843 -7.072 1.00 1.00 O ATOM 564 CB VAL A 111 -12.603 -0.169 -4.688 1.00 1.00 C ATOM 565 CG1 VAL A 111 -13.707 -0.437 -5.712 1.00 1.00 C ATOM 566 CG2 VAL A 111 -12.819 -0.996 -3.420 1.00 1.00 C ATOM 0 H VAL A 111 -11.325 1.564 -5.910 1.00 1.00 H new ATOM 0 HA VAL A 111 -10.544 -0.600 -4.450 1.00 1.00 H new ATOM 0 HB VAL A 111 -12.651 0.885 -4.413 1.00 1.00 H new ATOM 0 HG11 VAL A 111 -14.679 -0.240 -5.259 1.00 1.00 H new ATOM 0 HG12 VAL A 111 -13.570 0.215 -6.574 1.00 1.00 H new ATOM 0 HG13 VAL A 111 -13.661 -1.478 -6.033 1.00 1.00 H new ATOM 0 HG21 VAL A 111 -13.809 -0.788 -3.014 1.00 1.00 H new ATOM 0 HG22 VAL A 111 -12.741 -2.056 -3.660 1.00 1.00 H new ATOM 0 HG23 VAL A 111 -12.062 -0.734 -2.681 1.00 1.00 H new ATOM 576 N GLY A 112 -10.227 -2.556 -5.858 1.00 1.00 N ATOM 577 CA GLY A 112 -10.071 -3.792 -6.605 1.00 1.00 C ATOM 578 C GLY A 112 -8.644 -3.933 -7.141 1.00 1.00 C ATOM 579 O GLY A 112 -8.249 -5.008 -7.589 1.00 1.00 O ATOM 0 H GLY A 112 -9.554 -2.426 -5.103 1.00 1.00 H new ATOM 0 HA2 GLY A 112 -10.308 -4.641 -5.964 1.00 1.00 H new ATOM 0 HA3 GLY A 112 -10.778 -3.812 -7.434 1.00 1.00 H new ATOM 583 N ASP A 113 -7.911 -2.831 -7.078 1.00 1.00 N ATOM 584 CA ASP A 113 -6.537 -2.818 -7.550 1.00 1.00 C ATOM 585 C ASP A 113 -5.595 -3.076 -6.374 1.00 1.00 C ATOM 586 O ASP A 113 -5.772 -2.510 -5.297 1.00 1.00 O ATOM 587 CB ASP A 113 -6.176 -1.461 -8.157 1.00 1.00 C ATOM 588 CG ASP A 113 -6.189 -1.412 -9.687 1.00 1.00 C ATOM 589 OD1 ASP A 113 -7.177 -0.986 -10.303 1.00 1.00 O ATOM 590 OD2 ASP A 113 -5.112 -1.839 -10.254 1.00 1.00 O ATOM 0 H ASP A 113 -8.243 -1.941 -6.707 1.00 1.00 H new ATOM 0 HA ASP A 113 -6.435 -3.592 -8.311 1.00 1.00 H new ATOM 0 HB2 ASP A 113 -6.873 -0.714 -7.779 1.00 1.00 H new ATOM 0 HB3 ASP A 113 -5.183 -1.176 -7.808 1.00 1.00 H new ATOM 595 N THR A 114 -4.614 -3.932 -6.619 1.00 1.00 N ATOM 596 CA THR A 114 -3.643 -4.272 -5.593 1.00 1.00 C ATOM 597 C THR A 114 -3.108 -3.004 -4.924 1.00 1.00 C ATOM 598 O THR A 114 -3.435 -1.894 -5.339 1.00 1.00 O ATOM 599 CB THR A 114 -2.549 -5.124 -6.239 1.00 1.00 C ATOM 600 OG1 THR A 114 -3.252 -6.243 -6.774 1.00 1.00 O ATOM 601 CG2 THR A 114 -1.599 -5.738 -5.210 1.00 1.00 C ATOM 0 H THR A 114 -4.471 -4.401 -7.514 1.00 1.00 H new ATOM 0 HA THR A 114 -4.101 -4.856 -4.795 1.00 1.00 H new ATOM 0 HB THR A 114 -1.979 -4.513 -6.938 1.00 1.00 H new ATOM 0 HG1 THR A 114 -2.618 -6.848 -7.214 1.00 1.00 H new ATOM 0 HG21 THR A 114 -0.843 -6.332 -5.722 1.00 1.00 H new ATOM 0 HG22 THR A 114 -1.114 -4.943 -4.643 1.00 1.00 H new ATOM 0 HG23 THR A 114 -2.163 -6.377 -4.530 1.00 1.00 H new ATOM 609 N LEU A 115 -2.295 -3.212 -3.899 1.00 1.00 N ATOM 610 CA LEU A 115 -1.712 -2.100 -3.168 1.00 1.00 C ATOM 611 C LEU A 115 -0.243 -2.406 -2.868 1.00 1.00 C ATOM 612 O LEU A 115 0.624 -1.557 -3.064 1.00 1.00 O ATOM 613 CB LEU A 115 -2.541 -1.784 -1.922 1.00 1.00 C ATOM 614 CG LEU A 115 -2.760 -0.299 -1.620 1.00 1.00 C ATOM 615 CD1 LEU A 115 -3.366 0.422 -2.826 1.00 1.00 C ATOM 616 CD2 LEU A 115 -3.604 -0.116 -0.358 1.00 1.00 C ATOM 0 H LEU A 115 -2.026 -4.135 -3.557 1.00 1.00 H new ATOM 0 HA LEU A 115 -1.732 -1.194 -3.774 1.00 1.00 H new ATOM 0 HB2 LEU A 115 -3.516 -2.260 -2.028 1.00 1.00 H new ATOM 0 HB3 LEU A 115 -2.055 -2.242 -1.061 1.00 1.00 H new ATOM 0 HG LEU A 115 -1.789 0.158 -1.427 1.00 1.00 H new ATOM 0 HD11 LEU A 115 -3.511 1.475 -2.585 1.00 1.00 H new ATOM 0 HD12 LEU A 115 -2.692 0.334 -3.678 1.00 1.00 H new ATOM 0 HD13 LEU A 115 -4.327 -0.029 -3.075 1.00 1.00 H new ATOM 0 HD21 LEU A 115 -3.745 0.948 -0.166 1.00 1.00 H new ATOM 0 HD22 LEU A 115 -4.575 -0.591 -0.498 1.00 1.00 H new ATOM 0 HD23 LEU A 115 -3.095 -0.574 0.490 1.00 1.00 H new ATOM 627 N CYS A 116 -0.011 -3.622 -2.395 1.00 1.00 N ATOM 628 CA CYS A 116 1.338 -4.051 -2.066 1.00 1.00 C ATOM 629 C CYS A 116 1.284 -5.519 -1.637 1.00 1.00 C ATOM 630 O CYS A 116 0.240 -6.161 -1.740 1.00 1.00 O ATOM 631 CB CYS A 116 1.966 -3.165 -0.989 1.00 1.00 C ATOM 632 SG CYS A 116 0.699 -2.676 0.237 1.00 1.00 S ATOM 0 H CYS A 116 -0.734 -4.323 -2.232 1.00 1.00 H new ATOM 0 HA CYS A 116 1.978 -3.953 -2.943 1.00 1.00 H new ATOM 0 HB2 CYS A 116 2.776 -3.700 -0.493 1.00 1.00 H new ATOM 0 HB3 CYS A 116 2.403 -2.277 -1.446 1.00 1.00 H new ATOM 0 HG CYS A 116 0.879 -1.434 0.575 1.00 1.00 H new ATOM 637 N ILE A 117 2.422 -6.007 -1.166 1.00 1.00 N ATOM 638 CA ILE A 117 2.518 -7.388 -0.722 1.00 1.00 C ATOM 639 C ILE A 117 3.141 -7.426 0.675 1.00 1.00 C ATOM 640 O ILE A 117 3.915 -6.542 1.039 1.00 1.00 O ATOM 641 CB ILE A 117 3.267 -8.232 -1.754 1.00 1.00 C ATOM 642 CG1 ILE A 117 2.670 -8.048 -3.151 1.00 1.00 C ATOM 643 CG2 ILE A 117 3.305 -9.703 -1.335 1.00 1.00 C ATOM 644 CD1 ILE A 117 3.058 -9.209 -4.069 1.00 1.00 C ATOM 0 H ILE A 117 3.286 -5.471 -1.082 1.00 1.00 H new ATOM 0 HA ILE A 117 1.526 -7.833 -0.642 1.00 1.00 H new ATOM 0 HB ILE A 117 4.299 -7.883 -1.797 1.00 1.00 H new ATOM 0 HG12 ILE A 117 1.584 -7.982 -3.081 1.00 1.00 H new ATOM 0 HG13 ILE A 117 3.019 -7.108 -3.579 1.00 1.00 H new ATOM 0 HG21 ILE A 117 3.843 -10.281 -2.086 1.00 1.00 H new ATOM 0 HG22 ILE A 117 3.812 -9.795 -0.374 1.00 1.00 H new ATOM 0 HG23 ILE A 117 2.287 -10.082 -1.246 1.00 1.00 H new ATOM 0 HD11 ILE A 117 2.621 -9.054 -5.056 1.00 1.00 H new ATOM 0 HD12 ILE A 117 4.143 -9.257 -4.156 1.00 1.00 H new ATOM 0 HD13 ILE A 117 2.686 -10.144 -3.650 1.00 1.00 H new ATOM 655 N VAL A 118 2.780 -8.461 1.420 1.00 1.00 N ATOM 656 CA VAL A 118 3.295 -8.627 2.769 1.00 1.00 C ATOM 657 C VAL A 118 3.711 -10.085 2.975 1.00 1.00 C ATOM 658 O VAL A 118 2.958 -11.001 2.650 1.00 1.00 O ATOM 659 CB VAL A 118 2.255 -8.153 3.787 1.00 1.00 C ATOM 660 CG1 VAL A 118 2.497 -8.793 5.155 1.00 1.00 C ATOM 661 CG2 VAL A 118 2.246 -6.626 3.891 1.00 1.00 C ATOM 0 H VAL A 118 2.138 -9.192 1.115 1.00 1.00 H new ATOM 0 HA VAL A 118 4.182 -8.011 2.918 1.00 1.00 H new ATOM 0 HB VAL A 118 1.273 -8.471 3.436 1.00 1.00 H new ATOM 0 HG11 VAL A 118 1.745 -8.440 5.860 1.00 1.00 H new ATOM 0 HG12 VAL A 118 2.430 -9.877 5.066 1.00 1.00 H new ATOM 0 HG13 VAL A 118 3.489 -8.519 5.515 1.00 1.00 H new ATOM 0 HG21 VAL A 118 1.498 -6.315 4.621 1.00 1.00 H new ATOM 0 HG22 VAL A 118 3.229 -6.277 4.207 1.00 1.00 H new ATOM 0 HG23 VAL A 118 2.004 -6.197 2.919 1.00 1.00 H new ATOM 671 N GLU A 119 4.910 -10.254 3.514 1.00 1.00 N ATOM 672 CA GLU A 119 5.436 -11.584 3.766 1.00 1.00 C ATOM 673 C GLU A 119 5.246 -11.959 5.238 1.00 1.00 C ATOM 674 O GLU A 119 5.387 -11.114 6.121 1.00 1.00 O ATOM 675 CB GLU A 119 6.909 -11.677 3.364 1.00 1.00 C ATOM 676 CG GLU A 119 7.174 -12.940 2.541 1.00 1.00 C ATOM 677 CD GLU A 119 8.424 -12.778 1.674 1.00 1.00 C ATOM 678 OE1 GLU A 119 8.317 -12.681 0.443 1.00 1.00 O ATOM 679 OE2 GLU A 119 9.538 -12.753 2.324 1.00 1.00 O ATOM 0 H GLU A 119 5.532 -9.491 3.783 1.00 1.00 H new ATOM 0 HA GLU A 119 4.881 -12.295 3.154 1.00 1.00 H new ATOM 0 HB2 GLU A 119 7.188 -10.796 2.785 1.00 1.00 H new ATOM 0 HB3 GLU A 119 7.534 -11.683 4.257 1.00 1.00 H new ATOM 0 HG2 GLU A 119 7.298 -13.793 3.208 1.00 1.00 H new ATOM 0 HG3 GLU A 119 6.313 -13.153 1.907 1.00 1.00 H new ATOM 685 N ALA A 120 4.930 -13.227 5.456 1.00 1.00 N ATOM 686 CA ALA A 120 4.718 -13.724 6.805 1.00 1.00 C ATOM 687 C ALA A 120 5.370 -15.101 6.944 1.00 1.00 C ATOM 688 O ALA A 120 6.015 -15.583 6.014 1.00 1.00 O ATOM 689 CB ALA A 120 3.219 -13.754 7.109 1.00 1.00 C ATOM 0 H ALA A 120 4.816 -13.925 4.721 1.00 1.00 H new ATOM 0 HA ALA A 120 5.184 -13.063 7.536 1.00 1.00 H new ATOM 0 HB1 ALA A 120 3.060 -14.127 8.121 1.00 1.00 H new ATOM 0 HB2 ALA A 120 2.811 -12.747 7.025 1.00 1.00 H new ATOM 0 HB3 ALA A 120 2.717 -14.410 6.398 1.00 1.00 H new ATOM 695 N MET A 121 5.177 -15.697 8.112 1.00 1.00 N ATOM 696 CA MET A 121 5.736 -17.009 8.384 1.00 1.00 C ATOM 697 C MET A 121 5.675 -17.900 7.142 1.00 1.00 C ATOM 698 O MET A 121 4.664 -18.556 6.893 1.00 1.00 O ATOM 699 CB MET A 121 4.959 -17.670 9.525 1.00 1.00 C ATOM 700 CG MET A 121 5.202 -16.939 10.848 1.00 1.00 C ATOM 701 SD MET A 121 5.625 -18.113 12.125 1.00 1.00 S ATOM 702 CE MET A 121 5.346 -17.108 13.573 1.00 1.00 C ATOM 0 H MET A 121 4.641 -15.294 8.881 1.00 1.00 H new ATOM 0 HA MET A 121 6.781 -16.885 8.668 1.00 1.00 H new ATOM 0 HB2 MET A 121 3.894 -17.667 9.294 1.00 1.00 H new ATOM 0 HB3 MET A 121 5.262 -18.713 9.620 1.00 1.00 H new ATOM 0 HG2 MET A 121 6.006 -16.213 10.729 1.00 1.00 H new ATOM 0 HG3 MET A 121 4.310 -16.383 11.135 1.00 1.00 H new ATOM 0 HE1 MET A 121 5.564 -17.691 14.468 1.00 1.00 H new ATOM 0 HE2 MET A 121 5.997 -16.235 13.541 1.00 1.00 H new ATOM 0 HE3 MET A 121 4.306 -16.784 13.596 1.00 1.00 H new ATOM 710 N LYS A 122 6.769 -17.896 6.395 1.00 1.00 N ATOM 711 CA LYS A 122 6.853 -18.696 5.185 1.00 1.00 C ATOM 712 C LYS A 122 5.514 -18.636 4.447 1.00 1.00 C ATOM 713 O LYS A 122 4.893 -19.668 4.196 1.00 1.00 O ATOM 714 CB LYS A 122 7.311 -20.118 5.513 1.00 1.00 C ATOM 715 CG LYS A 122 8.114 -20.716 4.356 1.00 1.00 C ATOM 716 CD LYS A 122 7.196 -21.435 3.365 1.00 1.00 C ATOM 717 CE LYS A 122 7.727 -22.834 3.043 1.00 1.00 C ATOM 718 NZ LYS A 122 8.869 -22.751 2.106 1.00 1.00 N ATOM 0 H LYS A 122 7.605 -17.351 6.604 1.00 1.00 H new ATOM 0 HA LYS A 122 7.608 -18.291 4.512 1.00 1.00 H new ATOM 0 HB2 LYS A 122 7.921 -20.108 6.417 1.00 1.00 H new ATOM 0 HB3 LYS A 122 6.444 -20.745 5.720 1.00 1.00 H new ATOM 0 HG2 LYS A 122 8.662 -19.926 3.842 1.00 1.00 H new ATOM 0 HG3 LYS A 122 8.854 -21.416 4.745 1.00 1.00 H new ATOM 0 HD2 LYS A 122 6.192 -21.510 3.782 1.00 1.00 H new ATOM 0 HD3 LYS A 122 7.117 -20.852 2.448 1.00 1.00 H new ATOM 0 HE2 LYS A 122 8.038 -23.332 3.961 1.00 1.00 H new ATOM 0 HE3 LYS A 122 6.933 -23.439 2.605 1.00 1.00 H new ATOM 0 HZ1 LYS A 122 9.218 -23.708 1.898 1.00 1.00 H new ATOM 0 HZ2 LYS A 122 8.561 -22.295 1.223 1.00 1.00 H new ATOM 0 HZ3 LYS A 122 9.632 -22.191 2.537 1.00 1.00 H new ATOM 727 N MET A 123 5.108 -17.418 4.120 1.00 1.00 N ATOM 728 CA MET A 123 3.854 -17.211 3.415 1.00 1.00 C ATOM 729 C MET A 123 3.812 -15.826 2.768 1.00 1.00 C ATOM 730 O MET A 123 4.418 -14.882 3.273 1.00 1.00 O ATOM 731 CB MET A 123 2.688 -17.354 4.395 1.00 1.00 C ATOM 732 CG MET A 123 1.899 -18.637 4.127 1.00 1.00 C ATOM 733 SD MET A 123 0.276 -18.237 3.504 1.00 1.00 S ATOM 734 CE MET A 123 0.022 -19.611 2.393 1.00 1.00 C ATOM 0 H MET A 123 5.625 -16.564 4.330 1.00 1.00 H new ATOM 0 HA MET A 123 3.772 -17.961 2.628 1.00 1.00 H new ATOM 0 HB2 MET A 123 3.067 -17.363 5.417 1.00 1.00 H new ATOM 0 HB3 MET A 123 2.027 -16.492 4.307 1.00 1.00 H new ATOM 0 HG2 MET A 123 2.432 -19.257 3.406 1.00 1.00 H new ATOM 0 HG3 MET A 123 1.812 -19.219 5.045 1.00 1.00 H new ATOM 0 HE1 MET A 123 -0.953 -19.517 1.915 1.00 1.00 H new ATOM 0 HE2 MET A 123 0.801 -19.611 1.631 1.00 1.00 H new ATOM 0 HE3 MET A 123 0.063 -20.545 2.954 1.00 1.00 H new ATOM 742 N MET A 124 3.089 -15.746 1.661 1.00 1.00 N ATOM 743 CA MET A 124 2.959 -14.491 0.940 1.00 1.00 C ATOM 744 C MET A 124 1.499 -14.035 0.891 1.00 1.00 C ATOM 745 O MET A 124 0.606 -14.830 0.602 1.00 1.00 O ATOM 746 CB MET A 124 3.488 -14.664 -0.486 1.00 1.00 C ATOM 747 CG MET A 124 2.453 -15.357 -1.374 1.00 1.00 C ATOM 748 SD MET A 124 2.128 -17.002 -0.765 1.00 1.00 S ATOM 749 CE MET A 124 0.670 -17.402 -1.714 1.00 1.00 C ATOM 0 H MET A 124 2.587 -16.530 1.245 1.00 1.00 H new ATOM 0 HA MET A 124 3.540 -13.731 1.463 1.00 1.00 H new ATOM 0 HB2 MET A 124 3.738 -13.690 -0.906 1.00 1.00 H new ATOM 0 HB3 MET A 124 4.407 -15.249 -0.468 1.00 1.00 H new ATOM 0 HG2 MET A 124 1.530 -14.778 -1.390 1.00 1.00 H new ATOM 0 HG3 MET A 124 2.817 -15.406 -2.400 1.00 1.00 H new ATOM 0 HE1 MET A 124 0.331 -18.405 -1.455 1.00 1.00 H new ATOM 0 HE2 MET A 124 -0.118 -16.683 -1.490 1.00 1.00 H new ATOM 0 HE3 MET A 124 0.906 -17.362 -2.777 1.00 1.00 H new ATOM 757 N ASN A 125 1.302 -12.757 1.177 1.00 1.00 N ATOM 758 CA ASN A 125 -0.034 -12.186 1.170 1.00 1.00 C ATOM 759 C ASN A 125 -0.030 -10.902 0.337 1.00 1.00 C ATOM 760 O ASN A 125 0.990 -10.222 0.243 1.00 1.00 O ATOM 761 CB ASN A 125 -0.487 -11.828 2.587 1.00 1.00 C ATOM 762 CG ASN A 125 -0.386 -13.039 3.517 1.00 1.00 C ATOM 763 OD1 ASN A 125 0.851 -13.307 3.922 1.00 1.00 O flip ATOM 764 ND2 ASN A 125 -1.368 -13.687 3.844 1.00 1.00 N flip ATOM 0 H ASN A 125 2.045 -12.100 1.415 1.00 1.00 H new ATOM 0 HA ASN A 125 -0.715 -12.926 0.749 1.00 1.00 H new ATOM 0 HB2 ASN A 125 0.127 -11.015 2.975 1.00 1.00 H new ATOM 0 HB3 ASN A 125 -1.515 -11.467 2.564 1.00 1.00 H new ATOM 0 HD21 ASN A 125 -2.290 -13.426 3.496 1.00 1.00 H new ATOM 0 HD22 ASN A 125 -1.266 -14.489 4.465 1.00 1.00 H new ATOM 770 N GLN A 126 -1.184 -10.610 -0.246 1.00 1.00 N ATOM 771 CA GLN A 126 -1.327 -9.421 -1.069 1.00 1.00 C ATOM 772 C GLN A 126 -2.304 -8.440 -0.417 1.00 1.00 C ATOM 773 O GLN A 126 -3.200 -8.848 0.321 1.00 1.00 O ATOM 774 CB GLN A 126 -1.777 -9.784 -2.485 1.00 1.00 C ATOM 775 CG GLN A 126 -0.588 -10.217 -3.345 1.00 1.00 C ATOM 776 CD GLN A 126 -0.917 -11.482 -4.139 1.00 1.00 C ATOM 777 OE1 GLN A 126 -0.721 -12.599 -3.686 1.00 1.00 O ATOM 778 NE2 GLN A 126 -1.426 -11.247 -5.344 1.00 1.00 N ATOM 0 H GLN A 126 -2.028 -11.176 -0.165 1.00 1.00 H new ATOM 0 HA GLN A 126 -0.353 -8.937 -1.147 1.00 1.00 H new ATOM 0 HB2 GLN A 126 -2.511 -10.589 -2.442 1.00 1.00 H new ATOM 0 HB3 GLN A 126 -2.270 -8.927 -2.945 1.00 1.00 H new ATOM 0 HG2 GLN A 126 -0.318 -9.413 -4.030 1.00 1.00 H new ATOM 0 HG3 GLN A 126 0.279 -10.398 -2.709 1.00 1.00 H new ATOM 0 HE21 GLN A 126 -1.564 -10.287 -5.661 1.00 1.00 H new ATOM 0 HE22 GLN A 126 -1.679 -12.026 -5.952 1.00 1.00 H new ATOM 785 N ILE A 127 -2.098 -7.165 -0.713 1.00 1.00 N ATOM 786 CA ILE A 127 -2.949 -6.122 -0.166 1.00 1.00 C ATOM 787 C ILE A 127 -3.715 -5.445 -1.304 1.00 1.00 C ATOM 788 O ILE A 127 -3.112 -4.832 -2.184 1.00 1.00 O ATOM 789 CB ILE A 127 -2.128 -5.152 0.686 1.00 1.00 C ATOM 790 CG1 ILE A 127 -1.054 -5.895 1.482 1.00 1.00 C ATOM 791 CG2 ILE A 127 -3.034 -4.313 1.588 1.00 1.00 C ATOM 792 CD1 ILE A 127 -0.549 -5.045 2.650 1.00 1.00 C ATOM 0 H ILE A 127 -1.354 -6.831 -1.325 1.00 1.00 H new ATOM 0 HA ILE A 127 -3.692 -6.551 0.507 1.00 1.00 H new ATOM 0 HB ILE A 127 -1.613 -4.462 0.018 1.00 1.00 H new ATOM 0 HG12 ILE A 127 -1.460 -6.833 1.860 1.00 1.00 H new ATOM 0 HG13 ILE A 127 -0.221 -6.149 0.826 1.00 1.00 H new ATOM 0 HG21 ILE A 127 -2.425 -3.632 2.183 1.00 1.00 H new ATOM 0 HG22 ILE A 127 -3.727 -3.738 0.974 1.00 1.00 H new ATOM 0 HG23 ILE A 127 -3.596 -4.970 2.251 1.00 1.00 H new ATOM 0 HD11 ILE A 127 0.214 -5.597 3.199 1.00 1.00 H new ATOM 0 HD12 ILE A 127 -0.121 -4.118 2.267 1.00 1.00 H new ATOM 0 HD13 ILE A 127 -1.379 -4.813 3.317 1.00 1.00 H new ATOM 803 N GLU A 128 -5.032 -5.579 -1.250 1.00 1.00 N ATOM 804 CA GLU A 128 -5.886 -4.988 -2.265 1.00 1.00 C ATOM 805 C GLU A 128 -6.476 -3.669 -1.761 1.00 1.00 C ATOM 806 O GLU A 128 -6.975 -3.597 -0.639 1.00 1.00 O ATOM 807 CB GLU A 128 -6.992 -5.958 -2.685 1.00 1.00 C ATOM 808 CG GLU A 128 -7.604 -5.546 -4.026 1.00 1.00 C ATOM 809 CD GLU A 128 -8.525 -4.335 -3.858 1.00 1.00 C ATOM 810 OE1 GLU A 128 -8.251 -3.265 -4.422 1.00 1.00 O ATOM 811 OE2 GLU A 128 -9.558 -4.536 -3.112 1.00 1.00 O ATOM 0 H GLU A 128 -5.528 -6.088 -0.519 1.00 1.00 H new ATOM 0 HA GLU A 128 -5.278 -4.779 -3.145 1.00 1.00 H new ATOM 0 HB2 GLU A 128 -6.586 -6.967 -2.761 1.00 1.00 H new ATOM 0 HB3 GLU A 128 -7.768 -5.984 -1.920 1.00 1.00 H new ATOM 0 HG2 GLU A 128 -6.811 -5.309 -4.735 1.00 1.00 H new ATOM 0 HG3 GLU A 128 -8.167 -6.380 -4.445 1.00 1.00 H new ATOM 817 N ALA A 129 -6.400 -2.658 -2.614 1.00 1.00 N ATOM 818 CA ALA A 129 -6.919 -1.346 -2.268 1.00 1.00 C ATOM 819 C ALA A 129 -8.355 -1.489 -1.762 1.00 1.00 C ATOM 820 O ALA A 129 -9.131 -2.279 -2.297 1.00 1.00 O ATOM 821 CB ALA A 129 -6.819 -0.421 -3.483 1.00 1.00 C ATOM 0 H ALA A 129 -5.987 -2.721 -3.544 1.00 1.00 H new ATOM 0 HA ALA A 129 -6.330 -0.898 -1.468 1.00 1.00 H new ATOM 0 HB1 ALA A 129 -7.208 0.564 -3.224 1.00 1.00 H new ATOM 0 HB2 ALA A 129 -5.776 -0.330 -3.786 1.00 1.00 H new ATOM 0 HB3 ALA A 129 -7.401 -0.836 -4.305 1.00 1.00 H new ATOM 827 N ASP A 130 -8.667 -0.712 -0.734 1.00 1.00 N ATOM 828 CA ASP A 130 -9.997 -0.742 -0.149 1.00 1.00 C ATOM 829 C ASP A 130 -10.601 0.663 -0.193 1.00 1.00 C ATOM 830 O ASP A 130 -11.577 0.945 0.500 1.00 1.00 O ATOM 831 CB ASP A 130 -9.945 -1.188 1.314 1.00 1.00 C ATOM 832 CG ASP A 130 -11.248 -1.778 1.857 1.00 1.00 C ATOM 833 OD1 ASP A 130 -11.876 -1.212 2.763 1.00 1.00 O ATOM 834 OD2 ASP A 130 -11.619 -2.882 1.302 1.00 1.00 O ATOM 0 H ASP A 130 -8.021 -0.058 -0.292 1.00 1.00 H new ATOM 0 HA ASP A 130 -10.601 -1.447 -0.720 1.00 1.00 H new ATOM 0 HB2 ASP A 130 -9.154 -1.930 1.424 1.00 1.00 H new ATOM 0 HB3 ASP A 130 -9.667 -0.332 1.929 1.00 1.00 H new ATOM 839 N LYS A 131 -9.995 1.507 -1.016 1.00 1.00 N ATOM 840 CA LYS A 131 -10.462 2.875 -1.161 1.00 1.00 C ATOM 841 C LYS A 131 -9.659 3.570 -2.261 1.00 1.00 C ATOM 842 O LYS A 131 -8.552 4.049 -2.019 1.00 1.00 O ATOM 843 CB LYS A 131 -10.416 3.602 0.186 1.00 1.00 C ATOM 844 CG LYS A 131 -11.670 4.453 0.392 1.00 1.00 C ATOM 845 CD LYS A 131 -11.305 5.861 0.869 1.00 1.00 C ATOM 846 CE LYS A 131 -12.559 6.659 1.232 1.00 1.00 C ATOM 847 NZ LYS A 131 -13.316 7.018 0.013 1.00 1.00 N ATOM 0 H LYS A 131 -9.185 1.270 -1.589 1.00 1.00 H new ATOM 0 HA LYS A 131 -11.507 2.890 -1.471 1.00 1.00 H new ATOM 0 HB2 LYS A 131 -10.329 2.875 0.993 1.00 1.00 H new ATOM 0 HB3 LYS A 131 -9.530 4.236 0.231 1.00 1.00 H new ATOM 0 HG2 LYS A 131 -12.229 4.515 -0.542 1.00 1.00 H new ATOM 0 HG3 LYS A 131 -12.322 3.975 1.123 1.00 1.00 H new ATOM 0 HD2 LYS A 131 -10.647 5.796 1.736 1.00 1.00 H new ATOM 0 HD3 LYS A 131 -10.752 6.382 0.087 1.00 1.00 H new ATOM 0 HE2 LYS A 131 -13.190 6.072 1.899 1.00 1.00 H new ATOM 0 HE3 LYS A 131 -12.278 7.563 1.772 1.00 1.00 H new ATOM 0 HZ1 LYS A 131 -14.136 7.602 0.273 1.00 1.00 H new ATOM 0 HZ2 LYS A 131 -12.701 7.553 -0.633 1.00 1.00 H new ATOM 0 HZ3 LYS A 131 -13.644 6.152 -0.460 1.00 1.00 H new ATOM 856 N SER A 132 -10.247 3.601 -3.448 1.00 1.00 N ATOM 857 CA SER A 132 -9.600 4.229 -4.588 1.00 1.00 C ATOM 858 C SER A 132 -8.917 5.527 -4.152 1.00 1.00 C ATOM 859 O SER A 132 -9.445 6.261 -3.317 1.00 1.00 O ATOM 860 CB SER A 132 -10.605 4.508 -5.708 1.00 1.00 C ATOM 861 OG SER A 132 -11.514 5.551 -5.362 1.00 1.00 O ATOM 0 H SER A 132 -11.165 3.201 -3.645 1.00 1.00 H new ATOM 0 HA SER A 132 -8.848 3.542 -4.975 1.00 1.00 H new ATOM 0 HB2 SER A 132 -10.069 4.781 -6.617 1.00 1.00 H new ATOM 0 HB3 SER A 132 -11.164 3.598 -5.929 1.00 1.00 H new ATOM 0 HG SER A 132 -12.138 5.700 -6.103 1.00 1.00 H new ATOM 866 N GLY A 133 -7.753 5.771 -4.737 1.00 1.00 N ATOM 867 CA GLY A 133 -6.993 6.968 -4.420 1.00 1.00 C ATOM 868 C GLY A 133 -5.678 7.004 -5.200 1.00 1.00 C ATOM 869 O GLY A 133 -5.371 6.079 -5.953 1.00 1.00 O ATOM 0 H GLY A 133 -7.318 5.160 -5.428 1.00 1.00 H new ATOM 0 HA2 GLY A 133 -7.585 7.852 -4.657 1.00 1.00 H new ATOM 0 HA3 GLY A 133 -6.787 7.000 -3.350 1.00 1.00 H new ATOM 873 N THR A 134 -4.935 8.082 -4.996 1.00 1.00 N ATOM 874 CA THR A 134 -3.659 8.252 -5.672 1.00 1.00 C ATOM 875 C THR A 134 -2.511 8.202 -4.662 1.00 1.00 C ATOM 876 O THR A 134 -2.701 8.504 -3.484 1.00 1.00 O ATOM 877 CB THR A 134 -3.715 9.558 -6.466 1.00 1.00 C ATOM 878 OG1 THR A 134 -4.047 9.146 -7.789 1.00 1.00 O ATOM 879 CG2 THR A 134 -2.339 10.213 -6.613 1.00 1.00 C ATOM 0 H THR A 134 -5.192 8.847 -4.372 1.00 1.00 H new ATOM 0 HA THR A 134 -3.470 7.438 -6.372 1.00 1.00 H new ATOM 0 HB THR A 134 -4.397 10.252 -5.975 1.00 1.00 H new ATOM 0 HG1 THR A 134 -4.106 9.932 -8.371 1.00 1.00 H new ATOM 0 HG21 THR A 134 -2.435 11.136 -7.184 1.00 1.00 H new ATOM 0 HG22 THR A 134 -1.936 10.437 -5.626 1.00 1.00 H new ATOM 0 HG23 THR A 134 -1.666 9.532 -7.134 1.00 1.00 H new ATOM 887 N VAL A 135 -1.344 7.819 -5.160 1.00 1.00 N ATOM 888 CA VAL A 135 -0.165 7.727 -4.316 1.00 1.00 C ATOM 889 C VAL A 135 -0.092 8.958 -3.410 1.00 1.00 C ATOM 890 O VAL A 135 -0.791 9.945 -3.640 1.00 1.00 O ATOM 891 CB VAL A 135 1.085 7.548 -5.181 1.00 1.00 C ATOM 892 CG1 VAL A 135 1.414 8.834 -5.942 1.00 1.00 C ATOM 893 CG2 VAL A 135 2.276 7.091 -4.336 1.00 1.00 C ATOM 0 H VAL A 135 -1.190 7.569 -6.137 1.00 1.00 H new ATOM 0 HA VAL A 135 -0.227 6.851 -3.670 1.00 1.00 H new ATOM 0 HB VAL A 135 0.876 6.769 -5.914 1.00 1.00 H new ATOM 0 HG11 VAL A 135 2.306 8.680 -6.549 1.00 1.00 H new ATOM 0 HG12 VAL A 135 0.577 9.099 -6.588 1.00 1.00 H new ATOM 0 HG13 VAL A 135 1.593 9.641 -5.232 1.00 1.00 H new ATOM 0 HG21 VAL A 135 3.151 6.971 -4.975 1.00 1.00 H new ATOM 0 HG22 VAL A 135 2.486 7.837 -3.569 1.00 1.00 H new ATOM 0 HG23 VAL A 135 2.041 6.139 -3.861 1.00 1.00 H new ATOM 903 N LYS A 136 0.758 8.861 -2.399 1.00 1.00 N ATOM 904 CA LYS A 136 0.930 9.954 -1.457 1.00 1.00 C ATOM 905 C LYS A 136 2.355 9.923 -0.901 1.00 1.00 C ATOM 906 O LYS A 136 3.045 10.940 -0.895 1.00 1.00 O ATOM 907 CB LYS A 136 -0.153 9.908 -0.379 1.00 1.00 C ATOM 908 CG LYS A 136 -0.780 11.288 -0.171 1.00 1.00 C ATOM 909 CD LYS A 136 -0.072 12.047 0.953 1.00 1.00 C ATOM 910 CE LYS A 136 -1.082 12.626 1.945 1.00 1.00 C ATOM 911 NZ LYS A 136 -0.385 13.292 3.067 1.00 1.00 N ATOM 0 H LYS A 136 1.336 8.042 -2.211 1.00 1.00 H new ATOM 0 HA LYS A 136 0.805 10.913 -1.959 1.00 1.00 H new ATOM 0 HB2 LYS A 136 -0.925 9.193 -0.665 1.00 1.00 H new ATOM 0 HB3 LYS A 136 0.277 9.555 0.558 1.00 1.00 H new ATOM 0 HG2 LYS A 136 -0.721 11.862 -1.096 1.00 1.00 H new ATOM 0 HG3 LYS A 136 -1.838 11.179 0.069 1.00 1.00 H new ATOM 0 HD2 LYS A 136 0.612 11.377 1.474 1.00 1.00 H new ATOM 0 HD3 LYS A 136 0.530 12.851 0.530 1.00 1.00 H new ATOM 0 HE2 LYS A 136 -1.731 13.340 1.437 1.00 1.00 H new ATOM 0 HE3 LYS A 136 -1.721 11.831 2.328 1.00 1.00 H new ATOM 0 HZ1 LYS A 136 -1.086 13.679 3.730 1.00 1.00 H new ATOM 0 HZ2 LYS A 136 0.215 12.602 3.562 1.00 1.00 H new ATOM 0 HZ3 LYS A 136 0.206 14.064 2.699 1.00 1.00 H new ATOM 920 N ALA A 137 2.753 8.742 -0.448 1.00 1.00 N ATOM 921 CA ALA A 137 4.083 8.565 0.110 1.00 1.00 C ATOM 922 C ALA A 137 4.214 7.145 0.663 1.00 1.00 C ATOM 923 O ALA A 137 3.331 6.668 1.375 1.00 1.00 O ATOM 924 CB ALA A 137 4.335 9.632 1.177 1.00 1.00 C ATOM 0 H ALA A 137 2.178 7.900 -0.456 1.00 1.00 H new ATOM 0 HA ALA A 137 4.843 8.690 -0.661 1.00 1.00 H new ATOM 0 HB1 ALA A 137 5.333 9.499 1.596 1.00 1.00 H new ATOM 0 HB2 ALA A 137 4.259 10.622 0.727 1.00 1.00 H new ATOM 0 HB3 ALA A 137 3.593 9.536 1.970 1.00 1.00 H new ATOM 930 N ILE A 138 5.322 6.508 0.314 1.00 1.00 N ATOM 931 CA ILE A 138 5.579 5.151 0.767 1.00 1.00 C ATOM 932 C ILE A 138 6.556 5.188 1.944 1.00 1.00 C ATOM 933 O ILE A 138 7.717 5.563 1.781 1.00 1.00 O ATOM 934 CB ILE A 138 6.052 4.279 -0.397 1.00 1.00 C ATOM 935 CG1 ILE A 138 5.411 4.726 -1.713 1.00 1.00 C ATOM 936 CG2 ILE A 138 5.800 2.798 -0.111 1.00 1.00 C ATOM 937 CD1 ILE A 138 3.886 4.762 -1.596 1.00 1.00 C ATOM 0 H ILE A 138 6.052 6.906 -0.277 1.00 1.00 H new ATOM 0 HA ILE A 138 4.660 4.689 1.129 1.00 1.00 H new ATOM 0 HB ILE A 138 7.129 4.407 -0.504 1.00 1.00 H new ATOM 0 HG12 ILE A 138 5.782 5.714 -1.985 1.00 1.00 H new ATOM 0 HG13 ILE A 138 5.702 4.045 -2.513 1.00 1.00 H new ATOM 0 HG21 ILE A 138 6.146 2.201 -0.955 1.00 1.00 H new ATOM 0 HG22 ILE A 138 6.342 2.504 0.788 1.00 1.00 H new ATOM 0 HG23 ILE A 138 4.733 2.633 0.038 1.00 1.00 H new ATOM 0 HD11 ILE A 138 3.456 5.083 -2.545 1.00 1.00 H new ATOM 0 HD12 ILE A 138 3.517 3.767 -1.348 1.00 1.00 H new ATOM 0 HD13 ILE A 138 3.598 5.462 -0.812 1.00 1.00 H new ATOM 948 N LEU A 139 6.051 4.794 3.104 1.00 1.00 N ATOM 949 CA LEU A 139 6.865 4.777 4.308 1.00 1.00 C ATOM 950 C LEU A 139 7.710 3.502 4.329 1.00 1.00 C ATOM 951 O LEU A 139 8.899 3.546 4.639 1.00 1.00 O ATOM 952 CB LEU A 139 5.988 4.954 5.548 1.00 1.00 C ATOM 953 CG LEU A 139 4.572 5.477 5.301 1.00 1.00 C ATOM 954 CD1 LEU A 139 3.865 5.795 6.620 1.00 1.00 C ATOM 955 CD2 LEU A 139 4.588 6.679 4.355 1.00 1.00 C ATOM 0 H LEU A 139 5.088 4.484 3.236 1.00 1.00 H new ATOM 0 HA LEU A 139 7.558 5.619 4.312 1.00 1.00 H new ATOM 0 HB2 LEU A 139 5.915 3.993 6.057 1.00 1.00 H new ATOM 0 HB3 LEU A 139 6.492 5.638 6.230 1.00 1.00 H new ATOM 0 HG LEU A 139 3.999 4.689 4.811 1.00 1.00 H new ATOM 0 HD11 LEU A 139 2.860 6.165 6.414 1.00 1.00 H new ATOM 0 HD12 LEU A 139 3.802 4.891 7.226 1.00 1.00 H new ATOM 0 HD13 LEU A 139 4.428 6.556 7.160 1.00 1.00 H new ATOM 0 HD21 LEU A 139 3.569 7.031 4.197 1.00 1.00 H new ATOM 0 HD22 LEU A 139 5.184 7.479 4.794 1.00 1.00 H new ATOM 0 HD23 LEU A 139 5.023 6.385 3.400 1.00 1.00 H new ATOM 966 N VAL A 140 7.063 2.395 3.994 1.00 1.00 N ATOM 967 CA VAL A 140 7.740 1.110 3.972 1.00 1.00 C ATOM 968 C VAL A 140 8.547 0.987 2.678 1.00 1.00 C ATOM 969 O VAL A 140 8.372 1.780 1.755 1.00 1.00 O ATOM 970 CB VAL A 140 6.724 -0.021 4.152 1.00 1.00 C ATOM 971 CG1 VAL A 140 5.693 -0.016 3.023 1.00 1.00 C ATOM 972 CG2 VAL A 140 7.425 -1.377 4.250 1.00 1.00 C ATOM 0 H VAL A 140 6.077 2.362 3.736 1.00 1.00 H new ATOM 0 HA VAL A 140 8.442 1.034 4.803 1.00 1.00 H new ATOM 0 HB VAL A 140 6.194 0.150 5.089 1.00 1.00 H new ATOM 0 HG11 VAL A 140 4.983 -0.829 3.175 1.00 1.00 H new ATOM 0 HG12 VAL A 140 5.160 0.935 3.021 1.00 1.00 H new ATOM 0 HG13 VAL A 140 6.199 -0.150 2.067 1.00 1.00 H new ATOM 0 HG21 VAL A 140 6.681 -2.163 4.377 1.00 1.00 H new ATOM 0 HG22 VAL A 140 7.993 -1.560 3.338 1.00 1.00 H new ATOM 0 HG23 VAL A 140 8.102 -1.376 5.105 1.00 1.00 H new ATOM 982 N GLU A 141 9.415 -0.014 2.653 1.00 1.00 N ATOM 983 CA GLU A 141 10.250 -0.251 1.487 1.00 1.00 C ATOM 984 C GLU A 141 9.997 -1.653 0.928 1.00 1.00 C ATOM 985 O GLU A 141 9.308 -2.459 1.553 1.00 1.00 O ATOM 986 CB GLU A 141 11.730 -0.054 1.823 1.00 1.00 C ATOM 987 CG GLU A 141 12.125 1.420 1.716 1.00 1.00 C ATOM 988 CD GLU A 141 12.968 1.850 2.918 1.00 1.00 C ATOM 989 OE1 GLU A 141 14.134 2.239 2.750 1.00 1.00 O ATOM 990 OE2 GLU A 141 12.373 1.771 4.060 1.00 1.00 O ATOM 0 H GLU A 141 9.558 -0.670 3.421 1.00 1.00 H new ATOM 0 HA GLU A 141 9.985 0.478 0.721 1.00 1.00 H new ATOM 0 HB2 GLU A 141 11.929 -0.415 2.832 1.00 1.00 H new ATOM 0 HB3 GLU A 141 12.343 -0.649 1.145 1.00 1.00 H new ATOM 0 HG2 GLU A 141 12.686 1.584 0.796 1.00 1.00 H new ATOM 0 HG3 GLU A 141 11.228 2.037 1.657 1.00 1.00 H new ATOM 996 N SER A 142 10.566 -1.900 -0.241 1.00 1.00 N ATOM 997 CA SER A 142 10.411 -3.191 -0.892 1.00 1.00 C ATOM 998 C SER A 142 11.390 -4.201 -0.289 1.00 1.00 C ATOM 999 O SER A 142 12.547 -4.269 -0.700 1.00 1.00 O ATOM 1000 CB SER A 142 10.628 -3.076 -2.402 1.00 1.00 C ATOM 1001 OG SER A 142 10.239 -4.264 -3.088 1.00 1.00 O ATOM 0 H SER A 142 11.136 -1.229 -0.756 1.00 1.00 H new ATOM 0 HA SER A 142 9.392 -3.539 -0.725 1.00 1.00 H new ATOM 0 HB2 SER A 142 10.057 -2.231 -2.787 1.00 1.00 H new ATOM 0 HB3 SER A 142 11.679 -2.869 -2.603 1.00 1.00 H new ATOM 0 HG SER A 142 10.391 -4.151 -4.050 1.00 1.00 H new ATOM 1006 N GLY A 143 10.888 -4.961 0.674 1.00 1.00 N ATOM 1007 CA GLY A 143 11.704 -5.964 1.336 1.00 1.00 C ATOM 1008 C GLY A 143 11.898 -5.624 2.815 1.00 1.00 C ATOM 1009 O GLY A 143 12.486 -6.404 3.563 1.00 1.00 O ATOM 0 H GLY A 143 9.927 -4.902 1.011 1.00 1.00 H new ATOM 0 HA2 GLY A 143 11.231 -6.942 1.243 1.00 1.00 H new ATOM 0 HA3 GLY A 143 12.674 -6.031 0.844 1.00 1.00 H new ATOM 1013 N GLN A 144 11.392 -4.459 3.193 1.00 1.00 N ATOM 1014 CA GLN A 144 11.502 -4.006 4.569 1.00 1.00 C ATOM 1015 C GLN A 144 10.446 -4.692 5.439 1.00 1.00 C ATOM 1016 O GLN A 144 9.371 -5.044 4.955 1.00 1.00 O ATOM 1017 CB GLN A 144 11.380 -2.484 4.657 1.00 1.00 C ATOM 1018 CG GLN A 144 12.758 -1.830 4.775 1.00 1.00 C ATOM 1019 CD GLN A 144 13.717 -2.378 3.716 1.00 1.00 C ATOM 1020 OE1 GLN A 144 13.167 -2.527 2.514 1.00 1.00 O flip ATOM 1021 NE2 GLN A 144 14.880 -2.646 3.973 1.00 1.00 N flip ATOM 0 H GLN A 144 10.905 -3.815 2.570 1.00 1.00 H new ATOM 0 HA GLN A 144 12.488 -4.280 4.944 1.00 1.00 H new ATOM 0 HB2 GLN A 144 10.868 -2.105 3.773 1.00 1.00 H new ATOM 0 HB3 GLN A 144 10.770 -2.214 5.519 1.00 1.00 H new ATOM 0 HG2 GLN A 144 12.663 -0.750 4.661 1.00 1.00 H new ATOM 0 HG3 GLN A 144 13.166 -2.011 5.769 1.00 1.00 H new ATOM 0 HE21 GLN A 144 15.238 -2.508 4.918 1.00 1.00 H new ATOM 0 HE22 GLN A 144 15.493 -3.008 3.243 1.00 1.00 H new ATOM 1028 N PRO A 145 10.799 -4.865 6.741 1.00 1.00 N ATOM 1029 CA PRO A 145 9.894 -5.503 7.683 1.00 1.00 C ATOM 1030 C PRO A 145 8.760 -4.556 8.080 1.00 1.00 C ATOM 1031 O PRO A 145 8.876 -3.341 7.921 1.00 1.00 O ATOM 1032 CB PRO A 145 10.770 -5.906 8.858 1.00 1.00 C ATOM 1033 CG PRO A 145 12.035 -5.073 8.740 1.00 1.00 C ATOM 1034 CD PRO A 145 12.064 -4.462 7.350 1.00 1.00 C ATOM 0 HA PRO A 145 9.392 -6.373 7.261 1.00 1.00 H new ATOM 0 HB2 PRO A 145 10.265 -5.716 9.805 1.00 1.00 H new ATOM 0 HB3 PRO A 145 10.999 -6.971 8.827 1.00 1.00 H new ATOM 0 HG2 PRO A 145 12.050 -4.292 9.500 1.00 1.00 H new ATOM 0 HG3 PRO A 145 12.917 -5.693 8.903 1.00 1.00 H new ATOM 0 HD2 PRO A 145 12.153 -3.377 7.396 1.00 1.00 H new ATOM 0 HD3 PRO A 145 12.915 -4.827 6.775 1.00 1.00 H new ATOM 1039 N VAL A 146 7.689 -5.146 8.589 1.00 1.00 N ATOM 1040 CA VAL A 146 6.535 -4.370 9.010 1.00 1.00 C ATOM 1041 C VAL A 146 5.982 -4.953 10.312 1.00 1.00 C ATOM 1042 O VAL A 146 6.200 -6.125 10.614 1.00 1.00 O ATOM 1043 CB VAL A 146 5.497 -4.325 7.887 1.00 1.00 C ATOM 1044 CG1 VAL A 146 6.139 -3.910 6.563 1.00 1.00 C ATOM 1045 CG2 VAL A 146 4.778 -5.669 7.751 1.00 1.00 C ATOM 0 H VAL A 146 7.596 -6.153 8.720 1.00 1.00 H new ATOM 0 HA VAL A 146 6.821 -3.338 9.211 1.00 1.00 H new ATOM 0 HB VAL A 146 4.753 -3.572 8.148 1.00 1.00 H new ATOM 0 HG11 VAL A 146 5.379 -3.886 5.782 1.00 1.00 H new ATOM 0 HG12 VAL A 146 6.582 -2.920 6.668 1.00 1.00 H new ATOM 0 HG13 VAL A 146 6.914 -4.628 6.294 1.00 1.00 H new ATOM 0 HG21 VAL A 146 4.046 -5.610 6.946 1.00 1.00 H new ATOM 0 HG22 VAL A 146 5.505 -6.449 7.524 1.00 1.00 H new ATOM 0 HG23 VAL A 146 4.271 -5.907 8.686 1.00 1.00 H new ATOM 1055 N GLU A 147 5.277 -4.106 11.050 1.00 1.00 N ATOM 1056 CA GLU A 147 4.692 -4.522 12.313 1.00 1.00 C ATOM 1057 C GLU A 147 3.206 -4.157 12.354 1.00 1.00 C ATOM 1058 O GLU A 147 2.773 -3.224 11.681 1.00 1.00 O ATOM 1059 CB GLU A 147 5.441 -3.905 13.495 1.00 1.00 C ATOM 1060 CG GLU A 147 6.061 -4.989 14.378 1.00 1.00 C ATOM 1061 CD GLU A 147 7.182 -5.723 13.640 1.00 1.00 C ATOM 1062 OE1 GLU A 147 7.698 -5.215 12.632 1.00 1.00 O ATOM 1063 OE2 GLU A 147 7.517 -6.860 14.149 1.00 1.00 O ATOM 0 H GLU A 147 5.098 -3.134 10.797 1.00 1.00 H new ATOM 0 HA GLU A 147 4.783 -5.605 12.394 1.00 1.00 H new ATOM 0 HB2 GLU A 147 6.222 -3.240 13.128 1.00 1.00 H new ATOM 0 HB3 GLU A 147 4.756 -3.297 14.086 1.00 1.00 H new ATOM 0 HG2 GLU A 147 6.455 -4.539 15.290 1.00 1.00 H new ATOM 0 HG3 GLU A 147 5.293 -5.701 14.680 1.00 1.00 H new ATOM 1069 N PHE A 148 2.466 -4.913 13.152 1.00 1.00 N ATOM 1070 CA PHE A 148 1.038 -4.681 13.291 1.00 1.00 C ATOM 1071 C PHE A 148 0.763 -3.298 13.883 1.00 1.00 C ATOM 1072 O PHE A 148 1.409 -2.890 14.847 1.00 1.00 O ATOM 1073 CB PHE A 148 0.503 -5.748 14.248 1.00 1.00 C ATOM 1074 CG PHE A 148 -0.949 -5.527 14.677 1.00 1.00 C ATOM 1075 CD1 PHE A 148 -1.240 -4.625 15.653 1.00 1.00 C ATOM 1076 CD2 PHE A 148 -1.948 -6.231 14.082 1.00 1.00 C ATOM 1077 CE1 PHE A 148 -2.587 -4.420 16.052 1.00 1.00 C ATOM 1078 CE2 PHE A 148 -3.297 -6.025 14.480 1.00 1.00 C ATOM 1079 CZ PHE A 148 -3.587 -5.124 15.457 1.00 1.00 C ATOM 0 H PHE A 148 2.829 -5.687 13.709 1.00 1.00 H new ATOM 0 HA PHE A 148 0.556 -4.731 12.315 1.00 1.00 H new ATOM 0 HB2 PHE A 148 0.585 -6.724 13.770 1.00 1.00 H new ATOM 0 HB3 PHE A 148 1.134 -5.774 15.137 1.00 1.00 H new ATOM 0 HD1 PHE A 148 -0.446 -4.065 16.124 1.00 1.00 H new ATOM 0 HD2 PHE A 148 -1.717 -6.947 13.307 1.00 1.00 H new ATOM 0 HE1 PHE A 148 -2.818 -3.705 16.828 1.00 1.00 H new ATOM 0 HE2 PHE A 148 -4.091 -6.583 14.007 1.00 1.00 H new ATOM 0 HZ PHE A 148 -4.612 -4.968 15.760 1.00 1.00 H new ATOM 1088 N ASP A 149 -0.198 -2.613 13.281 1.00 1.00 N ATOM 1089 CA ASP A 149 -0.567 -1.283 13.737 1.00 1.00 C ATOM 1090 C ASP A 149 0.382 -0.254 13.118 1.00 1.00 C ATOM 1091 O ASP A 149 0.187 0.949 13.278 1.00 1.00 O ATOM 1092 CB ASP A 149 -0.458 -1.172 15.259 1.00 1.00 C ATOM 1093 CG ASP A 149 -1.333 -0.089 15.894 1.00 1.00 C ATOM 1094 OD1 ASP A 149 -0.844 0.770 16.640 1.00 1.00 O ATOM 1095 OD2 ASP A 149 -2.585 -0.153 15.589 1.00 1.00 O ATOM 0 H ASP A 149 -0.732 -2.954 12.482 1.00 1.00 H new ATOM 0 HA ASP A 149 -1.598 -1.097 13.435 1.00 1.00 H new ATOM 0 HB2 ASP A 149 -0.722 -2.134 15.698 1.00 1.00 H new ATOM 0 HB3 ASP A 149 0.582 -0.977 15.520 1.00 1.00 H new ATOM 1100 N GLU A 150 1.388 -0.767 12.425 1.00 1.00 N ATOM 1101 CA GLU A 150 2.367 0.092 11.781 1.00 1.00 C ATOM 1102 C GLU A 150 1.894 0.478 10.379 1.00 1.00 C ATOM 1103 O GLU A 150 1.182 -0.285 9.727 1.00 1.00 O ATOM 1104 CB GLU A 150 3.739 -0.583 11.730 1.00 1.00 C ATOM 1105 CG GLU A 150 4.121 -1.154 13.098 1.00 1.00 C ATOM 1106 CD GLU A 150 4.054 -0.075 14.181 1.00 1.00 C ATOM 1107 OE1 GLU A 150 3.348 -0.247 15.185 1.00 1.00 O ATOM 1108 OE2 GLU A 150 4.770 0.973 13.950 1.00 1.00 O ATOM 0 H GLU A 150 1.546 -1.766 12.295 1.00 1.00 H new ATOM 0 HA GLU A 150 2.468 1.002 12.372 1.00 1.00 H new ATOM 0 HB2 GLU A 150 3.728 -1.382 10.989 1.00 1.00 H new ATOM 0 HB3 GLU A 150 4.491 0.138 11.410 1.00 1.00 H new ATOM 0 HG2 GLU A 150 3.450 -1.974 13.354 1.00 1.00 H new ATOM 0 HG3 GLU A 150 5.128 -1.569 13.055 1.00 1.00 H new ATOM 1114 N PRO A 151 2.319 1.695 9.943 1.00 1.00 N ATOM 1115 CA PRO A 151 1.947 2.192 8.630 1.00 1.00 C ATOM 1116 C PRO A 151 2.740 1.483 7.530 1.00 1.00 C ATOM 1117 O PRO A 151 3.707 0.777 7.813 1.00 1.00 O ATOM 1118 CB PRO A 151 2.215 3.687 8.685 1.00 1.00 C ATOM 1119 CG PRO A 151 3.157 3.899 9.858 1.00 1.00 C ATOM 1120 CD PRO A 151 3.162 2.625 10.687 1.00 1.00 C ATOM 0 HA PRO A 151 0.903 1.996 8.387 1.00 1.00 H new ATOM 0 HB2 PRO A 151 2.664 4.038 7.756 1.00 1.00 H new ATOM 0 HB3 PRO A 151 1.289 4.245 8.822 1.00 1.00 H new ATOM 0 HG2 PRO A 151 4.162 4.128 9.504 1.00 1.00 H new ATOM 0 HG3 PRO A 151 2.831 4.746 10.462 1.00 1.00 H new ATOM 0 HD2 PRO A 151 4.173 2.234 10.807 1.00 1.00 H new ATOM 0 HD3 PRO A 151 2.768 2.802 11.688 1.00 1.00 H new ATOM 1125 N LEU A 152 2.300 1.693 6.298 1.00 1.00 N ATOM 1126 CA LEU A 152 2.956 1.082 5.155 1.00 1.00 C ATOM 1127 C LEU A 152 3.032 2.098 4.013 1.00 1.00 C ATOM 1128 O LEU A 152 4.074 2.713 3.793 1.00 1.00 O ATOM 1129 CB LEU A 152 2.258 -0.223 4.770 1.00 1.00 C ATOM 1130 CG LEU A 152 2.192 -1.295 5.860 1.00 1.00 C ATOM 1131 CD1 LEU A 152 1.242 -2.426 5.460 1.00 1.00 C ATOM 1132 CD2 LEU A 152 3.589 -1.815 6.204 1.00 1.00 C ATOM 0 H LEU A 152 1.497 2.278 6.067 1.00 1.00 H new ATOM 0 HA LEU A 152 3.980 0.806 5.407 1.00 1.00 H new ATOM 0 HB2 LEU A 152 1.241 0.011 4.456 1.00 1.00 H new ATOM 0 HB3 LEU A 152 2.770 -0.644 3.905 1.00 1.00 H new ATOM 0 HG LEU A 152 1.787 -0.838 6.763 1.00 1.00 H new ATOM 0 HD11 LEU A 152 1.214 -3.174 6.252 1.00 1.00 H new ATOM 0 HD12 LEU A 152 0.241 -2.023 5.305 1.00 1.00 H new ATOM 0 HD13 LEU A 152 1.594 -2.887 4.537 1.00 1.00 H new ATOM 0 HD21 LEU A 152 3.513 -2.576 6.981 1.00 1.00 H new ATOM 0 HD22 LEU A 152 4.045 -2.250 5.314 1.00 1.00 H new ATOM 0 HD23 LEU A 152 4.206 -0.991 6.562 1.00 1.00 H new ATOM 1143 N VAL A 153 1.914 2.244 3.317 1.00 1.00 N ATOM 1144 CA VAL A 153 1.841 3.175 2.204 1.00 1.00 C ATOM 1145 C VAL A 153 0.752 4.213 2.484 1.00 1.00 C ATOM 1146 O VAL A 153 -0.313 3.877 2.998 1.00 1.00 O ATOM 1147 CB VAL A 153 1.617 2.411 0.898 1.00 1.00 C ATOM 1148 CG1 VAL A 153 1.112 3.345 -0.204 1.00 1.00 C ATOM 1149 CG2 VAL A 153 2.892 1.686 0.460 1.00 1.00 C ATOM 0 H VAL A 153 1.051 1.733 3.503 1.00 1.00 H new ATOM 0 HA VAL A 153 2.782 3.713 2.093 1.00 1.00 H new ATOM 0 HB VAL A 153 0.849 1.659 1.078 1.00 1.00 H new ATOM 0 HG11 VAL A 153 0.961 2.777 -1.122 1.00 1.00 H new ATOM 0 HG12 VAL A 153 0.168 3.794 0.104 1.00 1.00 H new ATOM 0 HG13 VAL A 153 1.847 4.130 -0.380 1.00 1.00 H new ATOM 0 HG21 VAL A 153 2.705 1.151 -0.471 1.00 1.00 H new ATOM 0 HG22 VAL A 153 3.690 2.413 0.307 1.00 1.00 H new ATOM 0 HG23 VAL A 153 3.191 0.977 1.232 1.00 1.00 H new ATOM 1159 N VAL A 154 1.059 5.454 2.133 1.00 1.00 N ATOM 1160 CA VAL A 154 0.119 6.542 2.340 1.00 1.00 C ATOM 1161 C VAL A 154 -0.450 6.983 0.990 1.00 1.00 C ATOM 1162 O VAL A 154 0.294 7.394 0.102 1.00 1.00 O ATOM 1163 CB VAL A 154 0.800 7.683 3.102 1.00 1.00 C ATOM 1164 CG1 VAL A 154 -0.167 8.846 3.326 1.00 1.00 C ATOM 1165 CG2 VAL A 154 1.378 7.186 4.428 1.00 1.00 C ATOM 0 H VAL A 154 1.944 5.729 1.707 1.00 1.00 H new ATOM 0 HA VAL A 154 -0.719 6.211 2.954 1.00 1.00 H new ATOM 0 HB VAL A 154 1.626 8.048 2.492 1.00 1.00 H new ATOM 0 HG11 VAL A 154 0.342 9.643 3.869 1.00 1.00 H new ATOM 0 HG12 VAL A 154 -0.510 9.225 2.363 1.00 1.00 H new ATOM 0 HG13 VAL A 154 -1.023 8.501 3.906 1.00 1.00 H new ATOM 0 HG21 VAL A 154 1.856 8.015 4.950 1.00 1.00 H new ATOM 0 HG22 VAL A 154 0.576 6.782 5.046 1.00 1.00 H new ATOM 0 HG23 VAL A 154 2.114 6.406 4.234 1.00 1.00 H new ATOM 1175 N ILE A 155 -1.766 6.880 0.878 1.00 1.00 N ATOM 1176 CA ILE A 155 -2.445 7.262 -0.349 1.00 1.00 C ATOM 1177 C ILE A 155 -3.170 8.592 -0.133 1.00 1.00 C ATOM 1178 O ILE A 155 -3.377 9.013 1.005 1.00 1.00 O ATOM 1179 CB ILE A 155 -3.361 6.134 -0.829 1.00 1.00 C ATOM 1180 CG1 ILE A 155 -2.569 5.075 -1.599 1.00 1.00 C ATOM 1181 CG2 ILE A 155 -4.528 6.686 -1.648 1.00 1.00 C ATOM 1182 CD1 ILE A 155 -2.266 3.865 -0.713 1.00 1.00 C ATOM 0 H ILE A 155 -2.380 6.538 1.617 1.00 1.00 H new ATOM 0 HA ILE A 155 -1.723 7.418 -1.150 1.00 1.00 H new ATOM 0 HB ILE A 155 -3.787 5.644 0.046 1.00 1.00 H new ATOM 0 HG12 ILE A 155 -3.136 4.757 -2.474 1.00 1.00 H new ATOM 0 HG13 ILE A 155 -1.636 5.506 -1.963 1.00 1.00 H new ATOM 0 HG21 ILE A 155 -5.163 5.863 -1.977 1.00 1.00 H new ATOM 0 HG22 ILE A 155 -5.111 7.372 -1.034 1.00 1.00 H new ATOM 0 HG23 ILE A 155 -4.143 7.217 -2.518 1.00 1.00 H new ATOM 0 HD11 ILE A 155 -1.702 3.128 -1.285 1.00 1.00 H new ATOM 0 HD12 ILE A 155 -1.678 4.183 0.148 1.00 1.00 H new ATOM 0 HD13 ILE A 155 -3.201 3.421 -0.371 1.00 1.00 H new ATOM 1193 N GLU A 156 -3.536 9.217 -1.242 1.00 1.00 N ATOM 1194 CA GLU A 156 -4.234 10.490 -1.189 1.00 1.00 C ATOM 1195 C GLU A 156 -5.670 10.331 -1.692 1.00 1.00 C ATOM 1196 O GLU A 156 -6.000 10.777 -2.790 1.00 1.00 O ATOM 1197 CB GLU A 156 -3.487 11.558 -1.990 1.00 1.00 C ATOM 1198 CG GLU A 156 -3.699 12.947 -1.384 1.00 1.00 C ATOM 1199 CD GLU A 156 -4.033 13.974 -2.468 1.00 1.00 C ATOM 1200 OE1 GLU A 156 -5.163 13.991 -2.978 1.00 1.00 O ATOM 1201 OE2 GLU A 156 -3.069 14.773 -2.776 1.00 1.00 O ATOM 0 H GLU A 156 -3.362 8.865 -2.183 1.00 1.00 H new ATOM 0 HA GLU A 156 -4.269 10.819 -0.151 1.00 1.00 H new ATOM 0 HB2 GLU A 156 -2.422 11.325 -2.010 1.00 1.00 H new ATOM 0 HB3 GLU A 156 -3.834 11.551 -3.023 1.00 1.00 H new ATOM 0 HG2 GLU A 156 -4.507 12.909 -0.653 1.00 1.00 H new ATOM 0 HG3 GLU A 156 -2.800 13.256 -0.850 1.00 1.00 H new