USER MOD reduce.3.24.130724 H: found=0, std=0, add=590, rem=0, adj=13 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= -0.978 K(o=-0.98,f=-1.8!) USER MOD Single : A 85 SER OG : rot -102:sc= -0.757 USER MOD Single : A 87 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 TYR OH : rot 180:sc= 0.147 USER MOD Single : A 94 THR OG1 : rot 117:sc= 0.271 USER MOD Single : A 96 SER OG : rot -151:sc= -1.12 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 GLN : amide:sc= -2.15 K(o=-2.2,f=-3.1!) USER MOD Single : A 108 LYS NZ :NH3+ 153:sc= -0.0437 (180deg=-0.332) USER MOD Single : A 110 ASN : amide:sc= -0.343 K(o=-0.34,f=-0.98) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 CYS SG : rot 159:sc= -1.33! USER MOD Single : A 121 MET CE :methyl -150:sc= -0.116 (180deg=-0.682) 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 -151:sc= -0.461 (180deg=-1.81!) USER MOD Single : A 125 ASN : amide:sc= -0.941 K(o=-0.94,f=-0.28) USER MOD Single : A 126 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 SER OG : rot 180:sc=-0.00422 USER MOD Single : A 144 GLN : amide:sc= -1.91! C(o=-1.9!,f=-3.7!) USER MOD ----------------------------------------------------------------- ATOM 130 N HIS A 81 -5.522 8.067 3.066 1.00 1.00 N ATOM 131 CA HIS A 81 -5.674 6.720 3.588 1.00 1.00 C ATOM 132 C HIS A 81 -4.303 6.046 3.674 1.00 1.00 C ATOM 133 O HIS A 81 -3.756 5.611 2.661 1.00 1.00 O ATOM 134 CB HIS A 81 -6.676 5.922 2.751 1.00 1.00 C ATOM 135 CG HIS A 81 -6.357 4.450 2.651 1.00 1.00 C ATOM 136 ND1 HIS A 81 -5.951 3.695 3.738 1.00 1.00 N ATOM 137 CD2 HIS A 81 -6.391 3.600 1.585 1.00 1.00 C ATOM 138 CE1 HIS A 81 -5.751 2.450 3.332 1.00 1.00 C ATOM 139 NE2 HIS A 81 -6.024 2.394 1.997 1.00 1.00 N ATOM 0 HA HIS A 81 -6.084 6.761 4.597 1.00 1.00 H new ATOM 0 HB2 HIS A 81 -7.670 6.039 3.183 1.00 1.00 H new ATOM 0 HB3 HIS A 81 -6.713 6.344 1.747 1.00 1.00 H new ATOM 0 HD2 HIS A 81 -6.670 3.864 0.576 1.00 1.00 H new ATOM 0 HE1 HIS A 81 -5.429 1.625 3.949 1.00 1.00 H new ATOM 0 HE2 HIS A 81 -5.957 1.561 1.412 1.00 1.00 H new ATOM 146 N ILE A 82 -3.788 5.979 4.892 1.00 1.00 N ATOM 147 CA ILE A 82 -2.491 5.365 5.123 1.00 1.00 C ATOM 148 C ILE A 82 -2.682 3.873 5.409 1.00 1.00 C ATOM 149 O ILE A 82 -3.316 3.503 6.395 1.00 1.00 O ATOM 150 CB ILE A 82 -1.734 6.110 6.226 1.00 1.00 C ATOM 151 CG1 ILE A 82 -1.336 7.513 5.765 1.00 1.00 C ATOM 152 CG2 ILE A 82 -0.528 5.300 6.706 1.00 1.00 C ATOM 153 CD1 ILE A 82 -1.360 8.501 6.932 1.00 1.00 C ATOM 0 H ILE A 82 -4.245 6.340 5.730 1.00 1.00 H new ATOM 0 HA ILE A 82 -1.868 5.443 4.232 1.00 1.00 H new ATOM 0 HB ILE A 82 -2.402 6.229 7.079 1.00 1.00 H new ATOM 0 HG12 ILE A 82 -0.338 7.486 5.327 1.00 1.00 H new ATOM 0 HG13 ILE A 82 -2.018 7.850 4.984 1.00 1.00 H new ATOM 0 HG21 ILE A 82 -0.008 5.851 7.489 1.00 1.00 H new ATOM 0 HG22 ILE A 82 -0.867 4.342 7.100 1.00 1.00 H new ATOM 0 HG23 ILE A 82 0.151 5.129 5.871 1.00 1.00 H new ATOM 0 HD11 ILE A 82 -1.073 9.491 6.577 1.00 1.00 H new ATOM 0 HD12 ILE A 82 -2.365 8.543 7.352 1.00 1.00 H new ATOM 0 HD13 ILE A 82 -0.659 8.174 7.700 1.00 1.00 H new ATOM 164 N VAL A 83 -2.120 3.058 4.527 1.00 1.00 N ATOM 165 CA VAL A 83 -2.220 1.617 4.673 1.00 1.00 C ATOM 166 C VAL A 83 -1.444 1.178 5.915 1.00 1.00 C ATOM 167 O VAL A 83 -0.232 1.369 5.994 1.00 1.00 O ATOM 168 CB VAL A 83 -1.740 0.928 3.394 1.00 1.00 C ATOM 169 CG1 VAL A 83 -1.473 -0.558 3.638 1.00 1.00 C ATOM 170 CG2 VAL A 83 -2.743 1.125 2.255 1.00 1.00 C ATOM 0 H VAL A 83 -1.595 3.369 3.710 1.00 1.00 H new ATOM 0 HA VAL A 83 -3.259 1.319 4.818 1.00 1.00 H new ATOM 0 HB VAL A 83 -0.800 1.393 3.097 1.00 1.00 H new ATOM 0 HG11 VAL A 83 -1.133 -1.023 2.713 1.00 1.00 H new ATOM 0 HG12 VAL A 83 -0.705 -0.669 4.403 1.00 1.00 H new ATOM 0 HG13 VAL A 83 -2.391 -1.042 3.972 1.00 1.00 H new ATOM 0 HG21 VAL A 83 -2.377 0.625 1.358 1.00 1.00 H new ATOM 0 HG22 VAL A 83 -3.705 0.700 2.540 1.00 1.00 H new ATOM 0 HG23 VAL A 83 -2.861 2.190 2.055 1.00 1.00 H new ATOM 180 N ARG A 84 -2.175 0.597 6.856 1.00 1.00 N ATOM 181 CA ARG A 84 -1.569 0.130 8.092 1.00 1.00 C ATOM 182 C ARG A 84 -1.466 -1.397 8.088 1.00 1.00 C ATOM 183 O ARG A 84 -2.473 -2.091 8.227 1.00 1.00 O ATOM 184 CB ARG A 84 -2.384 0.577 9.307 1.00 1.00 C ATOM 185 CG ARG A 84 -2.399 2.102 9.426 1.00 1.00 C ATOM 186 CD ARG A 84 -3.640 2.580 10.184 1.00 1.00 C ATOM 187 NE ARG A 84 -4.280 3.697 9.456 1.00 1.00 N ATOM 188 CZ ARG A 84 -3.956 4.997 9.626 1.00 1.00 C ATOM 189 NH1 ARG A 84 -2.994 5.354 10.505 1.00 1.00 N ATOM 190 NH2 ARG A 84 -4.593 5.913 8.922 1.00 1.00 N ATOM 0 H ARG A 84 -3.180 0.439 6.787 1.00 1.00 H new ATOM 0 HA ARG A 84 -0.572 0.564 8.158 1.00 1.00 H new ATOM 0 HB2 ARG A 84 -3.405 0.205 9.221 1.00 1.00 H new ATOM 0 HB3 ARG A 84 -1.962 0.142 10.213 1.00 1.00 H new ATOM 0 HG2 ARG A 84 -1.500 2.439 9.943 1.00 1.00 H new ATOM 0 HG3 ARG A 84 -2.381 2.548 8.432 1.00 1.00 H new ATOM 0 HD2 ARG A 84 -4.346 1.757 10.297 1.00 1.00 H new ATOM 0 HD3 ARG A 84 -3.362 2.902 11.188 1.00 1.00 H new ATOM 0 HE ARG A 84 -5.012 3.471 8.783 1.00 1.00 H new ATOM 0 HH11 ARG A 84 -2.507 4.640 11.046 1.00 1.00 H new ATOM 0 HH12 ARG A 84 -2.755 6.338 10.628 1.00 1.00 H new ATOM 0 HH21 ARG A 84 -5.318 5.635 8.261 1.00 1.00 H new ATOM 0 HH22 ARG A 84 -4.360 6.899 9.039 1.00 1.00 H new ATOM 199 N SER A 85 -0.242 -1.875 7.927 1.00 1.00 N ATOM 200 CA SER A 85 0.005 -3.307 7.904 1.00 1.00 C ATOM 201 C SER A 85 -0.816 -3.998 8.995 1.00 1.00 C ATOM 202 O SER A 85 -0.497 -3.891 10.178 1.00 1.00 O ATOM 203 CB SER A 85 1.493 -3.612 8.086 1.00 1.00 C ATOM 204 OG SER A 85 1.923 -4.687 7.254 1.00 1.00 O ATOM 0 H SER A 85 0.590 -1.297 7.811 1.00 1.00 H new ATOM 0 HA SER A 85 -0.301 -3.691 6.931 1.00 1.00 H new ATOM 0 HB2 SER A 85 2.077 -2.720 7.857 1.00 1.00 H new ATOM 0 HB3 SER A 85 1.687 -3.861 9.129 1.00 1.00 H new ATOM 0 HG SER A 85 1.998 -5.505 7.789 1.00 1.00 H new ATOM 209 N PRO A 86 -1.885 -4.709 8.547 1.00 1.00 N ATOM 210 CA PRO A 86 -2.753 -5.417 9.471 1.00 1.00 C ATOM 211 C PRO A 86 -2.080 -6.689 9.992 1.00 1.00 C ATOM 212 O PRO A 86 -2.668 -7.428 10.781 1.00 1.00 O ATOM 213 CB PRO A 86 -4.023 -5.696 8.684 1.00 1.00 C ATOM 214 CG PRO A 86 -3.645 -5.549 7.219 1.00 1.00 C ATOM 215 CD PRO A 86 -2.292 -4.858 7.153 1.00 1.00 C ATOM 0 HA PRO A 86 -2.975 -4.837 10.367 1.00 1.00 H new ATOM 0 HB2 PRO A 86 -4.399 -6.698 8.892 1.00 1.00 H new ATOM 0 HB3 PRO A 86 -4.813 -4.996 8.956 1.00 1.00 H new ATOM 0 HG2 PRO A 86 -3.599 -6.526 6.737 1.00 1.00 H new ATOM 0 HG3 PRO A 86 -4.397 -4.966 6.687 1.00 1.00 H new ATOM 0 HD2 PRO A 86 -1.571 -5.452 6.591 1.00 1.00 H new ATOM 0 HD3 PRO A 86 -2.365 -3.891 6.656 1.00 1.00 H new ATOM 220 N MET A 87 -0.858 -6.905 9.528 1.00 1.00 N ATOM 221 CA MET A 87 -0.100 -8.075 9.936 1.00 1.00 C ATOM 222 C MET A 87 1.388 -7.744 10.073 1.00 1.00 C ATOM 223 O MET A 87 1.874 -6.793 9.463 1.00 1.00 O ATOM 224 CB MET A 87 -0.282 -9.189 8.902 1.00 1.00 C ATOM 225 CG MET A 87 -1.070 -10.360 9.492 1.00 1.00 C ATOM 226 SD MET A 87 -0.078 -11.214 10.704 1.00 1.00 S ATOM 227 CE MET A 87 -1.330 -11.590 11.921 1.00 1.00 C ATOM 0 H MET A 87 -0.374 -6.290 8.874 1.00 1.00 H new ATOM 0 HA MET A 87 -0.471 -8.404 10.907 1.00 1.00 H new ATOM 0 HB2 MET A 87 -0.804 -8.798 8.029 1.00 1.00 H new ATOM 0 HB3 MET A 87 0.693 -9.537 8.561 1.00 1.00 H new ATOM 0 HG2 MET A 87 -1.988 -9.996 9.953 1.00 1.00 H new ATOM 0 HG3 MET A 87 -1.363 -11.048 8.699 1.00 1.00 H new ATOM 0 HE1 MET A 87 -0.878 -12.128 12.754 1.00 1.00 H new ATOM 0 HE2 MET A 87 -1.773 -10.663 12.285 1.00 1.00 H new ATOM 0 HE3 MET A 87 -2.104 -12.209 11.467 1.00 1.00 H new ATOM 235 N VAL A 88 2.069 -8.546 10.878 1.00 1.00 N ATOM 236 CA VAL A 88 3.491 -8.351 11.102 1.00 1.00 C ATOM 237 C VAL A 88 4.281 -9.293 10.193 1.00 1.00 C ATOM 238 O VAL A 88 3.894 -10.445 9.998 1.00 1.00 O ATOM 239 CB VAL A 88 3.817 -8.538 12.585 1.00 1.00 C ATOM 240 CG1 VAL A 88 5.164 -7.901 12.935 1.00 1.00 C ATOM 241 CG2 VAL A 88 2.700 -7.977 13.467 1.00 1.00 C ATOM 0 H VAL A 88 1.662 -9.333 11.383 1.00 1.00 H new ATOM 0 HA VAL A 88 3.782 -7.333 10.844 1.00 1.00 H new ATOM 0 HB VAL A 88 3.892 -9.608 12.779 1.00 1.00 H new ATOM 0 HG11 VAL A 88 5.372 -8.048 13.995 1.00 1.00 H new ATOM 0 HG12 VAL A 88 5.952 -8.367 12.343 1.00 1.00 H new ATOM 0 HG13 VAL A 88 5.129 -6.834 12.717 1.00 1.00 H new ATOM 0 HG21 VAL A 88 2.957 -8.123 14.516 1.00 1.00 H new ATOM 0 HG22 VAL A 88 2.579 -6.912 13.268 1.00 1.00 H new ATOM 0 HG23 VAL A 88 1.767 -8.496 13.246 1.00 1.00 H new ATOM 251 N GLY A 89 5.375 -8.770 9.659 1.00 1.00 N ATOM 252 CA GLY A 89 6.224 -9.551 8.774 1.00 1.00 C ATOM 253 C GLY A 89 7.087 -8.641 7.898 1.00 1.00 C ATOM 254 O GLY A 89 7.918 -7.890 8.408 1.00 1.00 O ATOM 0 H GLY A 89 5.693 -7.815 9.822 1.00 1.00 H new ATOM 0 HA2 GLY A 89 6.864 -10.207 9.364 1.00 1.00 H new ATOM 0 HA3 GLY A 89 5.607 -10.190 8.143 1.00 1.00 H new ATOM 258 N THR A 90 6.861 -8.738 6.597 1.00 1.00 N ATOM 259 CA THR A 90 7.607 -7.933 5.646 1.00 1.00 C ATOM 260 C THR A 90 6.657 -7.263 4.651 1.00 1.00 C ATOM 261 O THR A 90 5.477 -7.605 4.589 1.00 1.00 O ATOM 262 CB THR A 90 8.649 -8.834 4.979 1.00 1.00 C ATOM 263 OG1 THR A 90 9.528 -9.194 6.040 1.00 1.00 O ATOM 264 CG2 THR A 90 9.541 -8.070 3.998 1.00 1.00 C ATOM 0 H THR A 90 6.171 -9.362 6.179 1.00 1.00 H new ATOM 0 HA THR A 90 8.132 -7.118 6.144 1.00 1.00 H new ATOM 0 HB THR A 90 8.144 -9.645 4.455 1.00 1.00 H new ATOM 0 HG1 THR A 90 10.234 -9.780 5.695 1.00 1.00 H new ATOM 0 HG21 THR A 90 10.262 -8.755 3.553 1.00 1.00 H new ATOM 0 HG22 THR A 90 8.926 -7.631 3.213 1.00 1.00 H new ATOM 0 HG23 THR A 90 10.071 -7.279 4.529 1.00 1.00 H new ATOM 272 N PHE A 91 7.207 -6.321 3.898 1.00 1.00 N ATOM 273 CA PHE A 91 6.423 -5.600 2.910 1.00 1.00 C ATOM 274 C PHE A 91 7.203 -5.434 1.605 1.00 1.00 C ATOM 275 O PHE A 91 8.392 -5.118 1.625 1.00 1.00 O ATOM 276 CB PHE A 91 6.128 -4.217 3.495 1.00 1.00 C ATOM 277 CG PHE A 91 5.516 -3.236 2.493 1.00 1.00 C ATOM 278 CD1 PHE A 91 6.272 -2.744 1.475 1.00 1.00 C ATOM 279 CD2 PHE A 91 4.217 -2.856 2.620 1.00 1.00 C ATOM 280 CE1 PHE A 91 5.704 -1.833 0.546 1.00 1.00 C ATOM 281 CE2 PHE A 91 3.649 -1.945 1.691 1.00 1.00 C ATOM 282 CZ PHE A 91 4.404 -1.452 0.674 1.00 1.00 C ATOM 0 H PHE A 91 8.186 -6.041 3.953 1.00 1.00 H new ATOM 0 HA PHE A 91 5.509 -6.150 2.687 1.00 1.00 H new ATOM 0 HB2 PHE A 91 5.449 -4.328 4.340 1.00 1.00 H new ATOM 0 HB3 PHE A 91 7.054 -3.793 3.884 1.00 1.00 H new ATOM 0 HD1 PHE A 91 7.304 -3.046 1.373 1.00 1.00 H new ATOM 0 HD2 PHE A 91 3.617 -3.247 3.428 1.00 1.00 H new ATOM 0 HE1 PHE A 91 6.304 -1.442 -0.263 1.00 1.00 H new ATOM 0 HE2 PHE A 91 2.617 -1.644 1.792 1.00 1.00 H new ATOM 0 HZ PHE A 91 3.972 -0.758 -0.032 1.00 1.00 H new ATOM 291 N TYR A 92 6.504 -5.654 0.502 1.00 1.00 N ATOM 292 CA TYR A 92 7.117 -5.533 -0.810 1.00 1.00 C ATOM 293 C TYR A 92 6.270 -4.654 -1.731 1.00 1.00 C ATOM 294 O TYR A 92 5.051 -4.582 -1.580 1.00 1.00 O ATOM 295 CB TYR A 92 7.169 -6.951 -1.384 1.00 1.00 C ATOM 296 CG TYR A 92 8.178 -7.866 -0.689 1.00 1.00 C ATOM 297 CD1 TYR A 92 9.531 -7.677 -0.884 1.00 1.00 C ATOM 298 CD2 TYR A 92 7.736 -8.883 0.133 1.00 1.00 C ATOM 299 CE1 TYR A 92 10.480 -8.540 -0.229 1.00 1.00 C ATOM 300 CE2 TYR A 92 8.685 -9.746 0.788 1.00 1.00 C ATOM 301 CZ TYR A 92 10.011 -9.531 0.574 1.00 1.00 C ATOM 302 OH TYR A 92 10.907 -10.345 1.192 1.00 1.00 O ATOM 0 H TYR A 92 5.518 -5.916 0.489 1.00 1.00 H new ATOM 0 HA TYR A 92 8.104 -5.077 -0.732 1.00 1.00 H new ATOM 0 HB2 TYR A 92 6.178 -7.398 -1.311 1.00 1.00 H new ATOM 0 HB3 TYR A 92 7.416 -6.894 -2.444 1.00 1.00 H new ATOM 0 HD1 TYR A 92 9.878 -6.882 -1.528 1.00 1.00 H new ATOM 0 HD2 TYR A 92 6.677 -9.032 0.285 1.00 1.00 H new ATOM 0 HE1 TYR A 92 11.542 -8.403 -0.373 1.00 1.00 H new ATOM 0 HE2 TYR A 92 8.352 -10.545 1.434 1.00 1.00 H new ATOM 0 HH TYR A 92 10.428 -11.006 1.735 1.00 1.00 H new ATOM 311 N ARG A 93 6.950 -4.004 -2.666 1.00 1.00 N ATOM 312 CA ARG A 93 6.275 -3.132 -3.612 1.00 1.00 C ATOM 313 C ARG A 93 6.020 -3.872 -4.926 1.00 1.00 C ATOM 314 O ARG A 93 5.200 -3.440 -5.737 1.00 1.00 O ATOM 315 CB ARG A 93 7.106 -1.878 -3.893 1.00 1.00 C ATOM 316 CG ARG A 93 7.458 -1.151 -2.593 1.00 1.00 C ATOM 317 CD ARG A 93 6.405 -0.095 -2.253 1.00 1.00 C ATOM 318 NE ARG A 93 6.146 0.761 -3.432 1.00 1.00 N ATOM 319 CZ ARG A 93 7.029 1.652 -3.930 1.00 1.00 C ATOM 320 NH1 ARG A 93 8.239 1.811 -3.352 1.00 1.00 N ATOM 321 NH2 ARG A 93 6.693 2.364 -4.988 1.00 1.00 N ATOM 0 H ARG A 93 7.961 -4.064 -2.788 1.00 1.00 H new ATOM 0 HA ARG A 93 5.325 -2.833 -3.169 1.00 1.00 H new ATOM 0 HB2 ARG A 93 8.020 -2.153 -4.419 1.00 1.00 H new ATOM 0 HB3 ARG A 93 6.550 -1.208 -4.549 1.00 1.00 H new ATOM 0 HG2 ARG A 93 7.532 -1.871 -1.778 1.00 1.00 H new ATOM 0 HG3 ARG A 93 8.435 -0.677 -2.690 1.00 1.00 H new ATOM 0 HD2 ARG A 93 5.482 -0.580 -1.936 1.00 1.00 H new ATOM 0 HD3 ARG A 93 6.748 0.516 -1.418 1.00 1.00 H new ATOM 0 HE ARG A 93 5.243 0.672 -3.898 1.00 1.00 H new ATOM 0 HH11 ARG A 93 8.490 1.256 -2.534 1.00 1.00 H new ATOM 0 HH12 ARG A 93 8.902 2.486 -3.733 1.00 1.00 H new ATOM 0 HH21 ARG A 93 5.777 2.237 -5.418 1.00 1.00 H new ATOM 0 HH22 ARG A 93 7.349 3.041 -5.376 1.00 1.00 H new ATOM 330 N THR A 94 6.736 -4.973 -5.098 1.00 1.00 N ATOM 331 CA THR A 94 6.597 -5.776 -6.301 1.00 1.00 C ATOM 332 C THR A 94 6.501 -7.261 -5.942 1.00 1.00 C ATOM 333 O THR A 94 6.977 -7.680 -4.888 1.00 1.00 O ATOM 334 CB THR A 94 7.770 -5.449 -7.227 1.00 1.00 C ATOM 335 OG1 THR A 94 8.922 -5.667 -6.417 1.00 1.00 O ATOM 336 CG2 THR A 94 7.839 -3.961 -7.580 1.00 1.00 C ATOM 0 H THR A 94 7.414 -5.328 -4.424 1.00 1.00 H new ATOM 0 HA THR A 94 5.673 -5.541 -6.829 1.00 1.00 H new ATOM 0 HB THR A 94 7.686 -6.036 -8.142 1.00 1.00 H new ATOM 0 HG1 THR A 94 9.456 -6.395 -6.797 1.00 1.00 H new ATOM 0 HG21 THR A 94 8.689 -3.782 -8.239 1.00 1.00 H new ATOM 0 HG22 THR A 94 6.920 -3.664 -8.085 1.00 1.00 H new ATOM 0 HG23 THR A 94 7.958 -3.376 -6.668 1.00 1.00 H new ATOM 344 N PRO A 95 5.867 -8.034 -6.864 1.00 1.00 N ATOM 345 CA PRO A 95 5.703 -9.463 -6.655 1.00 1.00 C ATOM 346 C PRO A 95 7.021 -10.206 -6.888 1.00 1.00 C ATOM 347 O PRO A 95 7.255 -11.260 -6.298 1.00 1.00 O ATOM 348 CB PRO A 95 4.609 -9.879 -7.623 1.00 1.00 C ATOM 349 CG PRO A 95 4.525 -8.770 -8.659 1.00 1.00 C ATOM 350 CD PRO A 95 5.292 -7.572 -8.123 1.00 1.00 C ATOM 0 HA PRO A 95 5.425 -9.709 -5.630 1.00 1.00 H new ATOM 0 HB2 PRO A 95 4.845 -10.834 -8.092 1.00 1.00 H new ATOM 0 HB3 PRO A 95 3.657 -10.004 -7.107 1.00 1.00 H new ATOM 0 HG2 PRO A 95 4.948 -9.101 -9.607 1.00 1.00 H new ATOM 0 HG3 PRO A 95 3.485 -8.504 -8.849 1.00 1.00 H new ATOM 0 HD2 PRO A 95 6.068 -7.254 -8.820 1.00 1.00 H new ATOM 0 HD3 PRO A 95 4.634 -6.717 -7.968 1.00 1.00 H new ATOM 355 N SER A 96 7.846 -9.627 -7.747 1.00 1.00 N ATOM 356 CA SER A 96 9.134 -10.220 -8.065 1.00 1.00 C ATOM 357 C SER A 96 10.179 -9.122 -8.272 1.00 1.00 C ATOM 358 O SER A 96 9.865 -7.936 -8.186 1.00 1.00 O ATOM 359 CB SER A 96 9.040 -11.106 -9.308 1.00 1.00 C ATOM 360 OG SER A 96 9.497 -12.432 -9.055 1.00 1.00 O ATOM 0 H SER A 96 7.648 -8.753 -8.233 1.00 1.00 H new ATOM 0 HA SER A 96 9.438 -10.848 -7.227 1.00 1.00 H new ATOM 0 HB2 SER A 96 8.006 -11.138 -9.653 1.00 1.00 H new ATOM 0 HB3 SER A 96 9.630 -10.666 -10.112 1.00 1.00 H new ATOM 0 HG SER A 96 9.857 -12.817 -9.881 1.00 1.00 H new ATOM 365 N PRO A 97 11.434 -9.568 -8.549 1.00 1.00 N ATOM 366 CA PRO A 97 12.527 -8.638 -8.769 1.00 1.00 C ATOM 367 C PRO A 97 12.419 -7.981 -10.147 1.00 1.00 C ATOM 368 O PRO A 97 12.537 -6.763 -10.269 1.00 1.00 O ATOM 369 CB PRO A 97 13.790 -9.468 -8.603 1.00 1.00 C ATOM 370 CG PRO A 97 13.359 -10.917 -8.758 1.00 1.00 C ATOM 371 CD PRO A 97 11.843 -10.965 -8.658 1.00 1.00 C ATOM 0 HA PRO A 97 12.519 -7.805 -8.066 1.00 1.00 H new ATOM 0 HB2 PRO A 97 14.535 -9.200 -9.352 1.00 1.00 H new ATOM 0 HB3 PRO A 97 14.244 -9.298 -7.627 1.00 1.00 H new ATOM 0 HG2 PRO A 97 13.691 -11.314 -9.717 1.00 1.00 H new ATOM 0 HG3 PRO A 97 13.813 -11.535 -7.983 1.00 1.00 H new ATOM 0 HD2 PRO A 97 11.403 -11.439 -9.535 1.00 1.00 H new ATOM 0 HD3 PRO A 97 11.521 -11.541 -7.790 1.00 1.00 H new ATOM 376 N ASP A 98 12.197 -8.819 -11.150 1.00 1.00 N ATOM 377 CA ASP A 98 12.072 -8.335 -12.514 1.00 1.00 C ATOM 378 C ASP A 98 10.589 -8.193 -12.867 1.00 1.00 C ATOM 379 O ASP A 98 10.143 -8.692 -13.899 1.00 1.00 O ATOM 380 CB ASP A 98 12.703 -9.314 -13.505 1.00 1.00 C ATOM 381 CG ASP A 98 13.402 -8.663 -14.700 1.00 1.00 C ATOM 382 OD1 ASP A 98 13.066 -8.935 -15.863 1.00 1.00 O ATOM 383 OD2 ASP A 98 14.344 -7.836 -14.396 1.00 1.00 O ATOM 0 H ASP A 98 12.101 -9.829 -11.045 1.00 1.00 H new ATOM 0 HA ASP A 98 12.584 -7.375 -12.580 1.00 1.00 H new ATOM 0 HB2 ASP A 98 13.426 -9.931 -12.972 1.00 1.00 H new ATOM 0 HB3 ASP A 98 11.926 -9.982 -13.877 1.00 1.00 H new ATOM 388 N ALA A 99 9.868 -7.512 -11.989 1.00 1.00 N ATOM 389 CA ALA A 99 8.445 -7.300 -12.195 1.00 1.00 C ATOM 390 C ALA A 99 8.113 -5.826 -11.951 1.00 1.00 C ATOM 391 O ALA A 99 8.859 -5.123 -11.269 1.00 1.00 O ATOM 392 CB ALA A 99 7.651 -8.235 -11.282 1.00 1.00 C ATOM 0 H ALA A 99 10.242 -7.100 -11.134 1.00 1.00 H new ATOM 0 HA ALA A 99 8.167 -7.535 -13.222 1.00 1.00 H new ATOM 0 HB1 ALA A 99 6.584 -8.075 -11.437 1.00 1.00 H new ATOM 0 HB2 ALA A 99 7.901 -9.270 -11.515 1.00 1.00 H new ATOM 0 HB3 ALA A 99 7.902 -8.027 -10.242 1.00 1.00 H new ATOM 398 N LYS A 100 6.995 -5.402 -12.519 1.00 1.00 N ATOM 399 CA LYS A 100 6.556 -4.024 -12.370 1.00 1.00 C ATOM 400 C LYS A 100 6.173 -3.770 -10.911 1.00 1.00 C ATOM 401 O LYS A 100 6.118 -4.701 -10.108 1.00 1.00 O ATOM 402 CB LYS A 100 5.434 -3.710 -13.363 1.00 1.00 C ATOM 403 CG LYS A 100 5.752 -4.278 -14.748 1.00 1.00 C ATOM 404 CD LYS A 100 7.190 -3.953 -15.157 1.00 1.00 C ATOM 405 CE LYS A 100 7.566 -4.668 -16.456 1.00 1.00 C ATOM 406 NZ LYS A 100 8.889 -4.210 -16.936 1.00 1.00 N ATOM 0 H LYS A 100 6.379 -5.987 -13.083 1.00 1.00 H new ATOM 0 HA LYS A 100 7.367 -3.337 -12.611 1.00 1.00 H new ATOM 0 HB2 LYS A 100 4.495 -4.129 -13.001 1.00 1.00 H new ATOM 0 HB3 LYS A 100 5.296 -2.631 -13.432 1.00 1.00 H new ATOM 0 HG2 LYS A 100 5.607 -5.358 -14.744 1.00 1.00 H new ATOM 0 HG3 LYS A 100 5.059 -3.866 -15.482 1.00 1.00 H new ATOM 0 HD2 LYS A 100 7.301 -2.876 -15.285 1.00 1.00 H new ATOM 0 HD3 LYS A 100 7.874 -4.251 -14.362 1.00 1.00 H new ATOM 0 HE2 LYS A 100 7.585 -5.745 -16.292 1.00 1.00 H new ATOM 0 HE3 LYS A 100 6.810 -4.474 -17.217 1.00 1.00 H new ATOM 0 HZ1 LYS A 100 9.129 -4.705 -17.818 1.00 1.00 H new ATOM 0 HZ2 LYS A 100 8.859 -3.185 -17.111 1.00 1.00 H new ATOM 0 HZ3 LYS A 100 9.610 -4.417 -16.216 1.00 1.00 H new ATOM 415 N ALA A 101 5.920 -2.505 -10.611 1.00 1.00 N ATOM 416 CA ALA A 101 5.545 -2.116 -9.262 1.00 1.00 C ATOM 417 C ALA A 101 4.020 -2.088 -9.149 1.00 1.00 C ATOM 418 O ALA A 101 3.340 -1.538 -10.016 1.00 1.00 O ATOM 419 CB ALA A 101 6.180 -0.765 -8.924 1.00 1.00 C ATOM 0 H ALA A 101 5.967 -1.736 -11.279 1.00 1.00 H new ATOM 0 HA ALA A 101 5.916 -2.841 -8.537 1.00 1.00 H new ATOM 0 HB1 ALA A 101 5.898 -0.474 -7.912 1.00 1.00 H new ATOM 0 HB2 ALA A 101 7.265 -0.846 -8.990 1.00 1.00 H new ATOM 0 HB3 ALA A 101 5.829 -0.012 -9.629 1.00 1.00 H new ATOM 425 N PHE A 102 3.526 -2.685 -8.075 1.00 1.00 N ATOM 426 CA PHE A 102 2.093 -2.734 -7.838 1.00 1.00 C ATOM 427 C PHE A 102 1.501 -1.326 -7.759 1.00 1.00 C ATOM 428 O PHE A 102 0.397 -1.084 -8.246 1.00 1.00 O ATOM 429 CB PHE A 102 1.886 -3.437 -6.495 1.00 1.00 C ATOM 430 CG PHE A 102 1.882 -4.965 -6.586 1.00 1.00 C ATOM 431 CD1 PHE A 102 0.802 -5.612 -7.100 1.00 1.00 C ATOM 432 CD2 PHE A 102 2.959 -5.674 -6.154 1.00 1.00 C ATOM 433 CE1 PHE A 102 0.798 -7.029 -7.184 1.00 1.00 C ATOM 434 CE2 PHE A 102 2.954 -7.092 -6.238 1.00 1.00 C ATOM 435 CZ PHE A 102 1.875 -7.739 -6.752 1.00 1.00 C ATOM 0 H PHE A 102 4.092 -3.139 -7.359 1.00 1.00 H new ATOM 0 HA PHE A 102 1.599 -3.261 -8.654 1.00 1.00 H new ATOM 0 HB2 PHE A 102 2.674 -3.126 -5.809 1.00 1.00 H new ATOM 0 HB3 PHE A 102 0.940 -3.106 -6.065 1.00 1.00 H new ATOM 0 HD1 PHE A 102 -0.052 -5.048 -7.444 1.00 1.00 H new ATOM 0 HD2 PHE A 102 3.817 -5.160 -5.747 1.00 1.00 H new ATOM 0 HE1 PHE A 102 -0.060 -7.543 -7.591 1.00 1.00 H new ATOM 0 HE2 PHE A 102 3.808 -7.656 -5.893 1.00 1.00 H new ATOM 0 HZ PHE A 102 1.873 -8.817 -6.818 1.00 1.00 H new ATOM 444 N ILE A 103 2.262 -0.433 -7.144 1.00 1.00 N ATOM 445 CA ILE A 103 1.827 0.946 -6.996 1.00 1.00 C ATOM 446 C ILE A 103 2.962 1.882 -7.412 1.00 1.00 C ATOM 447 O ILE A 103 3.803 2.248 -6.592 1.00 1.00 O ATOM 448 CB ILE A 103 1.312 1.196 -5.577 1.00 1.00 C ATOM 449 CG1 ILE A 103 2.295 0.656 -4.535 1.00 1.00 C ATOM 450 CG2 ILE A 103 -0.093 0.618 -5.393 1.00 1.00 C ATOM 451 CD1 ILE A 103 1.855 1.037 -3.120 1.00 1.00 C ATOM 0 H ILE A 103 3.177 -0.637 -6.742 1.00 1.00 H new ATOM 0 HA ILE A 103 0.985 1.153 -7.657 1.00 1.00 H new ATOM 0 HB ILE A 103 1.239 2.273 -5.425 1.00 1.00 H new ATOM 0 HG12 ILE A 103 2.361 -0.429 -4.620 1.00 1.00 H new ATOM 0 HG13 ILE A 103 3.291 1.053 -4.729 1.00 1.00 H new ATOM 0 HG21 ILE A 103 -0.435 0.810 -4.376 1.00 1.00 H new ATOM 0 HG22 ILE A 103 -0.776 1.089 -6.100 1.00 1.00 H new ATOM 0 HG23 ILE A 103 -0.070 -0.457 -5.572 1.00 1.00 H new ATOM 0 HD11 ILE A 103 2.570 0.642 -2.398 1.00 1.00 H new ATOM 0 HD12 ILE A 103 1.813 2.123 -3.032 1.00 1.00 H new ATOM 0 HD13 ILE A 103 0.869 0.618 -2.921 1.00 1.00 H new ATOM 462 N GLU A 104 2.952 2.246 -8.687 1.00 1.00 N ATOM 463 CA GLU A 104 3.970 3.132 -9.221 1.00 1.00 C ATOM 464 C GLU A 104 3.688 4.578 -8.805 1.00 1.00 C ATOM 465 O GLU A 104 2.696 5.168 -9.232 1.00 1.00 O ATOM 466 CB GLU A 104 4.061 3.008 -10.744 1.00 1.00 C ATOM 467 CG GLU A 104 5.516 2.870 -11.196 1.00 1.00 C ATOM 468 CD GLU A 104 5.657 3.177 -12.689 1.00 1.00 C ATOM 469 OE1 GLU A 104 6.442 4.059 -13.069 1.00 1.00 O ATOM 470 OE2 GLU A 104 4.915 2.462 -13.466 1.00 1.00 O ATOM 0 H GLU A 104 2.253 1.942 -9.365 1.00 1.00 H new ATOM 0 HA GLU A 104 4.934 2.837 -8.807 1.00 1.00 H new ATOM 0 HB2 GLU A 104 3.489 2.142 -11.077 1.00 1.00 H new ATOM 0 HB3 GLU A 104 3.613 3.885 -11.211 1.00 1.00 H new ATOM 0 HG2 GLU A 104 6.145 3.549 -10.620 1.00 1.00 H new ATOM 0 HG3 GLU A 104 5.869 1.859 -10.994 1.00 1.00 H new ATOM 476 N VAL A 105 4.576 5.105 -7.976 1.00 1.00 N ATOM 477 CA VAL A 105 4.435 6.469 -7.497 1.00 1.00 C ATOM 478 C VAL A 105 3.953 7.360 -8.643 1.00 1.00 C ATOM 479 O VAL A 105 4.655 7.533 -9.638 1.00 1.00 O ATOM 480 CB VAL A 105 5.752 6.947 -6.881 1.00 1.00 C ATOM 481 CG1 VAL A 105 5.614 8.365 -6.323 1.00 1.00 C ATOM 482 CG2 VAL A 105 6.236 5.977 -5.801 1.00 1.00 C ATOM 0 H VAL A 105 5.396 4.612 -7.624 1.00 1.00 H new ATOM 0 HA VAL A 105 3.685 6.521 -6.707 1.00 1.00 H new ATOM 0 HB VAL A 105 6.502 6.970 -7.671 1.00 1.00 H new ATOM 0 HG11 VAL A 105 6.564 8.680 -5.891 1.00 1.00 H new ATOM 0 HG12 VAL A 105 5.337 9.047 -7.127 1.00 1.00 H new ATOM 0 HG13 VAL A 105 4.843 8.379 -5.553 1.00 1.00 H new ATOM 0 HG21 VAL A 105 7.173 6.340 -5.380 1.00 1.00 H new ATOM 0 HG22 VAL A 105 5.487 5.907 -5.013 1.00 1.00 H new ATOM 0 HG23 VAL A 105 6.393 4.992 -6.241 1.00 1.00 H new ATOM 492 N GLY A 106 2.757 7.904 -8.465 1.00 1.00 N ATOM 493 CA GLY A 106 2.173 8.773 -9.472 1.00 1.00 C ATOM 494 C GLY A 106 1.000 8.087 -10.174 1.00 1.00 C ATOM 495 O GLY A 106 0.507 8.575 -11.190 1.00 1.00 O ATOM 0 H GLY A 106 2.177 7.759 -7.638 1.00 1.00 H new ATOM 0 HA2 GLY A 106 1.832 9.698 -9.006 1.00 1.00 H new ATOM 0 HA3 GLY A 106 2.931 9.046 -10.206 1.00 1.00 H new ATOM 499 N GLN A 107 0.585 6.964 -9.606 1.00 1.00 N ATOM 500 CA GLN A 107 -0.520 6.206 -10.165 1.00 1.00 C ATOM 501 C GLN A 107 -1.708 6.209 -9.199 1.00 1.00 C ATOM 502 O GLN A 107 -1.558 6.546 -8.026 1.00 1.00 O ATOM 503 CB GLN A 107 -0.091 4.776 -10.501 1.00 1.00 C ATOM 504 CG GLN A 107 -0.940 4.200 -11.637 1.00 1.00 C ATOM 505 CD GLN A 107 -1.695 2.951 -11.178 1.00 1.00 C ATOM 506 OE1 GLN A 107 -2.868 2.766 -11.456 1.00 1.00 O ATOM 507 NE2 GLN A 107 -0.958 2.106 -10.462 1.00 1.00 N ATOM 0 H GLN A 107 0.995 6.561 -8.763 1.00 1.00 H new ATOM 0 HA GLN A 107 -0.830 6.685 -11.094 1.00 1.00 H new ATOM 0 HB2 GLN A 107 0.961 4.766 -10.787 1.00 1.00 H new ATOM 0 HB3 GLN A 107 -0.186 4.147 -9.616 1.00 1.00 H new ATOM 0 HG2 GLN A 107 -1.650 4.952 -11.983 1.00 1.00 H new ATOM 0 HG3 GLN A 107 -0.300 3.952 -12.484 1.00 1.00 H new ATOM 0 HE21 GLN A 107 0.019 2.322 -10.265 1.00 1.00 H new ATOM 0 HE22 GLN A 107 -1.370 1.242 -10.110 1.00 1.00 H new ATOM 514 N LYS A 108 -2.861 5.829 -9.730 1.00 1.00 N ATOM 515 CA LYS A 108 -4.073 5.783 -8.929 1.00 1.00 C ATOM 516 C LYS A 108 -4.512 4.328 -8.758 1.00 1.00 C ATOM 517 O LYS A 108 -4.202 3.479 -9.593 1.00 1.00 O ATOM 518 CB LYS A 108 -5.152 6.683 -9.538 1.00 1.00 C ATOM 519 CG LYS A 108 -6.550 6.208 -9.140 1.00 1.00 C ATOM 520 CD LYS A 108 -6.962 4.975 -9.948 1.00 1.00 C ATOM 521 CE LYS A 108 -8.419 5.079 -10.404 1.00 1.00 C ATOM 522 NZ LYS A 108 -8.574 6.166 -11.396 1.00 1.00 N ATOM 0 H LYS A 108 -2.982 5.550 -10.704 1.00 1.00 H new ATOM 0 HA LYS A 108 -3.885 6.179 -7.931 1.00 1.00 H new ATOM 0 HB2 LYS A 108 -5.004 7.710 -9.205 1.00 1.00 H new ATOM 0 HB3 LYS A 108 -5.060 6.684 -10.624 1.00 1.00 H new ATOM 0 HG2 LYS A 108 -6.569 5.973 -8.076 1.00 1.00 H new ATOM 0 HG3 LYS A 108 -7.270 7.010 -9.302 1.00 1.00 H new ATOM 0 HD2 LYS A 108 -6.312 4.871 -10.817 1.00 1.00 H new ATOM 0 HD3 LYS A 108 -6.830 4.078 -9.342 1.00 1.00 H new ATOM 0 HE2 LYS A 108 -8.739 4.132 -10.840 1.00 1.00 H new ATOM 0 HE3 LYS A 108 -9.063 5.268 -9.545 1.00 1.00 H new ATOM 0 HZ1 LYS A 108 -9.382 5.957 -12.017 1.00 1.00 H new ATOM 0 HZ2 LYS A 108 -8.741 7.066 -10.902 1.00 1.00 H new ATOM 0 HZ3 LYS A 108 -7.708 6.241 -11.967 1.00 1.00 H new ATOM 531 N VAL A 109 -5.226 4.083 -7.670 1.00 1.00 N ATOM 532 CA VAL A 109 -5.711 2.744 -7.378 1.00 1.00 C ATOM 533 C VAL A 109 -7.207 2.805 -7.066 1.00 1.00 C ATOM 534 O VAL A 109 -7.645 3.627 -6.263 1.00 1.00 O ATOM 535 CB VAL A 109 -4.889 2.126 -6.246 1.00 1.00 C ATOM 536 CG1 VAL A 109 -3.402 2.089 -6.604 1.00 1.00 C ATOM 537 CG2 VAL A 109 -5.117 2.874 -4.930 1.00 1.00 C ATOM 0 H VAL A 109 -5.481 4.789 -6.979 1.00 1.00 H new ATOM 0 HA VAL A 109 -5.586 2.095 -8.245 1.00 1.00 H new ATOM 0 HB VAL A 109 -5.227 1.099 -6.111 1.00 1.00 H new ATOM 0 HG11 VAL A 109 -2.841 1.645 -5.782 1.00 1.00 H new ATOM 0 HG12 VAL A 109 -3.259 1.492 -7.505 1.00 1.00 H new ATOM 0 HG13 VAL A 109 -3.045 3.104 -6.781 1.00 1.00 H new ATOM 0 HG21 VAL A 109 -4.521 2.414 -4.142 1.00 1.00 H new ATOM 0 HG22 VAL A 109 -4.821 3.916 -5.048 1.00 1.00 H new ATOM 0 HG23 VAL A 109 -6.172 2.825 -4.662 1.00 1.00 H new ATOM 547 N ASN A 110 -7.952 1.922 -7.717 1.00 1.00 N ATOM 548 CA ASN A 110 -9.390 1.865 -7.519 1.00 1.00 C ATOM 549 C ASN A 110 -9.762 0.515 -6.904 1.00 1.00 C ATOM 550 O ASN A 110 -9.063 -0.477 -7.105 1.00 1.00 O ATOM 551 CB ASN A 110 -10.134 2.001 -8.849 1.00 1.00 C ATOM 552 CG ASN A 110 -11.633 2.210 -8.620 1.00 1.00 C ATOM 553 OD1 ASN A 110 -12.391 1.279 -8.406 1.00 1.00 O ATOM 554 ND2 ASN A 110 -12.015 3.483 -8.676 1.00 1.00 N ATOM 0 H ASN A 110 -7.586 1.241 -8.382 1.00 1.00 H new ATOM 0 HA ASN A 110 -9.674 2.687 -6.862 1.00 1.00 H new ATOM 0 HB2 ASN A 110 -9.728 2.841 -9.413 1.00 1.00 H new ATOM 0 HB3 ASN A 110 -9.976 1.107 -9.451 1.00 1.00 H new ATOM 0 HD21 ASN A 110 -12.995 3.728 -8.536 1.00 1.00 H new ATOM 0 HD22 ASN A 110 -11.328 4.214 -8.859 1.00 1.00 H new ATOM 560 N VAL A 111 -10.863 0.520 -6.168 1.00 1.00 N ATOM 561 CA VAL A 111 -11.337 -0.693 -5.522 1.00 1.00 C ATOM 562 C VAL A 111 -11.157 -1.877 -6.474 1.00 1.00 C ATOM 563 O VAL A 111 -11.869 -1.989 -7.472 1.00 1.00 O ATOM 564 CB VAL A 111 -12.786 -0.509 -5.063 1.00 1.00 C ATOM 565 CG1 VAL A 111 -13.495 -1.859 -4.939 1.00 1.00 C ATOM 566 CG2 VAL A 111 -12.850 0.268 -3.747 1.00 1.00 C ATOM 0 H VAL A 111 -11.441 1.344 -6.004 1.00 1.00 H new ATOM 0 HA VAL A 111 -10.751 -0.904 -4.628 1.00 1.00 H new ATOM 0 HB VAL A 111 -13.307 0.075 -5.821 1.00 1.00 H new ATOM 0 HG11 VAL A 111 -14.523 -1.702 -4.612 1.00 1.00 H new ATOM 0 HG12 VAL A 111 -13.495 -2.360 -5.907 1.00 1.00 H new ATOM 0 HG13 VAL A 111 -12.973 -2.479 -4.210 1.00 1.00 H new ATOM 0 HG21 VAL A 111 -13.890 0.385 -3.444 1.00 1.00 H new ATOM 0 HG22 VAL A 111 -12.306 -0.277 -2.976 1.00 1.00 H new ATOM 0 HG23 VAL A 111 -12.399 1.251 -3.883 1.00 1.00 H new ATOM 576 N GLY A 112 -10.202 -2.729 -6.133 1.00 1.00 N ATOM 577 CA GLY A 112 -9.919 -3.899 -6.946 1.00 1.00 C ATOM 578 C GLY A 112 -8.466 -3.897 -7.426 1.00 1.00 C ATOM 579 O GLY A 112 -7.945 -4.930 -7.842 1.00 1.00 O ATOM 0 H GLY A 112 -9.614 -2.632 -5.305 1.00 1.00 H new ATOM 0 HA2 GLY A 112 -10.113 -4.803 -6.368 1.00 1.00 H new ATOM 0 HA3 GLY A 112 -10.589 -3.920 -7.805 1.00 1.00 H new ATOM 583 N ASP A 113 -7.854 -2.724 -7.350 1.00 1.00 N ATOM 584 CA ASP A 113 -6.472 -2.572 -7.772 1.00 1.00 C ATOM 585 C ASP A 113 -5.547 -2.893 -6.596 1.00 1.00 C ATOM 586 O ASP A 113 -5.787 -2.451 -5.474 1.00 1.00 O ATOM 587 CB ASP A 113 -6.187 -1.138 -8.219 1.00 1.00 C ATOM 588 CG ASP A 113 -6.190 -0.920 -9.734 1.00 1.00 C ATOM 589 OD1 ASP A 113 -7.121 -1.341 -10.438 1.00 1.00 O ATOM 590 OD2 ASP A 113 -5.170 -0.281 -10.195 1.00 1.00 O ATOM 0 H ASP A 113 -8.290 -1.870 -7.002 1.00 1.00 H new ATOM 0 HA ASP A 113 -6.298 -3.251 -8.607 1.00 1.00 H new ATOM 0 HB2 ASP A 113 -6.931 -0.479 -7.771 1.00 1.00 H new ATOM 0 HB3 ASP A 113 -5.216 -0.837 -7.826 1.00 1.00 H new ATOM 595 N THR A 114 -4.509 -3.661 -6.893 1.00 1.00 N ATOM 596 CA THR A 114 -3.546 -4.046 -5.876 1.00 1.00 C ATOM 597 C THR A 114 -2.955 -2.804 -5.204 1.00 1.00 C ATOM 598 O THR A 114 -3.232 -1.679 -5.616 1.00 1.00 O ATOM 599 CB THR A 114 -2.495 -4.940 -6.534 1.00 1.00 C ATOM 600 OG1 THR A 114 -3.244 -6.036 -7.050 1.00 1.00 O ATOM 601 CG2 THR A 114 -1.552 -5.583 -5.514 1.00 1.00 C ATOM 0 H THR A 114 -4.314 -4.027 -7.825 1.00 1.00 H new ATOM 0 HA THR A 114 -4.021 -4.614 -5.076 1.00 1.00 H new ATOM 0 HB THR A 114 -1.915 -4.353 -7.247 1.00 1.00 H new ATOM 0 HG1 THR A 114 -2.639 -6.665 -7.496 1.00 1.00 H new ATOM 0 HG21 THR A 114 -0.825 -6.208 -6.034 1.00 1.00 H new ATOM 0 HG22 THR A 114 -1.030 -4.803 -4.959 1.00 1.00 H new ATOM 0 HG23 THR A 114 -2.129 -6.197 -4.822 1.00 1.00 H new ATOM 609 N LEU A 115 -2.150 -3.051 -4.180 1.00 1.00 N ATOM 610 CA LEU A 115 -1.518 -1.968 -3.448 1.00 1.00 C ATOM 611 C LEU A 115 -0.051 -2.320 -3.193 1.00 1.00 C ATOM 612 O LEU A 115 0.836 -1.496 -3.413 1.00 1.00 O ATOM 613 CB LEU A 115 -2.304 -1.651 -2.174 1.00 1.00 C ATOM 614 CG LEU A 115 -2.550 -0.168 -1.889 1.00 1.00 C ATOM 615 CD1 LEU A 115 -3.408 0.466 -2.987 1.00 1.00 C ATOM 616 CD2 LEU A 115 -3.159 0.030 -0.500 1.00 1.00 C ATOM 0 H LEU A 115 -1.922 -3.985 -3.841 1.00 1.00 H new ATOM 0 HA LEU A 115 -1.530 -1.052 -4.038 1.00 1.00 H new ATOM 0 HB2 LEU A 115 -3.269 -2.154 -2.232 1.00 1.00 H new ATOM 0 HB3 LEU A 115 -1.771 -2.080 -1.326 1.00 1.00 H new ATOM 0 HG LEU A 115 -1.588 0.345 -1.895 1.00 1.00 H new ATOM 0 HD11 LEU A 115 -3.568 1.520 -2.761 1.00 1.00 H new ATOM 0 HD12 LEU A 115 -2.898 0.374 -3.946 1.00 1.00 H new ATOM 0 HD13 LEU A 115 -4.370 -0.044 -3.037 1.00 1.00 H new ATOM 0 HD21 LEU A 115 -3.324 1.093 -0.323 1.00 1.00 H new ATOM 0 HD22 LEU A 115 -4.110 -0.499 -0.441 1.00 1.00 H new ATOM 0 HD23 LEU A 115 -2.478 -0.362 0.255 1.00 1.00 H new ATOM 627 N CYS A 116 0.160 -3.544 -2.733 1.00 1.00 N ATOM 628 CA CYS A 116 1.505 -4.015 -2.445 1.00 1.00 C ATOM 629 C CYS A 116 1.414 -5.465 -1.968 1.00 1.00 C ATOM 630 O CYS A 116 0.422 -6.146 -2.222 1.00 1.00 O ATOM 631 CB CYS A 116 2.210 -3.120 -1.424 1.00 1.00 C ATOM 632 SG CYS A 116 1.573 -3.465 0.256 1.00 1.00 S ATOM 0 H CYS A 116 -0.578 -4.225 -2.552 1.00 1.00 H new ATOM 0 HA CYS A 116 2.111 -3.970 -3.350 1.00 1.00 H new ATOM 0 HB2 CYS A 116 3.286 -3.294 -1.457 1.00 1.00 H new ATOM 0 HB3 CYS A 116 2.049 -2.072 -1.675 1.00 1.00 H new ATOM 0 HG CYS A 116 2.443 -3.074 1.139 1.00 1.00 H new ATOM 637 N ILE A 117 2.464 -5.896 -1.284 1.00 1.00 N ATOM 638 CA ILE A 117 2.515 -7.254 -0.770 1.00 1.00 C ATOM 639 C ILE A 117 3.102 -7.237 0.644 1.00 1.00 C ATOM 640 O ILE A 117 3.835 -6.317 1.005 1.00 1.00 O ATOM 641 CB ILE A 117 3.271 -8.166 -1.737 1.00 1.00 C ATOM 642 CG1 ILE A 117 2.742 -8.008 -3.164 1.00 1.00 C ATOM 643 CG2 ILE A 117 3.227 -9.621 -1.267 1.00 1.00 C ATOM 644 CD1 ILE A 117 3.169 -9.188 -4.040 1.00 1.00 C ATOM 0 H ILE A 117 3.285 -5.329 -1.074 1.00 1.00 H new ATOM 0 HA ILE A 117 1.510 -7.670 -0.695 1.00 1.00 H new ATOM 0 HB ILE A 117 4.318 -7.863 -1.745 1.00 1.00 H new ATOM 0 HG12 ILE A 117 1.654 -7.938 -3.147 1.00 1.00 H new ATOM 0 HG13 ILE A 117 3.115 -7.078 -3.593 1.00 1.00 H new ATOM 0 HG21 ILE A 117 3.772 -10.248 -1.973 1.00 1.00 H new ATOM 0 HG22 ILE A 117 3.687 -9.699 -0.282 1.00 1.00 H new ATOM 0 HG23 ILE A 117 2.191 -9.954 -1.211 1.00 1.00 H new ATOM 0 HD11 ILE A 117 2.780 -9.051 -5.049 1.00 1.00 H new ATOM 0 HD12 ILE A 117 4.257 -9.241 -4.074 1.00 1.00 H new ATOM 0 HD13 ILE A 117 2.774 -10.114 -3.621 1.00 1.00 H new ATOM 655 N VAL A 118 2.757 -8.264 1.405 1.00 1.00 N ATOM 656 CA VAL A 118 3.241 -8.379 2.772 1.00 1.00 C ATOM 657 C VAL A 118 3.564 -9.843 3.072 1.00 1.00 C ATOM 658 O VAL A 118 2.710 -10.715 2.920 1.00 1.00 O ATOM 659 CB VAL A 118 2.219 -7.781 3.741 1.00 1.00 C ATOM 660 CG1 VAL A 118 2.519 -8.197 5.182 1.00 1.00 C ATOM 661 CG2 VAL A 118 2.166 -6.257 3.610 1.00 1.00 C ATOM 0 H VAL A 118 2.148 -9.025 1.102 1.00 1.00 H new ATOM 0 HA VAL A 118 4.162 -7.810 2.901 1.00 1.00 H new ATOM 0 HB VAL A 118 1.238 -8.175 3.477 1.00 1.00 H new ATOM 0 HG11 VAL A 118 1.777 -7.758 5.849 1.00 1.00 H new ATOM 0 HG12 VAL A 118 2.482 -9.283 5.262 1.00 1.00 H new ATOM 0 HG13 VAL A 118 3.512 -7.846 5.463 1.00 1.00 H new ATOM 0 HG21 VAL A 118 1.432 -5.857 4.310 1.00 1.00 H new ATOM 0 HG22 VAL A 118 3.147 -5.838 3.834 1.00 1.00 H new ATOM 0 HG23 VAL A 118 1.881 -5.989 2.593 1.00 1.00 H new ATOM 671 N GLU A 119 4.800 -10.069 3.493 1.00 1.00 N ATOM 672 CA GLU A 119 5.246 -11.413 3.817 1.00 1.00 C ATOM 673 C GLU A 119 4.831 -11.781 5.243 1.00 1.00 C ATOM 674 O GLU A 119 5.094 -11.033 6.183 1.00 1.00 O ATOM 675 CB GLU A 119 6.759 -11.546 3.635 1.00 1.00 C ATOM 676 CG GLU A 119 7.118 -12.890 2.997 1.00 1.00 C ATOM 677 CD GLU A 119 8.455 -12.806 2.257 1.00 1.00 C ATOM 678 OE1 GLU A 119 8.502 -13.008 1.034 1.00 1.00 O ATOM 679 OE2 GLU A 119 9.470 -12.517 2.997 1.00 1.00 O ATOM 0 H GLU A 119 5.506 -9.344 3.617 1.00 1.00 H new ATOM 0 HA GLU A 119 4.767 -12.110 3.129 1.00 1.00 H new ATOM 0 HB2 GLU A 119 7.127 -10.733 3.009 1.00 1.00 H new ATOM 0 HB3 GLU A 119 7.255 -11.454 4.601 1.00 1.00 H new ATOM 0 HG2 GLU A 119 7.172 -13.659 3.767 1.00 1.00 H new ATOM 0 HG3 GLU A 119 6.332 -13.189 2.303 1.00 1.00 H new ATOM 685 N ALA A 120 4.189 -12.935 5.359 1.00 1.00 N ATOM 686 CA ALA A 120 3.734 -13.411 6.654 1.00 1.00 C ATOM 687 C ALA A 120 3.515 -14.924 6.587 1.00 1.00 C ATOM 688 O ALA A 120 3.271 -15.473 5.513 1.00 1.00 O ATOM 689 CB ALA A 120 2.468 -12.656 7.061 1.00 1.00 C ATOM 0 H ALA A 120 3.973 -13.554 4.577 1.00 1.00 H new ATOM 0 HA ALA A 120 4.486 -13.220 7.419 1.00 1.00 H new ATOM 0 HB1 ALA A 120 2.127 -13.014 8.033 1.00 1.00 H new ATOM 0 HB2 ALA A 120 2.684 -11.589 7.123 1.00 1.00 H new ATOM 0 HB3 ALA A 120 1.688 -12.826 6.318 1.00 1.00 H new ATOM 695 N MET A 121 3.608 -15.556 7.749 1.00 1.00 N ATOM 696 CA MET A 121 3.422 -16.994 7.836 1.00 1.00 C ATOM 697 C MET A 121 4.223 -17.716 6.750 1.00 1.00 C ATOM 698 O MET A 121 3.727 -18.655 6.128 1.00 1.00 O ATOM 699 CB MET A 121 1.937 -17.327 7.681 1.00 1.00 C ATOM 700 CG MET A 121 1.161 -16.974 8.951 1.00 1.00 C ATOM 701 SD MET A 121 0.587 -18.464 9.750 1.00 1.00 S ATOM 702 CE MET A 121 -0.585 -19.036 8.530 1.00 1.00 C ATOM 0 H MET A 121 3.810 -15.098 8.638 1.00 1.00 H new ATOM 0 HA MET A 121 3.779 -17.330 8.810 1.00 1.00 H new ATOM 0 HB2 MET A 121 1.524 -16.779 6.834 1.00 1.00 H new ATOM 0 HB3 MET A 121 1.819 -18.388 7.462 1.00 1.00 H new ATOM 0 HG2 MET A 121 1.798 -16.409 9.631 1.00 1.00 H new ATOM 0 HG3 MET A 121 0.314 -16.335 8.703 1.00 1.00 H new ATOM 0 HE1 MET A 121 -1.384 -19.589 9.024 1.00 1.00 H new ATOM 0 HE2 MET A 121 -1.008 -18.181 8.003 1.00 1.00 H new ATOM 0 HE3 MET A 121 -0.080 -19.688 7.818 1.00 1.00 H new ATOM 710 N LYS A 122 5.450 -17.253 6.557 1.00 1.00 N ATOM 711 CA LYS A 122 6.324 -17.843 5.559 1.00 1.00 C ATOM 712 C LYS A 122 5.567 -17.973 4.236 1.00 1.00 C ATOM 713 O LYS A 122 5.621 -19.015 3.584 1.00 1.00 O ATOM 714 CB LYS A 122 6.903 -19.166 6.068 1.00 1.00 C ATOM 715 CG LYS A 122 5.803 -20.215 6.239 1.00 1.00 C ATOM 716 CD LYS A 122 6.400 -21.616 6.392 1.00 1.00 C ATOM 717 CE LYS A 122 7.032 -21.794 7.775 1.00 1.00 C ATOM 718 NZ LYS A 122 5.991 -22.090 8.785 1.00 1.00 N ATOM 0 H LYS A 122 5.859 -16.476 7.076 1.00 1.00 H new ATOM 0 HA LYS A 122 7.181 -17.196 5.374 1.00 1.00 H new ATOM 0 HB2 LYS A 122 7.654 -19.532 5.368 1.00 1.00 H new ATOM 0 HB3 LYS A 122 7.407 -19.004 7.021 1.00 1.00 H new ATOM 0 HG2 LYS A 122 5.200 -19.975 7.115 1.00 1.00 H new ATOM 0 HG3 LYS A 122 5.136 -20.192 5.377 1.00 1.00 H new ATOM 0 HD2 LYS A 122 5.622 -22.365 6.244 1.00 1.00 H new ATOM 0 HD3 LYS A 122 7.152 -21.781 5.620 1.00 1.00 H new ATOM 0 HE2 LYS A 122 7.761 -22.604 7.747 1.00 1.00 H new ATOM 0 HE3 LYS A 122 7.572 -20.889 8.054 1.00 1.00 H new ATOM 0 HZ1 LYS A 122 6.436 -22.208 9.718 1.00 1.00 H new ATOM 0 HZ2 LYS A 122 5.311 -21.304 8.823 1.00 1.00 H new ATOM 0 HZ3 LYS A 122 5.494 -22.966 8.525 1.00 1.00 H new ATOM 727 N MET A 123 4.877 -16.900 3.879 1.00 1.00 N ATOM 728 CA MET A 123 4.109 -16.879 2.645 1.00 1.00 C ATOM 729 C MET A 123 3.764 -15.445 2.238 1.00 1.00 C ATOM 730 O MET A 123 3.514 -14.596 3.092 1.00 1.00 O ATOM 731 CB MET A 123 2.820 -17.681 2.833 1.00 1.00 C ATOM 732 CG MET A 123 2.416 -18.382 1.534 1.00 1.00 C ATOM 733 SD MET A 123 1.867 -20.044 1.882 1.00 1.00 S ATOM 734 CE MET A 123 0.115 -19.859 1.597 1.00 1.00 C ATOM 0 H MET A 123 4.833 -16.038 4.423 1.00 1.00 H new ATOM 0 HA MET A 123 4.713 -17.325 1.855 1.00 1.00 H new ATOM 0 HB2 MET A 123 2.959 -18.421 3.621 1.00 1.00 H new ATOM 0 HB3 MET A 123 2.018 -17.017 3.157 1.00 1.00 H new ATOM 0 HG2 MET A 123 1.620 -17.823 1.042 1.00 1.00 H new ATOM 0 HG3 MET A 123 3.261 -18.406 0.846 1.00 1.00 H new ATOM 0 HE1 MET A 123 -0.385 -20.812 1.771 1.00 1.00 H new ATOM 0 HE2 MET A 123 -0.287 -19.109 2.278 1.00 1.00 H new ATOM 0 HE3 MET A 123 -0.055 -19.543 0.568 1.00 1.00 H new ATOM 742 N MET A 124 3.762 -15.220 0.931 1.00 1.00 N ATOM 743 CA MET A 124 3.451 -13.904 0.400 1.00 1.00 C ATOM 744 C MET A 124 1.952 -13.613 0.497 1.00 1.00 C ATOM 745 O MET A 124 1.129 -14.460 0.153 1.00 1.00 O ATOM 746 CB MET A 124 3.894 -13.827 -1.062 1.00 1.00 C ATOM 747 CG MET A 124 5.382 -13.488 -1.168 1.00 1.00 C ATOM 748 SD MET A 124 5.940 -13.707 -2.849 1.00 1.00 S ATOM 749 CE MET A 124 5.623 -15.450 -3.058 1.00 1.00 C ATOM 0 H MET A 124 3.971 -15.927 0.226 1.00 1.00 H new ATOM 0 HA MET A 124 3.984 -13.159 0.990 1.00 1.00 H new ATOM 0 HB2 MET A 124 3.698 -14.779 -1.555 1.00 1.00 H new ATOM 0 HB3 MET A 124 3.307 -13.071 -1.584 1.00 1.00 H new ATOM 0 HG2 MET A 124 5.552 -12.459 -0.851 1.00 1.00 H new ATOM 0 HG3 MET A 124 5.958 -14.128 -0.499 1.00 1.00 H new ATOM 0 HE1 MET A 124 6.330 -15.865 -3.776 1.00 1.00 H new ATOM 0 HE2 MET A 124 5.738 -15.958 -2.100 1.00 1.00 H new ATOM 0 HE3 MET A 124 4.607 -15.594 -3.425 1.00 1.00 H new ATOM 757 N ASN A 125 1.643 -12.413 0.964 1.00 1.00 N ATOM 758 CA ASN A 125 0.257 -12.000 1.110 1.00 1.00 C ATOM 759 C ASN A 125 0.066 -10.633 0.450 1.00 1.00 C ATOM 760 O ASN A 125 0.451 -9.609 1.012 1.00 1.00 O ATOM 761 CB ASN A 125 -0.126 -11.870 2.585 1.00 1.00 C ATOM 762 CG ASN A 125 0.173 -13.164 3.345 1.00 1.00 C ATOM 763 OD1 ASN A 125 -0.643 -14.068 3.431 1.00 1.00 O ATOM 764 ND2 ASN A 125 1.385 -13.202 3.892 1.00 1.00 N ATOM 0 H ASN A 125 2.329 -11.713 1.247 1.00 1.00 H new ATOM 0 HA ASN A 125 -0.372 -12.755 0.639 1.00 1.00 H new ATOM 0 HB2 ASN A 125 0.424 -11.044 3.036 1.00 1.00 H new ATOM 0 HB3 ASN A 125 -1.186 -11.631 2.670 1.00 1.00 H new ATOM 0 HD21 ASN A 125 1.680 -14.022 4.422 1.00 1.00 H new ATOM 0 HD22 ASN A 125 2.019 -12.411 3.782 1.00 1.00 H new ATOM 770 N GLN A 126 -0.530 -10.661 -0.733 1.00 1.00 N ATOM 771 CA GLN A 126 -0.778 -9.438 -1.476 1.00 1.00 C ATOM 772 C GLN A 126 -1.834 -8.589 -0.763 1.00 1.00 C ATOM 773 O GLN A 126 -2.648 -9.113 -0.005 1.00 1.00 O ATOM 774 CB GLN A 126 -1.201 -9.745 -2.913 1.00 1.00 C ATOM 775 CG GLN A 126 0.019 -9.977 -3.806 1.00 1.00 C ATOM 776 CD GLN A 126 -0.241 -11.104 -4.810 1.00 1.00 C ATOM 777 OE1 GLN A 126 0.361 -12.164 -4.761 1.00 1.00 O ATOM 778 NE2 GLN A 126 -1.170 -10.816 -5.717 1.00 1.00 N ATOM 0 H GLN A 126 -0.849 -11.513 -1.195 1.00 1.00 H new ATOM 0 HA GLN A 126 0.150 -8.868 -1.520 1.00 1.00 H new ATOM 0 HB2 GLN A 126 -1.840 -10.628 -2.927 1.00 1.00 H new ATOM 0 HB3 GLN A 126 -1.792 -8.918 -3.306 1.00 1.00 H new ATOM 0 HG2 GLN A 126 0.263 -9.059 -4.340 1.00 1.00 H new ATOM 0 HG3 GLN A 126 0.883 -10.226 -3.190 1.00 1.00 H new ATOM 0 HE21 GLN A 126 -1.635 -9.908 -5.700 1.00 1.00 H new ATOM 0 HE22 GLN A 126 -1.417 -11.503 -6.429 1.00 1.00 H new ATOM 785 N ILE A 127 -1.784 -7.293 -1.032 1.00 1.00 N ATOM 786 CA ILE A 127 -2.725 -6.367 -0.426 1.00 1.00 C ATOM 787 C ILE A 127 -3.504 -5.644 -1.528 1.00 1.00 C ATOM 788 O ILE A 127 -2.924 -4.898 -2.315 1.00 1.00 O ATOM 789 CB ILE A 127 -2.004 -5.423 0.538 1.00 1.00 C ATOM 790 CG1 ILE A 127 -1.094 -6.202 1.490 1.00 1.00 C ATOM 791 CG2 ILE A 127 -3.001 -4.539 1.290 1.00 1.00 C ATOM 792 CD1 ILE A 127 -1.857 -6.633 2.745 1.00 1.00 C ATOM 0 H ILE A 127 -1.107 -6.862 -1.661 1.00 1.00 H new ATOM 0 HA ILE A 127 -3.454 -6.906 0.179 1.00 1.00 H new ATOM 0 HB ILE A 127 -1.366 -4.760 -0.046 1.00 1.00 H new ATOM 0 HG12 ILE A 127 -0.696 -7.080 0.982 1.00 1.00 H new ATOM 0 HG13 ILE A 127 -0.242 -5.584 1.772 1.00 1.00 H new ATOM 0 HG21 ILE A 127 -2.462 -3.878 1.968 1.00 1.00 H new ATOM 0 HG22 ILE A 127 -3.568 -3.942 0.576 1.00 1.00 H new ATOM 0 HG23 ILE A 127 -3.684 -5.167 1.862 1.00 1.00 H new ATOM 0 HD11 ILE A 127 -1.188 -7.185 3.406 1.00 1.00 H new ATOM 0 HD12 ILE A 127 -2.233 -5.751 3.263 1.00 1.00 H new ATOM 0 HD13 ILE A 127 -2.694 -7.271 2.461 1.00 1.00 H new ATOM 803 N GLU A 128 -4.805 -5.890 -1.548 1.00 1.00 N ATOM 804 CA GLU A 128 -5.669 -5.273 -2.538 1.00 1.00 C ATOM 805 C GLU A 128 -6.281 -3.985 -1.982 1.00 1.00 C ATOM 806 O GLU A 128 -6.654 -3.928 -0.811 1.00 1.00 O ATOM 807 CB GLU A 128 -6.759 -6.244 -2.998 1.00 1.00 C ATOM 808 CG GLU A 128 -7.550 -5.664 -4.173 1.00 1.00 C ATOM 809 CD GLU A 128 -8.470 -6.720 -4.788 1.00 1.00 C ATOM 810 OE1 GLU A 128 -9.531 -7.023 -4.222 1.00 1.00 O ATOM 811 OE2 GLU A 128 -8.050 -7.232 -5.895 1.00 1.00 O ATOM 0 H GLU A 128 -5.282 -6.509 -0.893 1.00 1.00 H new ATOM 0 HA GLU A 128 -5.065 -5.018 -3.409 1.00 1.00 H new ATOM 0 HB2 GLU A 128 -6.307 -7.191 -3.292 1.00 1.00 H new ATOM 0 HB3 GLU A 128 -7.435 -6.457 -2.170 1.00 1.00 H new ATOM 0 HG2 GLU A 128 -8.142 -4.814 -3.833 1.00 1.00 H new ATOM 0 HG3 GLU A 128 -6.861 -5.291 -4.931 1.00 1.00 H new ATOM 817 N ALA A 129 -6.364 -2.985 -2.846 1.00 1.00 N ATOM 818 CA ALA A 129 -6.923 -1.702 -2.456 1.00 1.00 C ATOM 819 C ALA A 129 -8.302 -1.922 -1.828 1.00 1.00 C ATOM 820 O ALA A 129 -9.125 -2.656 -2.371 1.00 1.00 O ATOM 821 CB ALA A 129 -6.979 -0.777 -3.673 1.00 1.00 C ATOM 0 H ALA A 129 -6.053 -3.037 -3.816 1.00 1.00 H new ATOM 0 HA ALA A 129 -6.292 -1.220 -1.709 1.00 1.00 H new ATOM 0 HB1 ALA A 129 -7.399 0.185 -3.380 1.00 1.00 H new ATOM 0 HB2 ALA A 129 -5.973 -0.630 -4.065 1.00 1.00 H new ATOM 0 HB3 ALA A 129 -7.606 -1.226 -4.443 1.00 1.00 H new ATOM 827 N ASP A 130 -8.509 -1.273 -0.692 1.00 1.00 N ATOM 828 CA ASP A 130 -9.773 -1.388 0.016 1.00 1.00 C ATOM 829 C ASP A 130 -10.439 -0.012 0.089 1.00 1.00 C ATOM 830 O ASP A 130 -11.377 0.187 0.858 1.00 1.00 O ATOM 831 CB ASP A 130 -9.560 -1.887 1.447 1.00 1.00 C ATOM 832 CG ASP A 130 -9.995 -3.330 1.700 1.00 1.00 C ATOM 833 OD1 ASP A 130 -9.171 -4.257 1.696 1.00 1.00 O ATOM 834 OD2 ASP A 130 -11.259 -3.490 1.910 1.00 1.00 O ATOM 0 H ASP A 130 -7.823 -0.666 -0.244 1.00 1.00 H new ATOM 0 HA ASP A 130 -10.398 -2.099 -0.524 1.00 1.00 H new ATOM 0 HB2 ASP A 130 -8.503 -1.794 1.695 1.00 1.00 H new ATOM 0 HB3 ASP A 130 -10.106 -1.234 2.128 1.00 1.00 H new ATOM 839 N LYS A 131 -9.928 0.901 -0.724 1.00 1.00 N ATOM 840 CA LYS A 131 -10.462 2.252 -0.761 1.00 1.00 C ATOM 841 C LYS A 131 -9.725 3.057 -1.834 1.00 1.00 C ATOM 842 O LYS A 131 -8.657 3.610 -1.576 1.00 1.00 O ATOM 843 CB LYS A 131 -10.408 2.888 0.629 1.00 1.00 C ATOM 844 CG LYS A 131 -11.566 3.869 0.829 1.00 1.00 C ATOM 845 CD LYS A 131 -11.047 5.292 1.044 1.00 1.00 C ATOM 846 CE LYS A 131 -12.199 6.257 1.333 1.00 1.00 C ATOM 847 NZ LYS A 131 -11.717 7.423 2.106 1.00 1.00 N ATOM 0 H LYS A 131 -9.150 0.732 -1.362 1.00 1.00 H new ATOM 0 HA LYS A 131 -11.516 2.238 -1.039 1.00 1.00 H new ATOM 0 HB2 LYS A 131 -10.450 2.110 1.391 1.00 1.00 H new ATOM 0 HB3 LYS A 131 -9.459 3.409 0.758 1.00 1.00 H new ATOM 0 HG2 LYS A 131 -12.222 3.845 -0.041 1.00 1.00 H new ATOM 0 HG3 LYS A 131 -12.163 3.562 1.688 1.00 1.00 H new ATOM 0 HD2 LYS A 131 -10.341 5.304 1.874 1.00 1.00 H new ATOM 0 HD3 LYS A 131 -10.504 5.623 0.159 1.00 1.00 H new ATOM 0 HE2 LYS A 131 -12.643 6.593 0.396 1.00 1.00 H new ATOM 0 HE3 LYS A 131 -12.981 5.742 1.890 1.00 1.00 H new ATOM 0 HZ1 LYS A 131 -12.511 8.068 2.293 1.00 1.00 H new ATOM 0 HZ2 LYS A 131 -11.314 7.099 3.008 1.00 1.00 H new ATOM 0 HZ3 LYS A 131 -10.987 7.923 1.560 1.00 1.00 H new ATOM 856 N SER A 132 -10.325 3.098 -3.014 1.00 1.00 N ATOM 857 CA SER A 132 -9.740 3.826 -4.127 1.00 1.00 C ATOM 858 C SER A 132 -9.119 5.132 -3.629 1.00 1.00 C ATOM 859 O SER A 132 -9.763 5.897 -2.911 1.00 1.00 O ATOM 860 CB SER A 132 -10.784 4.113 -5.208 1.00 1.00 C ATOM 861 OG SER A 132 -11.716 5.111 -4.799 1.00 1.00 O ATOM 0 H SER A 132 -11.211 2.639 -3.224 1.00 1.00 H new ATOM 0 HA SER A 132 -8.960 3.206 -4.569 1.00 1.00 H new ATOM 0 HB2 SER A 132 -10.282 4.438 -6.120 1.00 1.00 H new ATOM 0 HB3 SER A 132 -11.319 3.194 -5.448 1.00 1.00 H new ATOM 0 HG SER A 132 -12.365 5.267 -5.517 1.00 1.00 H new ATOM 866 N GLY A 133 -7.875 5.349 -4.028 1.00 1.00 N ATOM 867 CA GLY A 133 -7.159 6.550 -3.631 1.00 1.00 C ATOM 868 C GLY A 133 -5.992 6.832 -4.578 1.00 1.00 C ATOM 869 O GLY A 133 -5.848 6.171 -5.607 1.00 1.00 O ATOM 0 H GLY A 133 -7.344 4.713 -4.623 1.00 1.00 H new ATOM 0 HA2 GLY A 133 -7.842 7.400 -3.627 1.00 1.00 H new ATOM 0 HA3 GLY A 133 -6.786 6.435 -2.613 1.00 1.00 H new ATOM 873 N THR A 134 -5.187 7.814 -4.200 1.00 1.00 N ATOM 874 CA THR A 134 -4.037 8.191 -5.003 1.00 1.00 C ATOM 875 C THR A 134 -2.766 8.184 -4.151 1.00 1.00 C ATOM 876 O THR A 134 -2.825 8.401 -2.941 1.00 1.00 O ATOM 877 CB THR A 134 -4.332 9.548 -5.645 1.00 1.00 C ATOM 878 OG1 THR A 134 -5.092 9.225 -6.805 1.00 1.00 O ATOM 879 CG2 THR A 134 -3.074 10.221 -6.197 1.00 1.00 C ATOM 0 H THR A 134 -5.309 8.360 -3.347 1.00 1.00 H new ATOM 0 HA THR A 134 -3.859 7.470 -5.801 1.00 1.00 H new ATOM 0 HB THR A 134 -4.800 10.203 -4.910 1.00 1.00 H new ATOM 0 HG1 THR A 134 -5.328 10.048 -7.281 1.00 1.00 H new ATOM 0 HG21 THR A 134 -3.340 11.180 -6.641 1.00 1.00 H new ATOM 0 HG22 THR A 134 -2.362 10.381 -5.387 1.00 1.00 H new ATOM 0 HG23 THR A 134 -2.623 9.582 -6.956 1.00 1.00 H new ATOM 887 N VAL A 135 -1.647 7.935 -4.815 1.00 1.00 N ATOM 888 CA VAL A 135 -0.365 7.898 -4.134 1.00 1.00 C ATOM 889 C VAL A 135 -0.202 9.166 -3.292 1.00 1.00 C ATOM 890 O VAL A 135 -0.540 10.259 -3.740 1.00 1.00 O ATOM 891 CB VAL A 135 0.763 7.707 -5.151 1.00 1.00 C ATOM 892 CG1 VAL A 135 0.828 8.885 -6.125 1.00 1.00 C ATOM 893 CG2 VAL A 135 2.106 7.503 -4.447 1.00 1.00 C ATOM 0 H VAL A 135 -1.602 7.757 -5.818 1.00 1.00 H new ATOM 0 HA VAL A 135 -0.319 7.048 -3.454 1.00 1.00 H new ATOM 0 HB VAL A 135 0.546 6.808 -5.727 1.00 1.00 H new ATOM 0 HG11 VAL A 135 1.638 8.724 -6.837 1.00 1.00 H new ATOM 0 HG12 VAL A 135 -0.117 8.965 -6.662 1.00 1.00 H new ATOM 0 HG13 VAL A 135 1.010 9.806 -5.571 1.00 1.00 H new ATOM 0 HG21 VAL A 135 2.891 7.370 -5.192 1.00 1.00 H new ATOM 0 HG22 VAL A 135 2.332 8.376 -3.834 1.00 1.00 H new ATOM 0 HG23 VAL A 135 2.054 6.618 -3.813 1.00 1.00 H new ATOM 903 N LYS A 136 0.314 8.975 -2.087 1.00 1.00 N ATOM 904 CA LYS A 136 0.524 10.089 -1.178 1.00 1.00 C ATOM 905 C LYS A 136 1.989 10.110 -0.734 1.00 1.00 C ATOM 906 O LYS A 136 2.601 11.173 -0.653 1.00 1.00 O ATOM 907 CB LYS A 136 -0.469 10.028 -0.017 1.00 1.00 C ATOM 908 CG LYS A 136 -0.750 11.426 0.539 1.00 1.00 C ATOM 909 CD LYS A 136 -1.277 12.355 -0.557 1.00 1.00 C ATOM 910 CE LYS A 136 -0.188 13.320 -1.030 1.00 1.00 C ATOM 911 NZ LYS A 136 -0.487 13.812 -2.393 1.00 1.00 N ATOM 0 H LYS A 136 0.593 8.066 -1.719 1.00 1.00 H new ATOM 0 HA LYS A 136 0.330 11.035 -1.684 1.00 1.00 H new ATOM 0 HB2 LYS A 136 -1.400 9.573 -0.354 1.00 1.00 H new ATOM 0 HB3 LYS A 136 -0.071 9.392 0.773 1.00 1.00 H new ATOM 0 HG2 LYS A 136 -1.479 11.360 1.347 1.00 1.00 H new ATOM 0 HG3 LYS A 136 0.163 11.842 0.966 1.00 1.00 H new ATOM 0 HD2 LYS A 136 -1.634 11.763 -1.400 1.00 1.00 H new ATOM 0 HD3 LYS A 136 -2.130 12.920 -0.181 1.00 1.00 H new ATOM 0 HE2 LYS A 136 -0.116 14.162 -0.341 1.00 1.00 H new ATOM 0 HE3 LYS A 136 0.779 12.818 -1.022 1.00 1.00 H new ATOM 0 HZ1 LYS A 136 0.262 14.466 -2.698 1.00 1.00 H new ATOM 0 HZ2 LYS A 136 -0.533 13.007 -3.050 1.00 1.00 H new ATOM 0 HZ3 LYS A 136 -1.400 14.309 -2.390 1.00 1.00 H new ATOM 920 N ALA A 137 2.507 8.921 -0.460 1.00 1.00 N ATOM 921 CA ALA A 137 3.888 8.791 -0.027 1.00 1.00 C ATOM 922 C ALA A 137 4.093 7.408 0.598 1.00 1.00 C ATOM 923 O ALA A 137 3.294 6.973 1.426 1.00 1.00 O ATOM 924 CB ALA A 137 4.230 9.924 0.942 1.00 1.00 C ATOM 0 H ALA A 137 1.996 8.041 -0.529 1.00 1.00 H new ATOM 0 HA ALA A 137 4.566 8.874 -0.877 1.00 1.00 H new ATOM 0 HB1 ALA A 137 5.266 9.825 1.266 1.00 1.00 H new ATOM 0 HB2 ALA A 137 4.096 10.883 0.442 1.00 1.00 H new ATOM 0 HB3 ALA A 137 3.572 9.872 1.809 1.00 1.00 H new ATOM 930 N ILE A 138 5.167 6.757 0.177 1.00 1.00 N ATOM 931 CA ILE A 138 5.487 5.434 0.685 1.00 1.00 C ATOM 932 C ILE A 138 6.545 5.555 1.783 1.00 1.00 C ATOM 933 O ILE A 138 7.537 6.264 1.619 1.00 1.00 O ATOM 934 CB ILE A 138 5.893 4.504 -0.460 1.00 1.00 C ATOM 935 CG1 ILE A 138 5.187 4.894 -1.760 1.00 1.00 C ATOM 936 CG2 ILE A 138 5.646 3.040 -0.091 1.00 1.00 C ATOM 937 CD1 ILE A 138 5.439 3.855 -2.855 1.00 1.00 C ATOM 0 H ILE A 138 5.827 7.121 -0.510 1.00 1.00 H new ATOM 0 HA ILE A 138 4.607 4.978 1.139 1.00 1.00 H new ATOM 0 HB ILE A 138 6.964 4.618 -0.629 1.00 1.00 H new ATOM 0 HG12 ILE A 138 4.116 4.987 -1.582 1.00 1.00 H new ATOM 0 HG13 ILE A 138 5.541 5.870 -2.092 1.00 1.00 H new ATOM 0 HG21 ILE A 138 5.943 2.400 -0.922 1.00 1.00 H new ATOM 0 HG22 ILE A 138 6.232 2.783 0.792 1.00 1.00 H new ATOM 0 HG23 ILE A 138 4.587 2.892 0.121 1.00 1.00 H new ATOM 0 HD11 ILE A 138 4.926 4.157 -3.768 1.00 1.00 H new ATOM 0 HD12 ILE A 138 6.509 3.782 -3.048 1.00 1.00 H new ATOM 0 HD13 ILE A 138 5.062 2.885 -2.530 1.00 1.00 H new ATOM 948 N LEU A 139 6.298 4.854 2.880 1.00 1.00 N ATOM 949 CA LEU A 139 7.216 4.875 4.004 1.00 1.00 C ATOM 950 C LEU A 139 8.019 3.572 4.026 1.00 1.00 C ATOM 951 O LEU A 139 9.237 3.592 4.193 1.00 1.00 O ATOM 952 CB LEU A 139 6.463 5.155 5.307 1.00 1.00 C ATOM 953 CG LEU A 139 5.058 5.740 5.156 1.00 1.00 C ATOM 954 CD1 LEU A 139 4.310 5.720 6.490 1.00 1.00 C ATOM 955 CD2 LEU A 139 5.110 7.142 4.549 1.00 1.00 C ATOM 0 H LEU A 139 5.474 4.268 3.013 1.00 1.00 H new ATOM 0 HA LEU A 139 7.932 5.690 3.895 1.00 1.00 H new ATOM 0 HB2 LEU A 139 6.389 4.224 5.868 1.00 1.00 H new ATOM 0 HB3 LEU A 139 7.059 5.842 5.907 1.00 1.00 H new ATOM 0 HG LEU A 139 4.499 5.111 4.464 1.00 1.00 H new ATOM 0 HD11 LEU A 139 3.314 6.141 6.355 1.00 1.00 H new ATOM 0 HD12 LEU A 139 4.225 4.693 6.844 1.00 1.00 H new ATOM 0 HD13 LEU A 139 4.858 6.312 7.223 1.00 1.00 H new ATOM 0 HD21 LEU A 139 4.098 7.535 4.453 1.00 1.00 H new ATOM 0 HD22 LEU A 139 5.693 7.797 5.196 1.00 1.00 H new ATOM 0 HD23 LEU A 139 5.576 7.095 3.565 1.00 1.00 H new ATOM 966 N VAL A 140 7.302 2.470 3.856 1.00 1.00 N ATOM 967 CA VAL A 140 7.931 1.161 3.854 1.00 1.00 C ATOM 968 C VAL A 140 8.737 0.989 2.564 1.00 1.00 C ATOM 969 O VAL A 140 8.542 1.731 1.603 1.00 1.00 O ATOM 970 CB VAL A 140 6.875 0.072 4.048 1.00 1.00 C ATOM 971 CG1 VAL A 140 5.879 0.061 2.886 1.00 1.00 C ATOM 972 CG2 VAL A 140 7.527 -1.301 4.223 1.00 1.00 C ATOM 0 H VAL A 140 6.291 2.458 3.719 1.00 1.00 H new ATOM 0 HA VAL A 140 8.628 1.071 4.688 1.00 1.00 H new ATOM 0 HB VAL A 140 6.324 0.300 4.961 1.00 1.00 H new ATOM 0 HG11 VAL A 140 5.139 -0.722 3.049 1.00 1.00 H new ATOM 0 HG12 VAL A 140 5.378 1.027 2.827 1.00 1.00 H new ATOM 0 HG13 VAL A 140 6.410 -0.130 1.953 1.00 1.00 H new ATOM 0 HG21 VAL A 140 6.753 -2.057 4.359 1.00 1.00 H new ATOM 0 HG22 VAL A 140 8.116 -1.540 3.337 1.00 1.00 H new ATOM 0 HG23 VAL A 140 8.177 -1.286 5.098 1.00 1.00 H new ATOM 982 N GLU A 141 9.627 0.007 2.587 1.00 1.00 N ATOM 983 CA GLU A 141 10.463 -0.272 1.432 1.00 1.00 C ATOM 984 C GLU A 141 10.143 -1.657 0.866 1.00 1.00 C ATOM 985 O GLU A 141 9.422 -2.435 1.490 1.00 1.00 O ATOM 986 CB GLU A 141 11.947 -0.154 1.787 1.00 1.00 C ATOM 987 CG GLU A 141 12.609 0.984 1.007 1.00 1.00 C ATOM 988 CD GLU A 141 12.197 2.346 1.568 1.00 1.00 C ATOM 989 OE1 GLU A 141 11.856 2.450 2.755 1.00 1.00 O ATOM 990 OE2 GLU A 141 12.241 3.319 0.722 1.00 1.00 O ATOM 0 H GLU A 141 9.787 -0.605 3.387 1.00 1.00 H new ATOM 0 HA GLU A 141 10.247 0.471 0.664 1.00 1.00 H new ATOM 0 HB2 GLU A 141 12.056 0.023 2.857 1.00 1.00 H new ATOM 0 HB3 GLU A 141 12.453 -1.094 1.566 1.00 1.00 H new ATOM 0 HG2 GLU A 141 13.693 0.880 1.055 1.00 1.00 H new ATOM 0 HG3 GLU A 141 12.329 0.920 -0.044 1.00 1.00 H new ATOM 996 N SER A 142 10.694 -1.923 -0.309 1.00 1.00 N ATOM 997 CA SER A 142 10.476 -3.200 -0.966 1.00 1.00 C ATOM 998 C SER A 142 11.448 -4.245 -0.414 1.00 1.00 C ATOM 999 O SER A 142 12.536 -4.435 -0.958 1.00 1.00 O ATOM 1000 CB SER A 142 10.636 -3.074 -2.483 1.00 1.00 C ATOM 1001 OG SER A 142 10.837 -4.341 -3.104 1.00 1.00 O ATOM 0 H SER A 142 11.291 -1.275 -0.823 1.00 1.00 H new ATOM 0 HA SER A 142 9.454 -3.520 -0.762 1.00 1.00 H new ATOM 0 HB2 SER A 142 9.749 -2.601 -2.903 1.00 1.00 H new ATOM 0 HB3 SER A 142 11.481 -2.422 -2.706 1.00 1.00 H new ATOM 0 HG SER A 142 10.933 -4.219 -4.072 1.00 1.00 H new ATOM 1006 N GLY A 143 11.023 -4.894 0.660 1.00 1.00 N ATOM 1007 CA GLY A 143 11.842 -5.915 1.290 1.00 1.00 C ATOM 1008 C GLY A 143 12.057 -5.605 2.773 1.00 1.00 C ATOM 1009 O GLY A 143 12.641 -6.407 3.501 1.00 1.00 O ATOM 0 H GLY A 143 10.122 -4.732 1.110 1.00 1.00 H new ATOM 0 HA2 GLY A 143 11.363 -6.888 1.184 1.00 1.00 H new ATOM 0 HA3 GLY A 143 12.805 -5.977 0.784 1.00 1.00 H new ATOM 1013 N GLN A 144 11.574 -4.440 3.178 1.00 1.00 N ATOM 1014 CA GLN A 144 11.706 -4.014 4.561 1.00 1.00 C ATOM 1015 C GLN A 144 10.637 -4.684 5.426 1.00 1.00 C ATOM 1016 O GLN A 144 9.544 -4.984 4.949 1.00 1.00 O ATOM 1017 CB GLN A 144 11.630 -2.491 4.675 1.00 1.00 C ATOM 1018 CG GLN A 144 12.989 -1.850 4.388 1.00 1.00 C ATOM 1019 CD GLN A 144 13.068 -0.443 4.982 1.00 1.00 C ATOM 1020 OE1 GLN A 144 12.276 -0.050 5.823 1.00 1.00 O ATOM 1021 NE2 GLN A 144 14.067 0.292 4.502 1.00 1.00 N ATOM 0 H GLN A 144 11.090 -3.777 2.572 1.00 1.00 H new ATOM 0 HA GLN A 144 12.686 -4.323 4.925 1.00 1.00 H new ATOM 0 HB2 GLN A 144 10.888 -2.107 3.975 1.00 1.00 H new ATOM 0 HB3 GLN A 144 11.298 -2.214 5.675 1.00 1.00 H new ATOM 0 HG2 GLN A 144 13.783 -2.470 4.805 1.00 1.00 H new ATOM 0 HG3 GLN A 144 13.153 -1.804 3.311 1.00 1.00 H new ATOM 0 HE21 GLN A 144 14.695 -0.098 3.799 1.00 1.00 H new ATOM 0 HE22 GLN A 144 14.206 1.245 4.837 1.00 1.00 H new ATOM 1028 N PRO A 145 10.998 -4.904 6.719 1.00 1.00 N ATOM 1029 CA PRO A 145 10.083 -5.533 7.655 1.00 1.00 C ATOM 1030 C PRO A 145 8.989 -4.556 8.093 1.00 1.00 C ATOM 1031 O PRO A 145 9.171 -3.341 8.019 1.00 1.00 O ATOM 1032 CB PRO A 145 10.958 -5.999 8.808 1.00 1.00 C ATOM 1033 CG PRO A 145 12.251 -5.209 8.696 1.00 1.00 C ATOM 1034 CD PRO A 145 12.284 -4.562 7.321 1.00 1.00 C ATOM 0 HA PRO A 145 9.544 -6.373 7.216 1.00 1.00 H new ATOM 0 HB2 PRO A 145 10.471 -5.817 9.766 1.00 1.00 H new ATOM 0 HB3 PRO A 145 11.148 -7.070 8.746 1.00 1.00 H new ATOM 0 HG2 PRO A 145 12.303 -4.450 9.476 1.00 1.00 H new ATOM 0 HG3 PRO A 145 13.112 -5.864 8.830 1.00 1.00 H new ATOM 0 HD2 PRO A 145 12.412 -3.482 7.395 1.00 1.00 H new ATOM 0 HD3 PRO A 145 13.114 -4.941 6.725 1.00 1.00 H new ATOM 1039 N VAL A 146 7.877 -5.122 8.537 1.00 1.00 N ATOM 1040 CA VAL A 146 6.754 -4.317 8.985 1.00 1.00 C ATOM 1041 C VAL A 146 6.156 -4.941 10.247 1.00 1.00 C ATOM 1042 O VAL A 146 6.401 -6.110 10.543 1.00 1.00 O ATOM 1043 CB VAL A 146 5.734 -4.164 7.854 1.00 1.00 C ATOM 1044 CG1 VAL A 146 6.431 -3.864 6.525 1.00 1.00 C ATOM 1045 CG2 VAL A 146 4.851 -5.408 7.740 1.00 1.00 C ATOM 0 H VAL A 146 7.730 -6.130 8.596 1.00 1.00 H new ATOM 0 HA VAL A 146 7.085 -3.311 9.244 1.00 1.00 H new ATOM 0 HB VAL A 146 5.091 -3.317 8.095 1.00 1.00 H new ATOM 0 HG11 VAL A 146 5.684 -3.760 5.738 1.00 1.00 H new ATOM 0 HG12 VAL A 146 6.998 -2.937 6.612 1.00 1.00 H new ATOM 0 HG13 VAL A 146 7.108 -4.681 6.277 1.00 1.00 H new ATOM 0 HG21 VAL A 146 4.135 -5.273 6.929 1.00 1.00 H new ATOM 0 HG22 VAL A 146 5.474 -6.278 7.533 1.00 1.00 H new ATOM 0 HG23 VAL A 146 4.314 -5.560 8.676 1.00 1.00 H new ATOM 1055 N GLU A 147 5.383 -4.133 10.959 1.00 1.00 N ATOM 1056 CA GLU A 147 4.749 -4.592 12.183 1.00 1.00 C ATOM 1057 C GLU A 147 3.305 -4.089 12.253 1.00 1.00 C ATOM 1058 O GLU A 147 2.965 -3.081 11.635 1.00 1.00 O ATOM 1059 CB GLU A 147 5.544 -4.148 13.413 1.00 1.00 C ATOM 1060 CG GLU A 147 5.306 -2.667 13.715 1.00 1.00 C ATOM 1061 CD GLU A 147 5.960 -2.266 15.039 1.00 1.00 C ATOM 1062 OE1 GLU A 147 7.152 -2.537 15.250 1.00 1.00 O ATOM 1063 OE2 GLU A 147 5.183 -1.650 15.865 1.00 1.00 O ATOM 0 H GLU A 147 5.182 -3.164 10.711 1.00 1.00 H new ATOM 0 HA GLU A 147 4.734 -5.682 12.175 1.00 1.00 H new ATOM 0 HB2 GLU A 147 5.254 -4.750 14.274 1.00 1.00 H new ATOM 0 HB3 GLU A 147 6.607 -4.322 13.246 1.00 1.00 H new ATOM 0 HG2 GLU A 147 5.710 -2.058 12.906 1.00 1.00 H new ATOM 0 HG3 GLU A 147 4.235 -2.469 13.759 1.00 1.00 H new ATOM 1069 N PHE A 148 2.495 -4.813 13.012 1.00 1.00 N ATOM 1070 CA PHE A 148 1.097 -4.452 13.171 1.00 1.00 C ATOM 1071 C PHE A 148 0.956 -3.032 13.720 1.00 1.00 C ATOM 1072 O PHE A 148 1.710 -2.626 14.603 1.00 1.00 O ATOM 1073 CB PHE A 148 0.493 -5.437 14.175 1.00 1.00 C ATOM 1074 CG PHE A 148 -0.931 -5.086 14.610 1.00 1.00 C ATOM 1075 CD1 PHE A 148 -1.134 -4.150 15.577 1.00 1.00 C ATOM 1076 CD2 PHE A 148 -1.993 -5.709 14.033 1.00 1.00 C ATOM 1077 CE1 PHE A 148 -2.455 -3.823 15.982 1.00 1.00 C ATOM 1078 CE2 PHE A 148 -3.313 -5.382 14.438 1.00 1.00 C ATOM 1079 CZ PHE A 148 -3.518 -4.447 15.403 1.00 1.00 C ATOM 0 H PHE A 148 2.781 -5.648 13.523 1.00 1.00 H new ATOM 0 HA PHE A 148 0.590 -4.491 12.207 1.00 1.00 H new ATOM 0 HB2 PHE A 148 0.492 -6.434 13.735 1.00 1.00 H new ATOM 0 HB3 PHE A 148 1.132 -5.478 15.057 1.00 1.00 H new ATOM 0 HD1 PHE A 148 -0.290 -3.656 16.036 1.00 1.00 H new ATOM 0 HD2 PHE A 148 -1.832 -6.453 13.267 1.00 1.00 H new ATOM 0 HE1 PHE A 148 -2.617 -3.080 16.749 1.00 1.00 H new ATOM 0 HE2 PHE A 148 -4.156 -5.877 13.979 1.00 1.00 H new ATOM 0 HZ PHE A 148 -4.523 -4.199 15.710 1.00 1.00 H new ATOM 1088 N ASP A 149 -0.015 -2.315 13.175 1.00 1.00 N ATOM 1089 CA ASP A 149 -0.264 -0.947 13.599 1.00 1.00 C ATOM 1090 C ASP A 149 0.721 -0.012 12.897 1.00 1.00 C ATOM 1091 O ASP A 149 0.662 1.204 13.072 1.00 1.00 O ATOM 1092 CB ASP A 149 -0.068 -0.795 15.108 1.00 1.00 C ATOM 1093 CG ASP A 149 -0.809 0.385 15.741 1.00 1.00 C ATOM 1094 OD1 ASP A 149 -1.987 0.633 15.444 1.00 1.00 O ATOM 1095 OD2 ASP A 149 -0.117 1.075 16.584 1.00 1.00 O ATOM 0 H ASP A 149 -0.639 -2.655 12.443 1.00 1.00 H new ATOM 0 HA ASP A 149 -1.293 -0.696 13.342 1.00 1.00 H new ATOM 0 HB2 ASP A 149 -0.394 -1.713 15.596 1.00 1.00 H new ATOM 0 HB3 ASP A 149 0.997 -0.687 15.312 1.00 1.00 H new ATOM 1100 N GLU A 150 1.606 -0.615 12.115 1.00 1.00 N ATOM 1101 CA GLU A 150 2.604 0.149 11.385 1.00 1.00 C ATOM 1102 C GLU A 150 2.093 0.486 9.984 1.00 1.00 C ATOM 1103 O GLU A 150 1.507 -0.362 9.312 1.00 1.00 O ATOM 1104 CB GLU A 150 3.932 -0.606 11.319 1.00 1.00 C ATOM 1105 CG GLU A 150 5.113 0.365 11.251 1.00 1.00 C ATOM 1106 CD GLU A 150 5.463 0.702 9.800 1.00 1.00 C ATOM 1107 OE1 GLU A 150 5.226 -0.116 8.899 1.00 1.00 O ATOM 1108 OE2 GLU A 150 6.000 1.862 9.625 1.00 1.00 O ATOM 0 H GLU A 150 1.652 -1.624 11.971 1.00 1.00 H new ATOM 0 HA GLU A 150 2.782 1.082 11.919 1.00 1.00 H new ATOM 0 HB2 GLU A 150 4.034 -1.247 12.195 1.00 1.00 H new ATOM 0 HB3 GLU A 150 3.941 -1.257 10.445 1.00 1.00 H new ATOM 0 HG2 GLU A 150 4.868 1.279 11.792 1.00 1.00 H new ATOM 0 HG3 GLU A 150 5.979 -0.075 11.745 1.00 1.00 H new ATOM 1114 N PRO A 151 2.340 1.759 9.572 1.00 1.00 N ATOM 1115 CA PRO A 151 1.911 2.218 8.262 1.00 1.00 C ATOM 1116 C PRO A 151 2.810 1.650 7.161 1.00 1.00 C ATOM 1117 O PRO A 151 3.955 1.281 7.418 1.00 1.00 O ATOM 1118 CB PRO A 151 1.957 3.735 8.342 1.00 1.00 C ATOM 1119 CG PRO A 151 2.848 4.063 9.530 1.00 1.00 C ATOM 1120 CD PRO A 151 3.031 2.790 10.339 1.00 1.00 C ATOM 0 HA PRO A 151 0.909 1.876 8.004 1.00 1.00 H new ATOM 0 HB2 PRO A 151 2.358 4.163 7.423 1.00 1.00 H new ATOM 0 HB3 PRO A 151 0.958 4.149 8.477 1.00 1.00 H new ATOM 0 HG2 PRO A 151 3.812 4.442 9.191 1.00 1.00 H new ATOM 0 HG3 PRO A 151 2.396 4.843 10.143 1.00 1.00 H new ATOM 0 HD2 PRO A 151 4.087 2.549 10.464 1.00 1.00 H new ATOM 0 HD3 PRO A 151 2.606 2.891 11.338 1.00 1.00 H new ATOM 1125 N LEU A 152 2.258 1.600 5.957 1.00 1.00 N ATOM 1126 CA LEU A 152 2.994 1.083 4.817 1.00 1.00 C ATOM 1127 C LEU A 152 3.109 2.176 3.753 1.00 1.00 C ATOM 1128 O LEU A 152 4.143 2.834 3.643 1.00 1.00 O ATOM 1129 CB LEU A 152 2.354 -0.208 4.305 1.00 1.00 C ATOM 1130 CG LEU A 152 2.190 -1.330 5.334 1.00 1.00 C ATOM 1131 CD1 LEU A 152 1.408 -2.504 4.745 1.00 1.00 C ATOM 1132 CD2 LEU A 152 3.547 -1.766 5.889 1.00 1.00 C ATOM 0 H LEU A 152 1.309 1.909 5.747 1.00 1.00 H new ATOM 0 HA LEU A 152 4.009 0.813 5.110 1.00 1.00 H new ATOM 0 HB2 LEU A 152 1.371 0.033 3.900 1.00 1.00 H new ATOM 0 HB3 LEU A 152 2.956 -0.585 3.478 1.00 1.00 H new ATOM 0 HG LEU A 152 1.608 -0.944 6.171 1.00 1.00 H new ATOM 0 HD11 LEU A 152 1.306 -3.287 5.497 1.00 1.00 H new ATOM 0 HD12 LEU A 152 0.419 -2.165 4.438 1.00 1.00 H new ATOM 0 HD13 LEU A 152 1.941 -2.899 3.880 1.00 1.00 H new ATOM 0 HD21 LEU A 152 3.403 -2.564 6.618 1.00 1.00 H new ATOM 0 HD22 LEU A 152 4.174 -2.128 5.074 1.00 1.00 H new ATOM 0 HD23 LEU A 152 4.032 -0.918 6.371 1.00 1.00 H new ATOM 1143 N VAL A 153 2.034 2.336 2.996 1.00 1.00 N ATOM 1144 CA VAL A 153 2.001 3.338 1.944 1.00 1.00 C ATOM 1145 C VAL A 153 0.913 4.367 2.259 1.00 1.00 C ATOM 1146 O VAL A 153 -0.181 4.006 2.691 1.00 1.00 O ATOM 1147 CB VAL A 153 1.811 2.664 0.584 1.00 1.00 C ATOM 1148 CG1 VAL A 153 1.892 3.685 -0.551 1.00 1.00 C ATOM 1149 CG2 VAL A 153 2.827 1.538 0.383 1.00 1.00 C ATOM 0 H VAL A 153 1.179 1.788 3.090 1.00 1.00 H new ATOM 0 HA VAL A 153 2.950 3.872 1.896 1.00 1.00 H new ATOM 0 HB VAL A 153 0.814 2.223 0.566 1.00 1.00 H new ATOM 0 HG11 VAL A 153 1.754 3.179 -1.506 1.00 1.00 H new ATOM 0 HG12 VAL A 153 1.112 4.435 -0.422 1.00 1.00 H new ATOM 0 HG13 VAL A 153 2.868 4.170 -0.535 1.00 1.00 H new ATOM 0 HG21 VAL A 153 2.670 1.076 -0.592 1.00 1.00 H new ATOM 0 HG22 VAL A 153 3.837 1.946 0.433 1.00 1.00 H new ATOM 0 HG23 VAL A 153 2.699 0.789 1.165 1.00 1.00 H new ATOM 1159 N VAL A 154 1.251 5.627 2.031 1.00 1.00 N ATOM 1160 CA VAL A 154 0.316 6.710 2.285 1.00 1.00 C ATOM 1161 C VAL A 154 -0.439 7.040 0.995 1.00 1.00 C ATOM 1162 O VAL A 154 0.174 7.358 -0.023 1.00 1.00 O ATOM 1163 CB VAL A 154 1.058 7.915 2.869 1.00 1.00 C ATOM 1164 CG1 VAL A 154 0.075 8.931 3.455 1.00 1.00 C ATOM 1165 CG2 VAL A 154 2.081 7.474 3.915 1.00 1.00 C ATOM 0 H VAL A 154 2.159 5.923 1.673 1.00 1.00 H new ATOM 0 HA VAL A 154 -0.424 6.410 3.027 1.00 1.00 H new ATOM 0 HB VAL A 154 1.599 8.402 2.058 1.00 1.00 H new ATOM 0 HG11 VAL A 154 0.627 9.777 3.863 1.00 1.00 H new ATOM 0 HG12 VAL A 154 -0.597 9.280 2.671 1.00 1.00 H new ATOM 0 HG13 VAL A 154 -0.506 8.460 4.248 1.00 1.00 H new ATOM 0 HG21 VAL A 154 2.594 8.349 4.314 1.00 1.00 H new ATOM 0 HG22 VAL A 154 1.571 6.952 4.725 1.00 1.00 H new ATOM 0 HG23 VAL A 154 2.808 6.806 3.454 1.00 1.00 H new ATOM 1175 N ILE A 155 -1.758 6.952 1.081 1.00 1.00 N ATOM 1176 CA ILE A 155 -2.603 7.235 -0.067 1.00 1.00 C ATOM 1177 C ILE A 155 -3.451 8.475 0.226 1.00 1.00 C ATOM 1178 O ILE A 155 -3.579 8.888 1.378 1.00 1.00 O ATOM 1179 CB ILE A 155 -3.425 6.003 -0.446 1.00 1.00 C ATOM 1180 CG1 ILE A 155 -2.538 4.924 -1.072 1.00 1.00 C ATOM 1181 CG2 ILE A 155 -4.595 6.382 -1.356 1.00 1.00 C ATOM 1182 CD1 ILE A 155 -1.736 5.488 -2.247 1.00 1.00 C ATOM 0 H ILE A 155 -2.262 6.689 1.928 1.00 1.00 H new ATOM 0 HA ILE A 155 -1.994 7.462 -0.942 1.00 1.00 H new ATOM 0 HB ILE A 155 -3.850 5.583 0.465 1.00 1.00 H new ATOM 0 HG12 ILE A 155 -1.857 4.526 -0.320 1.00 1.00 H new ATOM 0 HG13 ILE A 155 -3.156 4.093 -1.414 1.00 1.00 H new ATOM 0 HG21 ILE A 155 -5.163 5.487 -1.610 1.00 1.00 H new ATOM 0 HG22 ILE A 155 -5.244 7.089 -0.839 1.00 1.00 H new ATOM 0 HG23 ILE A 155 -4.213 6.841 -2.268 1.00 1.00 H new ATOM 0 HD11 ILE A 155 -1.114 4.701 -2.674 1.00 1.00 H new ATOM 0 HD12 ILE A 155 -2.420 5.863 -3.008 1.00 1.00 H new ATOM 0 HD13 ILE A 155 -1.102 6.302 -1.897 1.00 1.00 H new ATOM 1193 N GLU A 156 -4.011 9.034 -0.837 1.00 1.00 N ATOM 1194 CA GLU A 156 -4.844 10.218 -0.710 1.00 1.00 C ATOM 1195 C GLU A 156 -5.601 10.478 -2.014 1.00 1.00 C ATOM 1196 O GLU A 156 -6.699 11.031 -1.999 1.00 1.00 O ATOM 1197 CB GLU A 156 -4.009 11.436 -0.308 1.00 1.00 C ATOM 1198 CG GLU A 156 -4.845 12.431 0.499 1.00 1.00 C ATOM 1199 CD GLU A 156 -4.338 13.861 0.299 1.00 1.00 C ATOM 1200 OE1 GLU A 156 -4.216 14.320 -0.846 1.00 1.00 O ATOM 1201 OE2 GLU A 156 -4.069 14.501 1.386 1.00 1.00 O ATOM 0 H GLU A 156 -3.904 8.689 -1.791 1.00 1.00 H new ATOM 0 HA GLU A 156 -5.573 10.042 0.081 1.00 1.00 H new ATOM 0 HB2 GLU A 156 -3.151 11.114 0.282 1.00 1.00 H new ATOM 0 HB3 GLU A 156 -3.618 11.924 -1.201 1.00 1.00 H new ATOM 0 HG2 GLU A 156 -5.889 12.366 0.194 1.00 1.00 H new ATOM 0 HG3 GLU A 156 -4.805 12.172 1.557 1.00 1.00 H new