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 Set 1.1: A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 123 MET CE :methyl -164:sc= 0 (180deg=-0.0265) USER MOD Single : A 81 HIS : no HE2:sc= -2.54! C(o=-2.5!,f=-4.8!) USER MOD Single : A 85 SER OG : rot -89:sc= -1.95! USER MOD Single : A 87 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot 180:sc=-0.00723 USER MOD Single : A 92 TYR OH : rot 179:sc= 0.491 USER MOD Single : A 94 THR OG1 : rot 113:sc= 0.136 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 GLN : amide:sc= -1.55 K(o=-1.5,f=-3.2!) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 ASN : amide:sc= -0.5 X(o=-0.5,f=-0.75) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 CYS SG : rot 145:sc= -1.31! USER MOD Single : A 121 MET CE :methyl -136:sc= -0.386 (180deg=-1.68!) USER MOD Single : A 124 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 125 ASN :FLIP amide:sc= 1.18 F(o=0.2,f=1.2) USER MOD Single : A 126 GLN : amide:sc= -0.0732 K(o=-0.073,f=-0.61) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 SER OG : rot 63:sc= 0.927 USER MOD Single : A 134 THR OG1 : rot -170:sc= -0.088 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 SER OG : rot 44:sc= 0.472 USER MOD Single : A 144 GLN : amide:sc= -2.64! C(o=-2.6!,f=-2.3!) USER MOD ----------------------------------------------------------------- ATOM 130 N HIS A 81 -5.177 8.060 2.965 1.00 1.00 N ATOM 131 CA HIS A 81 -5.476 6.755 3.529 1.00 1.00 C ATOM 132 C HIS A 81 -4.171 6.014 3.826 1.00 1.00 C ATOM 133 O HIS A 81 -3.573 5.417 2.932 1.00 1.00 O ATOM 134 CB HIS A 81 -6.409 5.965 2.610 1.00 1.00 C ATOM 135 CG HIS A 81 -7.160 6.819 1.616 1.00 1.00 C ATOM 136 ND1 HIS A 81 -7.568 8.112 1.896 1.00 1.00 N ATOM 137 CD2 HIS A 81 -7.570 6.554 0.343 1.00 1.00 C ATOM 138 CE1 HIS A 81 -8.197 8.592 0.833 1.00 1.00 C ATOM 139 NE2 HIS A 81 -8.197 7.625 -0.128 1.00 1.00 N ATOM 0 HA HIS A 81 -6.009 6.877 4.472 1.00 1.00 H new ATOM 0 HB2 HIS A 81 -5.824 5.223 2.067 1.00 1.00 H new ATOM 0 HB3 HIS A 81 -7.128 5.420 3.221 1.00 1.00 H new ATOM 0 HD1 HIS A 81 -7.411 8.611 2.772 1.00 1.00 H new ATOM 0 HD2 HIS A 81 -7.411 5.629 -0.192 1.00 1.00 H new ATOM 0 HE1 HIS A 81 -8.633 9.576 0.744 1.00 1.00 H new ATOM 146 N ILE A 82 -3.766 6.077 5.086 1.00 1.00 N ATOM 147 CA ILE A 82 -2.542 5.420 5.513 1.00 1.00 C ATOM 148 C ILE A 82 -2.846 3.962 5.864 1.00 1.00 C ATOM 149 O ILE A 82 -3.597 3.690 6.800 1.00 1.00 O ATOM 150 CB ILE A 82 -1.882 6.201 6.650 1.00 1.00 C ATOM 151 CG1 ILE A 82 -1.564 7.635 6.219 1.00 1.00 C ATOM 152 CG2 ILE A 82 -0.642 5.472 7.170 1.00 1.00 C ATOM 153 CD1 ILE A 82 -2.313 8.647 7.088 1.00 1.00 C ATOM 0 H ILE A 82 -4.264 6.573 5.825 1.00 1.00 H new ATOM 0 HA ILE A 82 -1.814 5.408 4.702 1.00 1.00 H new ATOM 0 HB ILE A 82 -2.590 6.262 7.477 1.00 1.00 H new ATOM 0 HG12 ILE A 82 -0.491 7.811 6.292 1.00 1.00 H new ATOM 0 HG13 ILE A 82 -1.839 7.774 5.173 1.00 1.00 H new ATOM 0 HG21 ILE A 82 -0.192 6.049 7.978 1.00 1.00 H new ATOM 0 HG22 ILE A 82 -0.928 4.488 7.543 1.00 1.00 H new ATOM 0 HG23 ILE A 82 0.079 5.358 6.361 1.00 1.00 H new ATOM 0 HD11 ILE A 82 -2.070 9.658 6.761 1.00 1.00 H new ATOM 0 HD12 ILE A 82 -3.387 8.484 6.993 1.00 1.00 H new ATOM 0 HD13 ILE A 82 -2.017 8.521 8.130 1.00 1.00 H new ATOM 164 N VAL A 83 -2.249 3.064 5.095 1.00 1.00 N ATOM 165 CA VAL A 83 -2.448 1.641 5.313 1.00 1.00 C ATOM 166 C VAL A 83 -1.422 1.138 6.331 1.00 1.00 C ATOM 167 O VAL A 83 -0.217 1.283 6.127 1.00 1.00 O ATOM 168 CB VAL A 83 -2.384 0.893 3.980 1.00 1.00 C ATOM 169 CG1 VAL A 83 -2.421 -0.620 4.198 1.00 1.00 C ATOM 170 CG2 VAL A 83 -3.510 1.341 3.046 1.00 1.00 C ATOM 0 H VAL A 83 -1.627 3.294 4.320 1.00 1.00 H new ATOM 0 HA VAL A 83 -3.438 1.453 5.728 1.00 1.00 H new ATOM 0 HB VAL A 83 -1.435 1.139 3.503 1.00 1.00 H new ATOM 0 HG11 VAL A 83 -2.374 -1.128 3.235 1.00 1.00 H new ATOM 0 HG12 VAL A 83 -1.569 -0.921 4.808 1.00 1.00 H new ATOM 0 HG13 VAL A 83 -3.346 -0.892 4.707 1.00 1.00 H new ATOM 0 HG21 VAL A 83 -3.442 0.794 2.106 1.00 1.00 H new ATOM 0 HG22 VAL A 83 -4.473 1.139 3.514 1.00 1.00 H new ATOM 0 HG23 VAL A 83 -3.418 2.410 2.852 1.00 1.00 H new ATOM 180 N ARG A 84 -1.937 0.557 7.405 1.00 1.00 N ATOM 181 CA ARG A 84 -1.080 0.032 8.454 1.00 1.00 C ATOM 182 C ARG A 84 -0.897 -1.478 8.285 1.00 1.00 C ATOM 183 O ARG A 84 -1.869 -2.206 8.088 1.00 1.00 O ATOM 184 CB ARG A 84 -1.668 0.315 9.839 1.00 1.00 C ATOM 185 CG ARG A 84 -1.872 1.817 10.050 1.00 1.00 C ATOM 186 CD ARG A 84 -2.983 2.080 11.069 1.00 1.00 C ATOM 187 NE ARG A 84 -3.396 3.501 11.011 1.00 1.00 N ATOM 188 CZ ARG A 84 -4.617 3.949 11.372 1.00 1.00 C ATOM 189 NH1 ARG A 84 -5.558 3.091 11.820 1.00 1.00 N ATOM 190 NH2 ARG A 84 -4.878 5.240 11.280 1.00 1.00 N ATOM 0 H ARG A 84 -2.936 0.438 7.571 1.00 1.00 H new ATOM 0 HA ARG A 84 -0.114 0.530 8.372 1.00 1.00 H new ATOM 0 HB2 ARG A 84 -2.620 -0.204 9.947 1.00 1.00 H new ATOM 0 HB3 ARG A 84 -1.002 -0.077 10.608 1.00 1.00 H new ATOM 0 HG2 ARG A 84 -0.942 2.269 10.395 1.00 1.00 H new ATOM 0 HG3 ARG A 84 -2.124 2.291 9.101 1.00 1.00 H new ATOM 0 HD2 ARG A 84 -3.837 1.435 10.863 1.00 1.00 H new ATOM 0 HD3 ARG A 84 -2.634 1.835 12.072 1.00 1.00 H new ATOM 0 HE ARG A 84 -2.715 4.184 10.678 1.00 1.00 H new ATOM 0 HH11 ARG A 84 -5.349 2.095 11.888 1.00 1.00 H new ATOM 0 HH12 ARG A 84 -6.478 3.439 12.091 1.00 1.00 H new ATOM 0 HH21 ARG A 84 -4.162 5.882 10.940 1.00 1.00 H new ATOM 0 HH22 ARG A 84 -5.796 5.595 11.549 1.00 1.00 H new ATOM 199 N SER A 85 0.354 -1.903 8.366 1.00 1.00 N ATOM 200 CA SER A 85 0.677 -3.312 8.225 1.00 1.00 C ATOM 201 C SER A 85 -0.392 -4.166 8.910 1.00 1.00 C ATOM 202 O SER A 85 -0.412 -4.276 10.135 1.00 1.00 O ATOM 203 CB SER A 85 2.058 -3.624 8.807 1.00 1.00 C ATOM 204 OG SER A 85 2.004 -3.858 10.211 1.00 1.00 O ATOM 0 H SER A 85 1.157 -1.296 8.528 1.00 1.00 H new ATOM 0 HA SER A 85 0.699 -3.551 7.162 1.00 1.00 H new ATOM 0 HB2 SER A 85 2.472 -4.501 8.309 1.00 1.00 H new ATOM 0 HB3 SER A 85 2.734 -2.793 8.603 1.00 1.00 H new ATOM 0 HG SER A 85 2.115 -3.009 10.689 1.00 1.00 H new ATOM 209 N PRO A 86 -1.278 -4.763 8.068 1.00 1.00 N ATOM 210 CA PRO A 86 -2.347 -5.602 8.579 1.00 1.00 C ATOM 211 C PRO A 86 -1.808 -6.961 9.033 1.00 1.00 C ATOM 212 O PRO A 86 -2.569 -7.812 9.491 1.00 1.00 O ATOM 213 CB PRO A 86 -3.344 -5.710 7.437 1.00 1.00 C ATOM 214 CG PRO A 86 -2.583 -5.317 6.182 1.00 1.00 C ATOM 215 CD PRO A 86 -1.284 -4.655 6.612 1.00 1.00 C ATOM 0 HA PRO A 86 -2.822 -5.183 9.466 1.00 1.00 H new ATOM 0 HB2 PRO A 86 -3.736 -6.724 7.355 1.00 1.00 H new ATOM 0 HB3 PRO A 86 -4.197 -5.051 7.599 1.00 1.00 H new ATOM 0 HG2 PRO A 86 -2.379 -6.195 5.569 1.00 1.00 H new ATOM 0 HG3 PRO A 86 -3.176 -4.634 5.574 1.00 1.00 H new ATOM 0 HD2 PRO A 86 -0.420 -5.156 6.174 1.00 1.00 H new ATOM 0 HD3 PRO A 86 -1.245 -3.614 6.292 1.00 1.00 H new ATOM 220 N MET A 87 -0.502 -7.121 8.888 1.00 1.00 N ATOM 221 CA MET A 87 0.148 -8.362 9.277 1.00 1.00 C ATOM 222 C MET A 87 1.645 -8.148 9.510 1.00 1.00 C ATOM 223 O MET A 87 2.327 -7.551 8.678 1.00 1.00 O ATOM 224 CB MET A 87 -0.054 -9.409 8.181 1.00 1.00 C ATOM 225 CG MET A 87 -0.747 -10.656 8.733 1.00 1.00 C ATOM 226 SD MET A 87 0.404 -11.615 9.703 1.00 1.00 S ATOM 227 CE MET A 87 -0.406 -13.205 9.664 1.00 1.00 C ATOM 0 H MET A 87 0.125 -6.412 8.507 1.00 1.00 H new ATOM 0 HA MET A 87 -0.299 -8.708 10.209 1.00 1.00 H new ATOM 0 HB2 MET A 87 -0.651 -8.985 7.374 1.00 1.00 H new ATOM 0 HB3 MET A 87 0.910 -9.684 7.754 1.00 1.00 H new ATOM 0 HG2 MET A 87 -1.600 -10.366 9.347 1.00 1.00 H new ATOM 0 HG3 MET A 87 -1.135 -11.260 7.913 1.00 1.00 H new ATOM 0 HE1 MET A 87 0.184 -13.928 10.227 1.00 1.00 H new ATOM 0 HE2 MET A 87 -1.397 -13.120 10.110 1.00 1.00 H new ATOM 0 HE3 MET A 87 -0.501 -13.540 8.631 1.00 1.00 H new ATOM 235 N VAL A 88 2.113 -8.647 10.644 1.00 1.00 N ATOM 236 CA VAL A 88 3.517 -8.519 10.996 1.00 1.00 C ATOM 237 C VAL A 88 4.350 -9.427 10.091 1.00 1.00 C ATOM 238 O VAL A 88 3.954 -10.556 9.804 1.00 1.00 O ATOM 239 CB VAL A 88 3.712 -8.815 12.485 1.00 1.00 C ATOM 240 CG1 VAL A 88 5.091 -8.353 12.959 1.00 1.00 C ATOM 241 CG2 VAL A 88 2.601 -8.176 13.321 1.00 1.00 C ATOM 0 H VAL A 88 1.545 -9.141 11.332 1.00 1.00 H new ATOM 0 HA VAL A 88 3.860 -7.497 10.834 1.00 1.00 H new ATOM 0 HB VAL A 88 3.655 -9.895 12.623 1.00 1.00 H new ATOM 0 HG11 VAL A 88 5.204 -8.575 14.020 1.00 1.00 H new ATOM 0 HG12 VAL A 88 5.864 -8.875 12.395 1.00 1.00 H new ATOM 0 HG13 VAL A 88 5.189 -7.279 12.800 1.00 1.00 H new ATOM 0 HG21 VAL A 88 2.763 -8.402 14.375 1.00 1.00 H new ATOM 0 HG22 VAL A 88 2.611 -7.096 13.175 1.00 1.00 H new ATOM 0 HG23 VAL A 88 1.636 -8.575 13.009 1.00 1.00 H new ATOM 251 N GLY A 89 5.491 -8.901 9.666 1.00 1.00 N ATOM 252 CA GLY A 89 6.383 -9.651 8.800 1.00 1.00 C ATOM 253 C GLY A 89 7.218 -8.710 7.928 1.00 1.00 C ATOM 254 O GLY A 89 8.004 -7.916 8.442 1.00 1.00 O ATOM 0 H GLY A 89 5.817 -7.965 9.906 1.00 1.00 H new ATOM 0 HA2 GLY A 89 7.042 -10.275 9.403 1.00 1.00 H new ATOM 0 HA3 GLY A 89 5.802 -10.321 8.166 1.00 1.00 H new ATOM 258 N THR A 90 7.019 -8.831 6.624 1.00 1.00 N ATOM 259 CA THR A 90 7.744 -8.003 5.675 1.00 1.00 C ATOM 260 C THR A 90 6.774 -7.342 4.694 1.00 1.00 C ATOM 261 O THR A 90 5.602 -7.712 4.630 1.00 1.00 O ATOM 262 CB THR A 90 8.798 -8.876 4.993 1.00 1.00 C ATOM 263 OG1 THR A 90 9.574 -9.391 6.072 1.00 1.00 O ATOM 264 CG2 THR A 90 9.797 -8.056 4.173 1.00 1.00 C ATOM 0 H THR A 90 6.365 -9.491 6.202 1.00 1.00 H new ATOM 0 HA THR A 90 8.257 -7.183 6.177 1.00 1.00 H new ATOM 0 HB THR A 90 8.305 -9.600 4.345 1.00 1.00 H new ATOM 0 HG1 THR A 90 10.281 -9.970 5.719 1.00 1.00 H new ATOM 0 HG21 THR A 90 10.523 -8.724 3.710 1.00 1.00 H new ATOM 0 HG22 THR A 90 9.265 -7.505 3.397 1.00 1.00 H new ATOM 0 HG23 THR A 90 10.315 -7.354 4.827 1.00 1.00 H new ATOM 272 N PHE A 91 7.297 -6.377 3.953 1.00 1.00 N ATOM 273 CA PHE A 91 6.493 -5.661 2.978 1.00 1.00 C ATOM 274 C PHE A 91 7.267 -5.454 1.675 1.00 1.00 C ATOM 275 O PHE A 91 8.451 -5.125 1.699 1.00 1.00 O ATOM 276 CB PHE A 91 6.162 -4.296 3.585 1.00 1.00 C ATOM 277 CG PHE A 91 5.495 -3.325 2.609 1.00 1.00 C ATOM 278 CD1 PHE A 91 6.210 -2.800 1.578 1.00 1.00 C ATOM 279 CD2 PHE A 91 4.188 -2.989 2.772 1.00 1.00 C ATOM 280 CE1 PHE A 91 5.591 -1.899 0.672 1.00 1.00 C ATOM 281 CE2 PHE A 91 3.568 -2.088 1.864 1.00 1.00 C ATOM 282 CZ PHE A 91 4.282 -1.562 0.834 1.00 1.00 C ATOM 0 H PHE A 91 8.269 -6.074 4.008 1.00 1.00 H new ATOM 0 HA PHE A 91 5.593 -6.231 2.747 1.00 1.00 H new ATOM 0 HB2 PHE A 91 5.505 -4.441 4.443 1.00 1.00 H new ATOM 0 HB3 PHE A 91 7.081 -3.844 3.960 1.00 1.00 H new ATOM 0 HD1 PHE A 91 7.248 -3.068 1.449 1.00 1.00 H new ATOM 0 HD2 PHE A 91 3.621 -3.406 3.591 1.00 1.00 H new ATOM 0 HE1 PHE A 91 6.159 -1.481 -0.146 1.00 1.00 H new ATOM 0 HE2 PHE A 91 2.529 -1.821 1.993 1.00 1.00 H new ATOM 0 HZ PHE A 91 3.811 -0.877 0.144 1.00 1.00 H new ATOM 291 N TYR A 92 6.564 -5.652 0.569 1.00 1.00 N ATOM 292 CA TYR A 92 7.171 -5.491 -0.742 1.00 1.00 C ATOM 293 C TYR A 92 6.318 -4.585 -1.633 1.00 1.00 C ATOM 294 O TYR A 92 5.113 -4.456 -1.420 1.00 1.00 O ATOM 295 CB TYR A 92 7.223 -6.890 -1.358 1.00 1.00 C ATOM 296 CG TYR A 92 8.277 -7.806 -0.732 1.00 1.00 C ATOM 297 CD1 TYR A 92 9.603 -7.679 -1.089 1.00 1.00 C ATOM 298 CD2 TYR A 92 7.899 -8.762 0.191 1.00 1.00 C ATOM 299 CE1 TYR A 92 10.594 -8.541 -0.500 1.00 1.00 C ATOM 300 CE2 TYR A 92 8.890 -9.624 0.780 1.00 1.00 C ATOM 301 CZ TYR A 92 10.188 -9.472 0.405 1.00 1.00 C ATOM 302 OH TYR A 92 11.125 -10.286 0.962 1.00 1.00 O ATOM 0 H TYR A 92 5.581 -5.922 0.554 1.00 1.00 H new ATOM 0 HA TYR A 92 8.158 -5.036 -0.655 1.00 1.00 H new ATOM 0 HB2 TYR A 92 6.244 -7.357 -1.256 1.00 1.00 H new ATOM 0 HB3 TYR A 92 7.423 -6.799 -2.426 1.00 1.00 H new ATOM 0 HD1 TYR A 92 9.898 -6.932 -1.811 1.00 1.00 H new ATOM 0 HD2 TYR A 92 6.861 -8.863 0.470 1.00 1.00 H new ATOM 0 HE1 TYR A 92 11.636 -8.451 -0.770 1.00 1.00 H new ATOM 0 HE2 TYR A 92 8.609 -10.375 1.504 1.00 1.00 H new ATOM 0 HH TYR A 92 10.695 -10.890 1.603 1.00 1.00 H new ATOM 311 N ARG A 93 6.977 -3.982 -2.611 1.00 1.00 N ATOM 312 CA ARG A 93 6.294 -3.092 -3.536 1.00 1.00 C ATOM 313 C ARG A 93 6.064 -3.794 -4.875 1.00 1.00 C ATOM 314 O ARG A 93 5.292 -3.317 -5.707 1.00 1.00 O ATOM 315 CB ARG A 93 7.102 -1.815 -3.769 1.00 1.00 C ATOM 316 CG ARG A 93 7.322 -1.058 -2.457 1.00 1.00 C ATOM 317 CD ARG A 93 6.138 -0.142 -2.147 1.00 1.00 C ATOM 318 NE ARG A 93 5.898 0.779 -3.281 1.00 1.00 N ATOM 319 CZ ARG A 93 4.701 1.336 -3.564 1.00 1.00 C ATOM 320 NH1 ARG A 93 3.623 1.071 -2.797 1.00 1.00 N ATOM 321 NH2 ARG A 93 4.603 2.144 -4.604 1.00 1.00 N ATOM 0 H ARG A 93 7.976 -4.092 -2.784 1.00 1.00 H new ATOM 0 HA ARG A 93 5.335 -2.825 -3.093 1.00 1.00 H new ATOM 0 HB2 ARG A 93 8.065 -2.066 -4.214 1.00 1.00 H new ATOM 0 HB3 ARG A 93 6.580 -1.174 -4.479 1.00 1.00 H new ATOM 0 HG2 ARG A 93 7.460 -1.768 -1.642 1.00 1.00 H new ATOM 0 HG3 ARG A 93 8.236 -0.467 -2.523 1.00 1.00 H new ATOM 0 HD2 ARG A 93 5.246 -0.739 -1.958 1.00 1.00 H new ATOM 0 HD3 ARG A 93 6.337 0.429 -1.240 1.00 1.00 H new ATOM 0 HE ARG A 93 6.686 1.007 -3.887 1.00 1.00 H new ATOM 0 HH11 ARG A 93 3.708 0.445 -1.996 1.00 1.00 H new ATOM 0 HH12 ARG A 93 2.723 1.496 -3.018 1.00 1.00 H new ATOM 0 HH21 ARG A 93 5.423 2.338 -5.178 1.00 1.00 H new ATOM 0 HH22 ARG A 93 3.707 2.574 -4.833 1.00 1.00 H new ATOM 330 N THR A 94 6.748 -4.916 -5.045 1.00 1.00 N ATOM 331 CA THR A 94 6.628 -5.688 -6.270 1.00 1.00 C ATOM 332 C THR A 94 6.279 -7.144 -5.951 1.00 1.00 C ATOM 333 O THR A 94 6.566 -7.629 -4.859 1.00 1.00 O ATOM 334 CB THR A 94 7.933 -5.535 -7.055 1.00 1.00 C ATOM 335 OG1 THR A 94 8.948 -5.847 -6.105 1.00 1.00 O ATOM 336 CG2 THR A 94 8.216 -4.081 -7.440 1.00 1.00 C ATOM 0 H THR A 94 7.387 -5.309 -4.354 1.00 1.00 H new ATOM 0 HA THR A 94 5.812 -5.319 -6.891 1.00 1.00 H new ATOM 0 HB THR A 94 7.890 -6.147 -7.956 1.00 1.00 H new ATOM 0 HG1 THR A 94 9.394 -6.680 -6.365 1.00 1.00 H new ATOM 0 HG21 THR A 94 9.153 -4.027 -7.995 1.00 1.00 H new ATOM 0 HG22 THR A 94 7.404 -3.705 -8.062 1.00 1.00 H new ATOM 0 HG23 THR A 94 8.293 -3.474 -6.538 1.00 1.00 H new ATOM 344 N PRO A 95 5.648 -7.815 -6.951 1.00 1.00 N ATOM 345 CA PRO A 95 5.256 -9.205 -6.788 1.00 1.00 C ATOM 346 C PRO A 95 6.470 -10.131 -6.884 1.00 1.00 C ATOM 347 O PRO A 95 6.517 -11.168 -6.224 1.00 1.00 O ATOM 348 CB PRO A 95 4.229 -9.455 -7.881 1.00 1.00 C ATOM 349 CG PRO A 95 4.425 -8.344 -8.899 1.00 1.00 C ATOM 350 CD PRO A 95 5.291 -7.271 -8.258 1.00 1.00 C ATOM 0 HA PRO A 95 4.830 -9.410 -5.806 1.00 1.00 H new ATOM 0 HB2 PRO A 95 4.375 -10.434 -8.338 1.00 1.00 H new ATOM 0 HB3 PRO A 95 3.217 -9.440 -7.477 1.00 1.00 H new ATOM 0 HG2 PRO A 95 4.901 -8.731 -9.800 1.00 1.00 H new ATOM 0 HG3 PRO A 95 3.463 -7.929 -9.201 1.00 1.00 H new ATOM 0 HD2 PRO A 95 6.178 -7.067 -8.858 1.00 1.00 H new ATOM 0 HD3 PRO A 95 4.749 -6.330 -8.161 1.00 1.00 H new ATOM 355 N SER A 96 7.420 -9.725 -7.713 1.00 1.00 N ATOM 356 CA SER A 96 8.630 -10.506 -7.905 1.00 1.00 C ATOM 357 C SER A 96 9.859 -9.601 -7.798 1.00 1.00 C ATOM 358 O SER A 96 9.731 -8.380 -7.718 1.00 1.00 O ATOM 359 CB SER A 96 8.615 -11.222 -9.256 1.00 1.00 C ATOM 360 OG SER A 96 7.332 -11.173 -9.873 1.00 1.00 O ATOM 0 H SER A 96 7.376 -8.865 -8.260 1.00 1.00 H new ATOM 0 HA SER A 96 8.675 -11.264 -7.123 1.00 1.00 H new ATOM 0 HB2 SER A 96 9.352 -10.765 -9.916 1.00 1.00 H new ATOM 0 HB3 SER A 96 8.911 -12.262 -9.118 1.00 1.00 H new ATOM 0 HG SER A 96 7.365 -11.640 -10.734 1.00 1.00 H new ATOM 365 N PRO A 97 11.053 -10.251 -7.799 1.00 1.00 N ATOM 366 CA PRO A 97 12.305 -9.518 -7.703 1.00 1.00 C ATOM 367 C PRO A 97 12.639 -8.829 -9.027 1.00 1.00 C ATOM 368 O PRO A 97 13.391 -7.856 -9.053 1.00 1.00 O ATOM 369 CB PRO A 97 13.338 -10.556 -7.296 1.00 1.00 C ATOM 370 CG PRO A 97 12.727 -11.907 -7.631 1.00 1.00 C ATOM 371 CD PRO A 97 11.244 -11.696 -7.892 1.00 1.00 C ATOM 0 HA PRO A 97 12.264 -8.709 -6.974 1.00 1.00 H new ATOM 0 HB2 PRO A 97 14.274 -10.407 -7.834 1.00 1.00 H new ATOM 0 HB3 PRO A 97 13.566 -10.484 -6.233 1.00 1.00 H new ATOM 0 HG2 PRO A 97 13.211 -12.338 -8.507 1.00 1.00 H new ATOM 0 HG3 PRO A 97 12.874 -12.607 -6.809 1.00 1.00 H new ATOM 0 HD2 PRO A 97 10.958 -12.071 -8.875 1.00 1.00 H new ATOM 0 HD3 PRO A 97 10.634 -12.224 -7.159 1.00 1.00 H new ATOM 376 N ASP A 98 12.064 -9.361 -10.096 1.00 1.00 N ATOM 377 CA ASP A 98 12.292 -8.809 -11.421 1.00 1.00 C ATOM 378 C ASP A 98 10.953 -8.396 -12.034 1.00 1.00 C ATOM 379 O ASP A 98 10.535 -8.946 -13.051 1.00 1.00 O ATOM 380 CB ASP A 98 12.935 -9.845 -12.346 1.00 1.00 C ATOM 381 CG ASP A 98 12.149 -11.147 -12.503 1.00 1.00 C ATOM 382 OD1 ASP A 98 11.342 -11.297 -13.432 1.00 1.00 O ATOM 383 OD2 ASP A 98 12.397 -12.045 -11.611 1.00 1.00 O ATOM 0 H ASP A 98 11.441 -10.168 -10.072 1.00 1.00 H new ATOM 0 HA ASP A 98 12.959 -7.953 -11.319 1.00 1.00 H new ATOM 0 HB2 ASP A 98 13.068 -9.398 -13.331 1.00 1.00 H new ATOM 0 HB3 ASP A 98 13.929 -10.082 -11.966 1.00 1.00 H new ATOM 388 N ALA A 99 10.316 -7.429 -11.388 1.00 1.00 N ATOM 389 CA ALA A 99 9.033 -6.935 -11.856 1.00 1.00 C ATOM 390 C ALA A 99 8.853 -5.485 -11.404 1.00 1.00 C ATOM 391 O ALA A 99 9.326 -5.101 -10.335 1.00 1.00 O ATOM 392 CB ALA A 99 7.917 -7.848 -11.344 1.00 1.00 C ATOM 0 H ALA A 99 10.666 -6.975 -10.544 1.00 1.00 H new ATOM 0 HA ALA A 99 8.991 -6.948 -12.945 1.00 1.00 H new ATOM 0 HB1 ALA A 99 6.954 -7.477 -11.695 1.00 1.00 H new ATOM 0 HB2 ALA A 99 8.075 -8.860 -11.718 1.00 1.00 H new ATOM 0 HB3 ALA A 99 7.926 -7.858 -10.254 1.00 1.00 H new ATOM 398 N LYS A 100 8.168 -4.718 -12.240 1.00 1.00 N ATOM 399 CA LYS A 100 7.921 -3.318 -11.940 1.00 1.00 C ATOM 400 C LYS A 100 7.093 -3.215 -10.657 1.00 1.00 C ATOM 401 O LYS A 100 6.561 -4.214 -10.176 1.00 1.00 O ATOM 402 CB LYS A 100 7.282 -2.617 -13.141 1.00 1.00 C ATOM 403 CG LYS A 100 7.890 -3.116 -14.454 1.00 1.00 C ATOM 404 CD LYS A 100 8.208 -1.949 -15.389 1.00 1.00 C ATOM 405 CE LYS A 100 7.178 -1.852 -16.516 1.00 1.00 C ATOM 406 NZ LYS A 100 6.820 -0.439 -16.771 1.00 1.00 N ATOM 0 H LYS A 100 7.776 -5.040 -13.125 1.00 1.00 H new ATOM 0 HA LYS A 100 8.860 -2.796 -11.758 1.00 1.00 H new ATOM 0 HB2 LYS A 100 6.207 -2.797 -13.142 1.00 1.00 H new ATOM 0 HB3 LYS A 100 7.425 -1.540 -13.056 1.00 1.00 H new ATOM 0 HG2 LYS A 100 8.800 -3.679 -14.247 1.00 1.00 H new ATOM 0 HG3 LYS A 100 7.197 -3.800 -14.943 1.00 1.00 H new ATOM 0 HD2 LYS A 100 8.221 -1.018 -14.823 1.00 1.00 H new ATOM 0 HD3 LYS A 100 9.204 -2.079 -15.812 1.00 1.00 H new ATOM 0 HE2 LYS A 100 7.581 -2.301 -17.424 1.00 1.00 H new ATOM 0 HE3 LYS A 100 6.285 -2.417 -16.250 1.00 1.00 H new ATOM 0 HZ1 LYS A 100 6.120 -0.391 -17.539 1.00 1.00 H new ATOM 0 HZ2 LYS A 100 6.416 -0.022 -15.908 1.00 1.00 H new ATOM 0 HZ3 LYS A 100 7.672 0.091 -17.046 1.00 1.00 H new ATOM 415 N ALA A 101 7.012 -1.998 -10.140 1.00 1.00 N ATOM 416 CA ALA A 101 6.259 -1.751 -8.922 1.00 1.00 C ATOM 417 C ALA A 101 4.764 -1.911 -9.210 1.00 1.00 C ATOM 418 O ALA A 101 4.257 -1.371 -10.192 1.00 1.00 O ATOM 419 CB ALA A 101 6.603 -0.362 -8.381 1.00 1.00 C ATOM 0 H ALA A 101 7.455 -1.172 -10.542 1.00 1.00 H new ATOM 0 HA ALA A 101 6.526 -2.475 -8.153 1.00 1.00 H new ATOM 0 HB1 ALA A 101 6.038 -0.177 -7.467 1.00 1.00 H new ATOM 0 HB2 ALA A 101 7.670 -0.310 -8.165 1.00 1.00 H new ATOM 0 HB3 ALA A 101 6.346 0.392 -9.125 1.00 1.00 H new ATOM 425 N PHE A 102 4.102 -2.655 -8.336 1.00 1.00 N ATOM 426 CA PHE A 102 2.676 -2.893 -8.486 1.00 1.00 C ATOM 427 C PHE A 102 1.953 -1.624 -8.940 1.00 1.00 C ATOM 428 O PHE A 102 1.122 -1.669 -9.845 1.00 1.00 O ATOM 429 CB PHE A 102 2.145 -3.302 -7.109 1.00 1.00 C ATOM 430 CG PHE A 102 2.015 -4.815 -6.918 1.00 1.00 C ATOM 431 CD1 PHE A 102 0.911 -5.465 -7.375 1.00 1.00 C ATOM 432 CD2 PHE A 102 3.003 -5.508 -6.291 1.00 1.00 C ATOM 433 CE1 PHE A 102 0.791 -6.869 -7.197 1.00 1.00 C ATOM 434 CE2 PHE A 102 2.882 -6.912 -6.114 1.00 1.00 C ATOM 435 CZ PHE A 102 1.779 -7.563 -6.571 1.00 1.00 C ATOM 0 H PHE A 102 4.526 -3.101 -7.522 1.00 1.00 H new ATOM 0 HA PHE A 102 2.504 -3.665 -9.236 1.00 1.00 H new ATOM 0 HB2 PHE A 102 2.809 -2.905 -6.342 1.00 1.00 H new ATOM 0 HB3 PHE A 102 1.169 -2.841 -6.955 1.00 1.00 H new ATOM 0 HD1 PHE A 102 0.127 -4.914 -7.873 1.00 1.00 H new ATOM 0 HD2 PHE A 102 3.879 -4.991 -5.928 1.00 1.00 H new ATOM 0 HE1 PHE A 102 -0.085 -7.386 -7.559 1.00 1.00 H new ATOM 0 HE2 PHE A 102 3.666 -7.463 -5.616 1.00 1.00 H new ATOM 0 HZ PHE A 102 1.688 -8.631 -6.437 1.00 1.00 H new ATOM 444 N ILE A 103 2.297 -0.520 -8.292 1.00 1.00 N ATOM 445 CA ILE A 103 1.692 0.760 -8.618 1.00 1.00 C ATOM 446 C ILE A 103 2.792 1.805 -8.815 1.00 1.00 C ATOM 447 O ILE A 103 3.933 1.591 -8.412 1.00 1.00 O ATOM 448 CB ILE A 103 0.655 1.148 -7.561 1.00 1.00 C ATOM 449 CG1 ILE A 103 -0.670 0.421 -7.800 1.00 1.00 C ATOM 450 CG2 ILE A 103 0.475 2.666 -7.503 1.00 1.00 C ATOM 451 CD1 ILE A 103 -0.884 -0.683 -6.762 1.00 1.00 C ATOM 0 H ILE A 103 2.988 -0.486 -7.542 1.00 1.00 H new ATOM 0 HA ILE A 103 1.144 0.694 -9.558 1.00 1.00 H new ATOM 0 HB ILE A 103 1.024 0.830 -6.586 1.00 1.00 H new ATOM 0 HG12 ILE A 103 -1.494 1.134 -7.754 1.00 1.00 H new ATOM 0 HG13 ILE A 103 -0.677 -0.010 -8.801 1.00 1.00 H new ATOM 0 HG21 ILE A 103 -0.267 2.916 -6.744 1.00 1.00 H new ATOM 0 HG22 ILE A 103 1.425 3.136 -7.250 1.00 1.00 H new ATOM 0 HG23 ILE A 103 0.138 3.030 -8.474 1.00 1.00 H new ATOM 0 HD11 ILE A 103 -1.833 -1.184 -6.954 1.00 1.00 H new ATOM 0 HD12 ILE A 103 -0.071 -1.407 -6.828 1.00 1.00 H new ATOM 0 HD13 ILE A 103 -0.900 -0.246 -5.764 1.00 1.00 H new ATOM 462 N GLU A 104 2.408 2.911 -9.433 1.00 1.00 N ATOM 463 CA GLU A 104 3.348 3.990 -9.688 1.00 1.00 C ATOM 464 C GLU A 104 2.833 5.297 -9.082 1.00 1.00 C ATOM 465 O GLU A 104 1.801 5.817 -9.506 1.00 1.00 O ATOM 466 CB GLU A 104 3.611 4.146 -11.187 1.00 1.00 C ATOM 467 CG GLU A 104 2.371 4.675 -11.909 1.00 1.00 C ATOM 468 CD GLU A 104 2.505 4.509 -13.424 1.00 1.00 C ATOM 469 OE1 GLU A 104 3.263 3.644 -13.888 1.00 1.00 O ATOM 470 OE2 GLU A 104 1.787 5.317 -14.128 1.00 1.00 O ATOM 0 H GLU A 104 1.459 3.084 -9.765 1.00 1.00 H new ATOM 0 HA GLU A 104 4.296 3.740 -9.211 1.00 1.00 H new ATOM 0 HB2 GLU A 104 4.446 4.828 -11.344 1.00 1.00 H new ATOM 0 HB3 GLU A 104 3.901 3.185 -11.611 1.00 1.00 H new ATOM 0 HG2 GLU A 104 1.487 4.143 -11.558 1.00 1.00 H new ATOM 0 HG3 GLU A 104 2.226 5.728 -11.666 1.00 1.00 H new ATOM 476 N VAL A 105 3.574 5.792 -8.101 1.00 1.00 N ATOM 477 CA VAL A 105 3.204 7.028 -7.434 1.00 1.00 C ATOM 478 C VAL A 105 2.686 8.027 -8.471 1.00 1.00 C ATOM 479 O VAL A 105 3.429 8.454 -9.352 1.00 1.00 O ATOM 480 CB VAL A 105 4.390 7.563 -6.630 1.00 1.00 C ATOM 481 CG1 VAL A 105 4.026 8.867 -5.917 1.00 1.00 C ATOM 482 CG2 VAL A 105 4.895 6.516 -5.634 1.00 1.00 C ATOM 0 H VAL A 105 4.429 5.359 -7.752 1.00 1.00 H new ATOM 0 HA VAL A 105 2.398 6.851 -6.722 1.00 1.00 H new ATOM 0 HB VAL A 105 5.198 7.778 -7.329 1.00 1.00 H new ATOM 0 HG11 VAL A 105 4.887 9.226 -5.353 1.00 1.00 H new ATOM 0 HG12 VAL A 105 3.737 9.616 -6.654 1.00 1.00 H new ATOM 0 HG13 VAL A 105 3.194 8.689 -5.236 1.00 1.00 H new ATOM 0 HG21 VAL A 105 5.738 6.922 -5.075 1.00 1.00 H new ATOM 0 HG22 VAL A 105 4.094 6.255 -4.943 1.00 1.00 H new ATOM 0 HG23 VAL A 105 5.213 5.624 -6.174 1.00 1.00 H new ATOM 492 N GLY A 106 1.413 8.369 -8.330 1.00 1.00 N ATOM 493 CA GLY A 106 0.787 9.310 -9.243 1.00 1.00 C ATOM 494 C GLY A 106 -0.223 8.604 -10.150 1.00 1.00 C ATOM 495 O GLY A 106 -0.505 9.070 -11.253 1.00 1.00 O ATOM 0 H GLY A 106 0.799 8.012 -7.598 1.00 1.00 H new ATOM 0 HA2 GLY A 106 0.286 10.094 -8.676 1.00 1.00 H new ATOM 0 HA3 GLY A 106 1.551 9.795 -9.851 1.00 1.00 H new ATOM 499 N GLN A 107 -0.741 7.490 -9.651 1.00 1.00 N ATOM 500 CA GLN A 107 -1.714 6.716 -10.402 1.00 1.00 C ATOM 501 C GLN A 107 -3.047 6.669 -9.654 1.00 1.00 C ATOM 502 O GLN A 107 -3.106 6.974 -8.464 1.00 1.00 O ATOM 503 CB GLN A 107 -1.192 5.305 -10.682 1.00 1.00 C ATOM 504 CG GLN A 107 -1.799 4.742 -11.969 1.00 1.00 C ATOM 505 CD GLN A 107 -2.539 3.430 -11.697 1.00 1.00 C ATOM 506 OE1 GLN A 107 -3.725 3.403 -11.417 1.00 1.00 O ATOM 507 NE2 GLN A 107 -1.773 2.347 -11.796 1.00 1.00 N ATOM 0 H GLN A 107 -0.505 7.106 -8.736 1.00 1.00 H new ATOM 0 HA GLN A 107 -1.876 7.206 -11.362 1.00 1.00 H new ATOM 0 HB2 GLN A 107 -0.105 5.325 -10.767 1.00 1.00 H new ATOM 0 HB3 GLN A 107 -1.434 4.651 -9.845 1.00 1.00 H new ATOM 0 HG2 GLN A 107 -2.487 5.469 -12.400 1.00 1.00 H new ATOM 0 HG3 GLN A 107 -1.012 4.574 -12.704 1.00 1.00 H new ATOM 0 HE21 GLN A 107 -0.786 2.441 -12.034 1.00 1.00 H new ATOM 0 HE22 GLN A 107 -2.173 1.423 -11.634 1.00 1.00 H new ATOM 514 N LYS A 108 -4.085 6.283 -10.383 1.00 1.00 N ATOM 515 CA LYS A 108 -5.414 6.193 -9.802 1.00 1.00 C ATOM 516 C LYS A 108 -5.734 4.727 -9.500 1.00 1.00 C ATOM 517 O LYS A 108 -5.845 3.912 -10.414 1.00 1.00 O ATOM 518 CB LYS A 108 -6.442 6.872 -10.709 1.00 1.00 C ATOM 519 CG LYS A 108 -6.519 8.373 -10.421 1.00 1.00 C ATOM 520 CD LYS A 108 -5.323 9.110 -11.028 1.00 1.00 C ATOM 521 CE LYS A 108 -5.764 10.406 -11.708 1.00 1.00 C ATOM 522 NZ LYS A 108 -5.981 11.471 -10.703 1.00 1.00 N ATOM 0 H LYS A 108 -4.032 6.029 -11.370 1.00 1.00 H new ATOM 0 HA LYS A 108 -5.454 6.731 -8.855 1.00 1.00 H new ATOM 0 HB2 LYS A 108 -6.174 6.712 -11.753 1.00 1.00 H new ATOM 0 HB3 LYS A 108 -7.422 6.418 -10.558 1.00 1.00 H new ATOM 0 HG2 LYS A 108 -7.445 8.778 -10.829 1.00 1.00 H new ATOM 0 HG3 LYS A 108 -6.545 8.539 -9.344 1.00 1.00 H new ATOM 0 HD2 LYS A 108 -4.596 9.334 -10.248 1.00 1.00 H new ATOM 0 HD3 LYS A 108 -4.825 8.466 -11.753 1.00 1.00 H new ATOM 0 HE2 LYS A 108 -5.007 10.723 -12.425 1.00 1.00 H new ATOM 0 HE3 LYS A 108 -6.683 10.235 -12.269 1.00 1.00 H new ATOM 0 HZ1 LYS A 108 -6.280 12.344 -11.182 1.00 1.00 H new ATOM 0 HZ2 LYS A 108 -6.720 11.172 -10.035 1.00 1.00 H new ATOM 0 HZ3 LYS A 108 -5.096 11.646 -10.186 1.00 1.00 H new ATOM 531 N VAL A 109 -5.874 4.438 -8.214 1.00 1.00 N ATOM 532 CA VAL A 109 -6.180 3.086 -7.780 1.00 1.00 C ATOM 533 C VAL A 109 -7.629 3.026 -7.295 1.00 1.00 C ATOM 534 O VAL A 109 -8.087 3.920 -6.584 1.00 1.00 O ATOM 535 CB VAL A 109 -5.175 2.638 -6.718 1.00 1.00 C ATOM 536 CG1 VAL A 109 -3.777 2.470 -7.320 1.00 1.00 C ATOM 537 CG2 VAL A 109 -5.149 3.614 -5.539 1.00 1.00 C ATOM 0 H VAL A 109 -5.781 5.118 -7.459 1.00 1.00 H new ATOM 0 HA VAL A 109 -6.087 2.388 -8.612 1.00 1.00 H new ATOM 0 HB VAL A 109 -5.498 1.667 -6.343 1.00 1.00 H new ATOM 0 HG11 VAL A 109 -3.082 2.151 -6.543 1.00 1.00 H new ATOM 0 HG12 VAL A 109 -3.809 1.719 -8.109 1.00 1.00 H new ATOM 0 HG13 VAL A 109 -3.444 3.420 -7.737 1.00 1.00 H new ATOM 0 HG21 VAL A 109 -4.426 3.271 -4.799 1.00 1.00 H new ATOM 0 HG22 VAL A 109 -4.864 4.605 -5.893 1.00 1.00 H new ATOM 0 HG23 VAL A 109 -6.139 3.662 -5.084 1.00 1.00 H new ATOM 547 N ASN A 110 -8.311 1.964 -7.696 1.00 1.00 N ATOM 548 CA ASN A 110 -9.699 1.775 -7.311 1.00 1.00 C ATOM 549 C ASN A 110 -9.879 0.367 -6.742 1.00 1.00 C ATOM 550 O ASN A 110 -9.142 -0.551 -7.099 1.00 1.00 O ATOM 551 CB ASN A 110 -10.630 1.921 -8.516 1.00 1.00 C ATOM 552 CG ASN A 110 -12.085 1.662 -8.120 1.00 1.00 C ATOM 553 OD1 ASN A 110 -12.710 2.434 -7.412 1.00 1.00 O ATOM 554 ND2 ASN A 110 -12.588 0.533 -8.614 1.00 1.00 N ATOM 0 H ASN A 110 -7.928 1.224 -8.285 1.00 1.00 H new ATOM 0 HA ASN A 110 -9.949 2.533 -6.569 1.00 1.00 H new ATOM 0 HB2 ASN A 110 -10.536 2.924 -8.933 1.00 1.00 H new ATOM 0 HB3 ASN A 110 -10.332 1.222 -9.297 1.00 1.00 H new ATOM 0 HD21 ASN A 110 -13.551 0.270 -8.406 1.00 1.00 H new ATOM 0 HD22 ASN A 110 -12.010 -0.069 -9.201 1.00 1.00 H new ATOM 560 N VAL A 111 -10.864 0.239 -5.865 1.00 1.00 N ATOM 561 CA VAL A 111 -11.151 -1.042 -5.243 1.00 1.00 C ATOM 562 C VAL A 111 -11.019 -2.152 -6.287 1.00 1.00 C ATOM 563 O VAL A 111 -11.842 -2.257 -7.195 1.00 1.00 O ATOM 564 CB VAL A 111 -12.530 -1.007 -4.580 1.00 1.00 C ATOM 565 CG1 VAL A 111 -13.062 -2.421 -4.345 1.00 1.00 C ATOM 566 CG2 VAL A 111 -12.490 -0.210 -3.274 1.00 1.00 C ATOM 0 H VAL A 111 -11.474 1.002 -5.570 1.00 1.00 H new ATOM 0 HA VAL A 111 -10.431 -1.251 -4.452 1.00 1.00 H new ATOM 0 HB VAL A 111 -13.216 -0.501 -5.260 1.00 1.00 H new ATOM 0 HG11 VAL A 111 -14.043 -2.367 -3.873 1.00 1.00 H new ATOM 0 HG12 VAL A 111 -13.147 -2.941 -5.299 1.00 1.00 H new ATOM 0 HG13 VAL A 111 -12.376 -2.964 -3.695 1.00 1.00 H new ATOM 0 HG21 VAL A 111 -13.482 -0.200 -2.823 1.00 1.00 H new ATOM 0 HG22 VAL A 111 -11.783 -0.674 -2.586 1.00 1.00 H new ATOM 0 HG23 VAL A 111 -12.176 0.813 -3.481 1.00 1.00 H new ATOM 576 N GLY A 112 -9.977 -2.955 -6.123 1.00 1.00 N ATOM 577 CA GLY A 112 -9.726 -4.053 -7.041 1.00 1.00 C ATOM 578 C GLY A 112 -8.264 -4.068 -7.492 1.00 1.00 C ATOM 579 O GLY A 112 -7.746 -5.108 -7.894 1.00 1.00 O ATOM 0 H GLY A 112 -9.297 -2.867 -5.368 1.00 1.00 H new ATOM 0 HA2 GLY A 112 -9.971 -4.999 -6.558 1.00 1.00 H new ATOM 0 HA3 GLY A 112 -10.377 -3.961 -7.910 1.00 1.00 H new ATOM 583 N ASP A 113 -7.642 -2.900 -7.412 1.00 1.00 N ATOM 584 CA ASP A 113 -6.250 -2.767 -7.808 1.00 1.00 C ATOM 585 C ASP A 113 -5.352 -3.060 -6.604 1.00 1.00 C ATOM 586 O ASP A 113 -5.628 -2.606 -5.495 1.00 1.00 O ATOM 587 CB ASP A 113 -5.949 -1.345 -8.287 1.00 1.00 C ATOM 588 CG ASP A 113 -5.837 -1.185 -9.805 1.00 1.00 C ATOM 589 OD1 ASP A 113 -6.828 -0.894 -10.491 1.00 1.00 O ATOM 590 OD2 ASP A 113 -4.656 -1.376 -10.288 1.00 1.00 O ATOM 0 H ASP A 113 -8.076 -2.039 -7.079 1.00 1.00 H new ATOM 0 HA ASP A 113 -6.060 -3.470 -8.619 1.00 1.00 H new ATOM 0 HB2 ASP A 113 -6.734 -0.681 -7.924 1.00 1.00 H new ATOM 0 HB3 ASP A 113 -5.015 -1.014 -7.832 1.00 1.00 H new ATOM 595 N THR A 114 -4.296 -3.816 -6.865 1.00 1.00 N ATOM 596 CA THR A 114 -3.356 -4.175 -5.817 1.00 1.00 C ATOM 597 C THR A 114 -2.747 -2.917 -5.193 1.00 1.00 C ATOM 598 O THR A 114 -2.991 -1.806 -5.662 1.00 1.00 O ATOM 599 CB THR A 114 -2.313 -5.118 -6.420 1.00 1.00 C ATOM 600 OG1 THR A 114 -3.078 -6.226 -6.889 1.00 1.00 O ATOM 601 CG2 THR A 114 -1.390 -5.725 -5.361 1.00 1.00 C ATOM 0 H THR A 114 -4.071 -4.190 -7.787 1.00 1.00 H new ATOM 0 HA THR A 114 -3.855 -4.697 -5.001 1.00 1.00 H new ATOM 0 HB THR A 114 -1.716 -4.577 -7.155 1.00 1.00 H new ATOM 0 HG1 THR A 114 -2.480 -6.887 -7.297 1.00 1.00 H new ATOM 0 HG21 THR A 114 -0.669 -6.386 -5.842 1.00 1.00 H new ATOM 0 HG22 THR A 114 -0.860 -4.928 -4.840 1.00 1.00 H new ATOM 0 HG23 THR A 114 -1.983 -6.294 -4.645 1.00 1.00 H new ATOM 609 N LEU A 115 -1.966 -3.134 -4.145 1.00 1.00 N ATOM 610 CA LEU A 115 -1.321 -2.032 -3.451 1.00 1.00 C ATOM 611 C LEU A 115 0.133 -2.403 -3.154 1.00 1.00 C ATOM 612 O LEU A 115 1.042 -1.610 -3.394 1.00 1.00 O ATOM 613 CB LEU A 115 -2.121 -1.638 -2.208 1.00 1.00 C ATOM 614 CG LEU A 115 -2.371 -0.141 -2.018 1.00 1.00 C ATOM 615 CD1 LEU A 115 -2.974 0.480 -3.279 1.00 1.00 C ATOM 616 CD2 LEU A 115 -3.236 0.117 -0.782 1.00 1.00 C ATOM 0 H LEU A 115 -1.765 -4.057 -3.759 1.00 1.00 H new ATOM 0 HA LEU A 115 -1.302 -1.144 -4.083 1.00 1.00 H new ATOM 0 HB2 LEU A 115 -3.085 -2.145 -2.245 1.00 1.00 H new ATOM 0 HB3 LEU A 115 -1.597 -2.013 -1.329 1.00 1.00 H new ATOM 0 HG LEU A 115 -1.411 0.346 -1.848 1.00 1.00 H new ATOM 0 HD11 LEU A 115 -3.141 1.545 -3.116 1.00 1.00 H new ATOM 0 HD12 LEU A 115 -2.288 0.344 -4.115 1.00 1.00 H new ATOM 0 HD13 LEU A 115 -3.923 -0.006 -3.506 1.00 1.00 H new ATOM 0 HD21 LEU A 115 -3.399 1.189 -0.669 1.00 1.00 H new ATOM 0 HD22 LEU A 115 -4.196 -0.386 -0.898 1.00 1.00 H new ATOM 0 HD23 LEU A 115 -2.730 -0.268 0.103 1.00 1.00 H new ATOM 627 N CYS A 116 0.308 -3.610 -2.636 1.00 1.00 N ATOM 628 CA CYS A 116 1.636 -4.096 -2.304 1.00 1.00 C ATOM 629 C CYS A 116 1.505 -5.523 -1.766 1.00 1.00 C ATOM 630 O CYS A 116 0.420 -6.103 -1.794 1.00 1.00 O ATOM 631 CB CYS A 116 2.343 -3.175 -1.307 1.00 1.00 C ATOM 632 SG CYS A 116 1.141 -2.537 -0.083 1.00 1.00 S ATOM 0 H CYS A 116 -0.448 -4.266 -2.438 1.00 1.00 H new ATOM 0 HA CYS A 116 2.258 -4.101 -3.199 1.00 1.00 H new ATOM 0 HB2 CYS A 116 3.139 -3.719 -0.798 1.00 1.00 H new ATOM 0 HB3 CYS A 116 2.812 -2.345 -1.835 1.00 1.00 H new ATOM 0 HG CYS A 116 1.723 -2.414 1.073 1.00 1.00 H new ATOM 637 N ILE A 117 2.624 -6.048 -1.291 1.00 1.00 N ATOM 638 CA ILE A 117 2.648 -7.397 -0.750 1.00 1.00 C ATOM 639 C ILE A 117 3.221 -7.361 0.668 1.00 1.00 C ATOM 640 O ILE A 117 3.878 -6.395 1.053 1.00 1.00 O ATOM 641 CB ILE A 117 3.398 -8.340 -1.693 1.00 1.00 C ATOM 642 CG1 ILE A 117 2.913 -8.173 -3.134 1.00 1.00 C ATOM 643 CG2 ILE A 117 3.292 -9.790 -1.216 1.00 1.00 C ATOM 644 CD1 ILE A 117 3.279 -9.395 -3.980 1.00 1.00 C ATOM 0 H ILE A 117 3.522 -5.564 -1.269 1.00 1.00 H new ATOM 0 HA ILE A 117 1.637 -7.797 -0.677 1.00 1.00 H new ATOM 0 HB ILE A 117 4.454 -8.072 -1.676 1.00 1.00 H new ATOM 0 HG12 ILE A 117 1.833 -8.030 -3.144 1.00 1.00 H new ATOM 0 HG13 ILE A 117 3.357 -7.278 -3.570 1.00 1.00 H new ATOM 0 HG21 ILE A 117 3.833 -10.440 -1.904 1.00 1.00 H new ATOM 0 HG22 ILE A 117 3.723 -9.877 -0.219 1.00 1.00 H new ATOM 0 HG23 ILE A 117 2.244 -10.087 -1.185 1.00 1.00 H new ATOM 0 HD11 ILE A 117 2.923 -9.251 -5.000 1.00 1.00 H new ATOM 0 HD12 ILE A 117 4.362 -9.521 -3.988 1.00 1.00 H new ATOM 0 HD13 ILE A 117 2.813 -10.284 -3.555 1.00 1.00 H new ATOM 655 N VAL A 118 2.952 -8.428 1.408 1.00 1.00 N ATOM 656 CA VAL A 118 3.432 -8.530 2.775 1.00 1.00 C ATOM 657 C VAL A 118 3.794 -9.986 3.076 1.00 1.00 C ATOM 658 O VAL A 118 2.965 -10.881 2.914 1.00 1.00 O ATOM 659 CB VAL A 118 2.390 -7.962 3.740 1.00 1.00 C ATOM 660 CG1 VAL A 118 2.709 -8.352 5.185 1.00 1.00 C ATOM 661 CG2 VAL A 118 2.279 -6.442 3.595 1.00 1.00 C ATOM 0 H VAL A 118 2.408 -9.228 1.086 1.00 1.00 H new ATOM 0 HA VAL A 118 4.336 -7.935 2.907 1.00 1.00 H new ATOM 0 HB VAL A 118 1.424 -8.395 3.482 1.00 1.00 H new ATOM 0 HG11 VAL A 118 1.952 -7.935 5.850 1.00 1.00 H new ATOM 0 HG12 VAL A 118 2.713 -9.438 5.276 1.00 1.00 H new ATOM 0 HG13 VAL A 118 3.689 -7.961 5.460 1.00 1.00 H new ATOM 0 HG21 VAL A 118 1.531 -6.064 4.292 1.00 1.00 H new ATOM 0 HG22 VAL A 118 3.244 -5.984 3.814 1.00 1.00 H new ATOM 0 HG23 VAL A 118 1.983 -6.194 2.576 1.00 1.00 H new ATOM 671 N GLU A 119 5.031 -10.178 3.507 1.00 1.00 N ATOM 672 CA GLU A 119 5.513 -11.510 3.831 1.00 1.00 C ATOM 673 C GLU A 119 5.071 -11.905 5.242 1.00 1.00 C ATOM 674 O GLU A 119 5.309 -11.171 6.199 1.00 1.00 O ATOM 675 CB GLU A 119 7.034 -11.593 3.691 1.00 1.00 C ATOM 676 CG GLU A 119 7.459 -12.947 3.118 1.00 1.00 C ATOM 677 CD GLU A 119 8.834 -12.855 2.454 1.00 1.00 C ATOM 678 OE1 GLU A 119 9.681 -12.060 2.890 1.00 1.00 O ATOM 679 OE2 GLU A 119 9.008 -13.646 1.451 1.00 1.00 O ATOM 0 H GLU A 119 5.715 -9.433 3.640 1.00 1.00 H new ATOM 0 HA GLU A 119 5.077 -12.215 3.123 1.00 1.00 H new ATOM 0 HB2 GLU A 119 7.387 -10.792 3.041 1.00 1.00 H new ATOM 0 HB3 GLU A 119 7.501 -11.443 4.664 1.00 1.00 H new ATOM 0 HG2 GLU A 119 7.485 -13.691 3.914 1.00 1.00 H new ATOM 0 HG3 GLU A 119 6.722 -13.285 2.390 1.00 1.00 H new ATOM 685 N ALA A 120 4.434 -13.065 5.325 1.00 1.00 N ATOM 686 CA ALA A 120 3.957 -13.567 6.603 1.00 1.00 C ATOM 687 C ALA A 120 3.422 -14.988 6.419 1.00 1.00 C ATOM 688 O ALA A 120 3.285 -15.464 5.293 1.00 1.00 O ATOM 689 CB ALA A 120 2.900 -12.613 7.162 1.00 1.00 C ATOM 0 H ALA A 120 4.237 -13.671 4.528 1.00 1.00 H new ATOM 0 HA ALA A 120 4.771 -13.613 7.327 1.00 1.00 H new ATOM 0 HB1 ALA A 120 2.541 -12.988 8.120 1.00 1.00 H new ATOM 0 HB2 ALA A 120 3.339 -11.625 7.300 1.00 1.00 H new ATOM 0 HB3 ALA A 120 2.066 -12.545 6.464 1.00 1.00 H new ATOM 695 N MET A 121 3.133 -15.627 7.544 1.00 1.00 N ATOM 696 CA MET A 121 2.615 -16.985 7.521 1.00 1.00 C ATOM 697 C MET A 121 3.363 -17.838 6.495 1.00 1.00 C ATOM 698 O MET A 121 2.744 -18.564 5.717 1.00 1.00 O ATOM 699 CB MET A 121 1.126 -16.958 7.176 1.00 1.00 C ATOM 700 CG MET A 121 0.896 -16.358 5.787 1.00 1.00 C ATOM 701 SD MET A 121 -0.799 -16.612 5.285 1.00 1.00 S ATOM 702 CE MET A 121 -0.842 -18.396 5.232 1.00 1.00 C ATOM 0 H MET A 121 3.248 -15.230 8.476 1.00 1.00 H new ATOM 0 HA MET A 121 2.759 -17.426 8.507 1.00 1.00 H new ATOM 0 HB2 MET A 121 0.723 -17.970 7.210 1.00 1.00 H new ATOM 0 HB3 MET A 121 0.587 -16.374 7.922 1.00 1.00 H new ATOM 0 HG2 MET A 121 1.124 -15.292 5.800 1.00 1.00 H new ATOM 0 HG3 MET A 121 1.571 -16.820 5.066 1.00 1.00 H new ATOM 0 HE1 MET A 121 -1.359 -18.721 4.329 1.00 1.00 H new ATOM 0 HE2 MET A 121 0.176 -18.784 5.226 1.00 1.00 H new ATOM 0 HE3 MET A 121 -1.369 -18.773 6.108 1.00 1.00 H new ATOM 710 N LYS A 122 4.682 -17.726 6.526 1.00 1.00 N ATOM 711 CA LYS A 122 5.520 -18.479 5.609 1.00 1.00 C ATOM 712 C LYS A 122 4.875 -18.482 4.221 1.00 1.00 C ATOM 713 O LYS A 122 4.694 -19.540 3.619 1.00 1.00 O ATOM 714 CB LYS A 122 5.797 -19.878 6.161 1.00 1.00 C ATOM 715 CG LYS A 122 4.499 -20.672 6.318 1.00 1.00 C ATOM 716 CD LYS A 122 4.780 -22.091 6.819 1.00 1.00 C ATOM 717 CE LYS A 122 5.103 -23.029 5.654 1.00 1.00 C ATOM 718 NZ LYS A 122 3.863 -23.626 5.111 1.00 1.00 N ATOM 0 H LYS A 122 5.192 -17.124 7.173 1.00 1.00 H new ATOM 0 HA LYS A 122 6.495 -18.003 5.507 1.00 1.00 H new ATOM 0 HB2 LYS A 122 6.474 -20.409 5.492 1.00 1.00 H new ATOM 0 HB3 LYS A 122 6.299 -19.800 7.126 1.00 1.00 H new ATOM 0 HG2 LYS A 122 3.838 -20.160 7.017 1.00 1.00 H new ATOM 0 HG3 LYS A 122 3.978 -20.717 5.362 1.00 1.00 H new ATOM 0 HD2 LYS A 122 5.615 -22.075 7.520 1.00 1.00 H new ATOM 0 HD3 LYS A 122 3.914 -22.467 7.364 1.00 1.00 H new ATOM 0 HE2 LYS A 122 5.623 -22.479 4.870 1.00 1.00 H new ATOM 0 HE3 LYS A 122 5.776 -23.817 5.990 1.00 1.00 H new ATOM 0 HZ1 LYS A 122 4.100 -24.260 4.321 1.00 1.00 H new ATOM 0 HZ2 LYS A 122 3.383 -24.168 5.858 1.00 1.00 H new ATOM 0 HZ3 LYS A 122 3.234 -22.871 4.772 1.00 1.00 H new ATOM 727 N MET A 123 4.544 -17.287 3.756 1.00 1.00 N ATOM 728 CA MET A 123 3.923 -17.139 2.450 1.00 1.00 C ATOM 729 C MET A 123 3.728 -15.662 2.100 1.00 1.00 C ATOM 730 O MET A 123 3.745 -14.804 2.982 1.00 1.00 O ATOM 731 CB MET A 123 2.567 -17.848 2.447 1.00 1.00 C ATOM 732 CG MET A 123 2.619 -19.124 1.604 1.00 1.00 C ATOM 733 SD MET A 123 1.809 -20.460 2.469 1.00 1.00 S ATOM 734 CE MET A 123 2.898 -21.809 2.046 1.00 1.00 C ATOM 0 H MET A 123 4.694 -16.412 4.259 1.00 1.00 H new ATOM 0 HA MET A 123 4.579 -17.586 1.703 1.00 1.00 H new ATOM 0 HB2 MET A 123 2.279 -18.094 3.469 1.00 1.00 H new ATOM 0 HB3 MET A 123 1.803 -17.178 2.053 1.00 1.00 H new ATOM 0 HG2 MET A 123 2.134 -18.955 0.643 1.00 1.00 H new ATOM 0 HG3 MET A 123 3.655 -19.390 1.395 1.00 1.00 H new ATOM 0 HE1 MET A 123 2.402 -22.757 2.257 1.00 1.00 H new ATOM 0 HE2 MET A 123 3.146 -21.757 0.986 1.00 1.00 H new ATOM 0 HE3 MET A 123 3.811 -21.738 2.636 1.00 1.00 H new ATOM 742 N MET A 124 3.546 -15.411 0.812 1.00 1.00 N ATOM 743 CA MET A 124 3.347 -14.053 0.336 1.00 1.00 C ATOM 744 C MET A 124 1.862 -13.687 0.326 1.00 1.00 C ATOM 745 O MET A 124 1.042 -14.413 -0.236 1.00 1.00 O ATOM 746 CB MET A 124 3.914 -13.921 -1.079 1.00 1.00 C ATOM 747 CG MET A 124 5.234 -13.147 -1.071 1.00 1.00 C ATOM 748 SD MET A 124 6.277 -13.703 -2.409 1.00 1.00 S ATOM 749 CE MET A 124 6.846 -12.130 -3.032 1.00 1.00 C ATOM 0 H MET A 124 3.532 -16.125 0.084 1.00 1.00 H new ATOM 0 HA MET A 124 3.865 -13.372 1.011 1.00 1.00 H new ATOM 0 HB2 MET A 124 4.072 -14.912 -1.505 1.00 1.00 H new ATOM 0 HB3 MET A 124 3.193 -13.411 -1.717 1.00 1.00 H new ATOM 0 HG2 MET A 124 5.039 -12.079 -1.171 1.00 1.00 H new ATOM 0 HG3 MET A 124 5.743 -13.291 -0.118 1.00 1.00 H new ATOM 0 HE1 MET A 124 7.514 -12.294 -3.878 1.00 1.00 H new ATOM 0 HE2 MET A 124 5.991 -11.536 -3.354 1.00 1.00 H new ATOM 0 HE3 MET A 124 7.381 -11.599 -2.245 1.00 1.00 H new ATOM 757 N ASN A 125 1.559 -12.561 0.955 1.00 1.00 N ATOM 758 CA ASN A 125 0.186 -12.089 1.026 1.00 1.00 C ATOM 759 C ASN A 125 0.068 -10.761 0.275 1.00 1.00 C ATOM 760 O ASN A 125 0.796 -9.813 0.567 1.00 1.00 O ATOM 761 CB ASN A 125 -0.240 -11.852 2.476 1.00 1.00 C ATOM 762 CG ASN A 125 0.082 -13.068 3.348 1.00 1.00 C ATOM 763 OD1 ASN A 125 1.217 -12.958 4.031 1.00 1.00 O flip ATOM 764 ND2 ASN A 125 -0.653 -14.041 3.397 1.00 1.00 N flip ATOM 0 H ASN A 125 2.241 -11.962 1.420 1.00 1.00 H new ATOM 0 HA ASN A 125 -0.456 -12.850 0.581 1.00 1.00 H new ATOM 0 HB2 ASN A 125 0.270 -10.973 2.869 1.00 1.00 H new ATOM 0 HB3 ASN A 125 -1.309 -11.645 2.515 1.00 1.00 H new ATOM 0 HD21 ASN A 125 -1.511 -14.060 2.846 1.00 1.00 H new ATOM 0 HD22 ASN A 125 -0.409 -14.835 3.989 1.00 1.00 H new ATOM 770 N GLN A 126 -0.854 -10.735 -0.676 1.00 1.00 N ATOM 771 CA GLN A 126 -1.077 -9.539 -1.470 1.00 1.00 C ATOM 772 C GLN A 126 -2.103 -8.632 -0.788 1.00 1.00 C ATOM 773 O GLN A 126 -3.037 -9.116 -0.151 1.00 1.00 O ATOM 774 CB GLN A 126 -1.520 -9.898 -2.890 1.00 1.00 C ATOM 775 CG GLN A 126 -0.319 -10.273 -3.761 1.00 1.00 C ATOM 776 CD GLN A 126 -0.633 -11.490 -4.633 1.00 1.00 C ATOM 777 OE1 GLN A 126 -1.769 -11.753 -4.990 1.00 1.00 O ATOM 778 NE2 GLN A 126 0.435 -12.215 -4.953 1.00 1.00 N ATOM 0 H GLN A 126 -1.455 -11.523 -0.915 1.00 1.00 H new ATOM 0 HA GLN A 126 -0.135 -8.996 -1.545 1.00 1.00 H new ATOM 0 HB2 GLN A 126 -2.223 -10.730 -2.856 1.00 1.00 H new ATOM 0 HB3 GLN A 126 -2.047 -9.054 -3.335 1.00 1.00 H new ATOM 0 HG2 GLN A 126 -0.046 -9.428 -4.394 1.00 1.00 H new ATOM 0 HG3 GLN A 126 0.542 -10.487 -3.127 1.00 1.00 H new ATOM 0 HE21 GLN A 126 1.358 -11.937 -4.620 1.00 1.00 H new ATOM 0 HE22 GLN A 126 0.331 -13.049 -5.532 1.00 1.00 H new ATOM 785 N ILE A 127 -1.895 -7.333 -0.945 1.00 1.00 N ATOM 786 CA ILE A 127 -2.790 -6.355 -0.352 1.00 1.00 C ATOM 787 C ILE A 127 -3.505 -5.584 -1.464 1.00 1.00 C ATOM 788 O ILE A 127 -2.867 -4.873 -2.240 1.00 1.00 O ATOM 789 CB ILE A 127 -2.032 -5.458 0.628 1.00 1.00 C ATOM 790 CG1 ILE A 127 -1.196 -6.294 1.601 1.00 1.00 C ATOM 791 CG2 ILE A 127 -2.986 -4.512 1.358 1.00 1.00 C ATOM 792 CD1 ILE A 127 -0.811 -5.474 2.835 1.00 1.00 C ATOM 0 H ILE A 127 -1.119 -6.935 -1.475 1.00 1.00 H new ATOM 0 HA ILE A 127 -3.560 -6.853 0.238 1.00 1.00 H new ATOM 0 HB ILE A 127 -1.340 -4.838 0.058 1.00 1.00 H new ATOM 0 HG12 ILE A 127 -1.760 -7.175 1.907 1.00 1.00 H new ATOM 0 HG13 ILE A 127 -0.295 -6.650 1.100 1.00 1.00 H new ATOM 0 HG21 ILE A 127 -2.420 -3.886 2.048 1.00 1.00 H new ATOM 0 HG22 ILE A 127 -3.498 -3.881 0.632 1.00 1.00 H new ATOM 0 HG23 ILE A 127 -3.720 -5.094 1.915 1.00 1.00 H new ATOM 0 HD11 ILE A 127 -0.218 -6.090 3.511 1.00 1.00 H new ATOM 0 HD12 ILE A 127 -0.227 -4.607 2.528 1.00 1.00 H new ATOM 0 HD13 ILE A 127 -1.714 -5.141 3.347 1.00 1.00 H new ATOM 803 N GLU A 128 -4.818 -5.752 -1.507 1.00 1.00 N ATOM 804 CA GLU A 128 -5.626 -5.081 -2.512 1.00 1.00 C ATOM 805 C GLU A 128 -6.200 -3.779 -1.948 1.00 1.00 C ATOM 806 O GLU A 128 -6.636 -3.735 -0.799 1.00 1.00 O ATOM 807 CB GLU A 128 -6.741 -5.996 -3.021 1.00 1.00 C ATOM 808 CG GLU A 128 -7.051 -5.717 -4.493 1.00 1.00 C ATOM 809 CD GLU A 128 -6.709 -6.926 -5.364 1.00 1.00 C ATOM 810 OE1 GLU A 128 -6.734 -8.067 -4.879 1.00 1.00 O ATOM 811 OE2 GLU A 128 -6.409 -6.649 -6.589 1.00 1.00 O ATOM 0 H GLU A 128 -5.343 -6.343 -0.862 1.00 1.00 H new ATOM 0 HA GLU A 128 -4.986 -4.837 -3.360 1.00 1.00 H new ATOM 0 HB2 GLU A 128 -6.445 -7.038 -2.899 1.00 1.00 H new ATOM 0 HB3 GLU A 128 -7.640 -5.848 -2.422 1.00 1.00 H new ATOM 0 HG2 GLU A 128 -8.107 -5.470 -4.605 1.00 1.00 H new ATOM 0 HG3 GLU A 128 -6.483 -4.850 -4.830 1.00 1.00 H new ATOM 817 N ALA A 129 -6.182 -2.751 -2.784 1.00 1.00 N ATOM 818 CA ALA A 129 -6.695 -1.452 -2.383 1.00 1.00 C ATOM 819 C ALA A 129 -8.019 -1.638 -1.639 1.00 1.00 C ATOM 820 O ALA A 129 -8.891 -2.378 -2.093 1.00 1.00 O ATOM 821 CB ALA A 129 -6.841 -0.559 -3.616 1.00 1.00 C ATOM 0 H ALA A 129 -5.820 -2.791 -3.737 1.00 1.00 H new ATOM 0 HA ALA A 129 -6.001 -0.959 -1.702 1.00 1.00 H new ATOM 0 HB1 ALA A 129 -7.226 0.416 -3.316 1.00 1.00 H new ATOM 0 HB2 ALA A 129 -5.868 -0.434 -4.092 1.00 1.00 H new ATOM 0 HB3 ALA A 129 -7.533 -1.021 -4.320 1.00 1.00 H new ATOM 827 N ASP A 130 -8.127 -0.956 -0.509 1.00 1.00 N ATOM 828 CA ASP A 130 -9.329 -1.038 0.303 1.00 1.00 C ATOM 829 C ASP A 130 -10.039 0.318 0.292 1.00 1.00 C ATOM 830 O ASP A 130 -10.921 0.567 1.114 1.00 1.00 O ATOM 831 CB ASP A 130 -8.992 -1.384 1.754 1.00 1.00 C ATOM 832 CG ASP A 130 -8.001 -0.435 2.432 1.00 1.00 C ATOM 833 OD1 ASP A 130 -8.394 0.581 3.026 1.00 1.00 O ATOM 834 OD2 ASP A 130 -6.762 -0.779 2.331 1.00 1.00 O ATOM 0 H ASP A 130 -7.401 -0.344 -0.136 1.00 1.00 H new ATOM 0 HA ASP A 130 -9.965 -1.818 -0.114 1.00 1.00 H new ATOM 0 HB2 ASP A 130 -9.915 -1.395 2.333 1.00 1.00 H new ATOM 0 HB3 ASP A 130 -8.584 -2.394 1.785 1.00 1.00 H new ATOM 839 N LYS A 131 -9.629 1.158 -0.646 1.00 1.00 N ATOM 840 CA LYS A 131 -10.214 2.481 -0.774 1.00 1.00 C ATOM 841 C LYS A 131 -9.469 3.262 -1.858 1.00 1.00 C ATOM 842 O LYS A 131 -8.342 3.706 -1.645 1.00 1.00 O ATOM 843 CB LYS A 131 -10.242 3.189 0.583 1.00 1.00 C ATOM 844 CG LYS A 131 -11.650 3.691 0.910 1.00 1.00 C ATOM 845 CD LYS A 131 -11.607 5.108 1.484 1.00 1.00 C ATOM 846 CE LYS A 131 -13.014 5.698 1.596 1.00 1.00 C ATOM 847 NZ LYS A 131 -13.307 6.078 2.996 1.00 1.00 N ATOM 0 H LYS A 131 -8.898 0.948 -1.325 1.00 1.00 H new ATOM 0 HA LYS A 131 -11.254 2.407 -1.091 1.00 1.00 H new ATOM 0 HB2 LYS A 131 -9.906 2.504 1.362 1.00 1.00 H new ATOM 0 HB3 LYS A 131 -9.546 4.028 0.574 1.00 1.00 H new ATOM 0 HG2 LYS A 131 -12.263 3.678 0.009 1.00 1.00 H new ATOM 0 HG3 LYS A 131 -12.122 3.019 1.626 1.00 1.00 H new ATOM 0 HD2 LYS A 131 -11.137 5.092 2.467 1.00 1.00 H new ATOM 0 HD3 LYS A 131 -10.992 5.744 0.847 1.00 1.00 H new ATOM 0 HE2 LYS A 131 -13.101 6.572 0.950 1.00 1.00 H new ATOM 0 HE3 LYS A 131 -13.748 4.971 1.249 1.00 1.00 H new ATOM 0 HZ1 LYS A 131 -14.266 6.477 3.054 1.00 1.00 H new ATOM 0 HZ2 LYS A 131 -13.244 5.237 3.604 1.00 1.00 H new ATOM 0 HZ3 LYS A 131 -12.617 6.788 3.315 1.00 1.00 H new ATOM 856 N SER A 132 -10.128 3.406 -2.999 1.00 1.00 N ATOM 857 CA SER A 132 -9.542 4.125 -4.116 1.00 1.00 C ATOM 858 C SER A 132 -8.779 5.350 -3.608 1.00 1.00 C ATOM 859 O SER A 132 -9.081 5.874 -2.537 1.00 1.00 O ATOM 860 CB SER A 132 -10.614 4.548 -5.122 1.00 1.00 C ATOM 861 OG SER A 132 -10.059 5.243 -6.235 1.00 1.00 O ATOM 0 H SER A 132 -11.063 3.036 -3.173 1.00 1.00 H new ATOM 0 HA SER A 132 -8.847 3.457 -4.625 1.00 1.00 H new ATOM 0 HB2 SER A 132 -11.147 3.666 -5.475 1.00 1.00 H new ATOM 0 HB3 SER A 132 -11.346 5.185 -4.625 1.00 1.00 H new ATOM 0 HG SER A 132 -9.448 4.649 -6.720 1.00 1.00 H new ATOM 866 N GLY A 133 -7.804 5.770 -4.401 1.00 1.00 N ATOM 867 CA GLY A 133 -6.995 6.924 -4.046 1.00 1.00 C ATOM 868 C GLY A 133 -5.985 7.246 -5.149 1.00 1.00 C ATOM 869 O GLY A 133 -6.024 6.652 -6.225 1.00 1.00 O ATOM 0 H GLY A 133 -7.556 5.332 -5.288 1.00 1.00 H new ATOM 0 HA2 GLY A 133 -7.640 7.786 -3.876 1.00 1.00 H new ATOM 0 HA3 GLY A 133 -6.469 6.730 -3.111 1.00 1.00 H new ATOM 873 N THR A 134 -5.104 8.187 -4.843 1.00 1.00 N ATOM 874 CA THR A 134 -4.084 8.595 -5.795 1.00 1.00 C ATOM 875 C THR A 134 -2.720 8.685 -5.110 1.00 1.00 C ATOM 876 O THR A 134 -2.065 9.725 -5.155 1.00 1.00 O ATOM 877 CB THR A 134 -4.533 9.914 -6.431 1.00 1.00 C ATOM 878 OG1 THR A 134 -5.149 10.624 -5.360 1.00 1.00 O ATOM 879 CG2 THR A 134 -5.660 9.720 -7.447 1.00 1.00 C ATOM 0 H THR A 134 -5.075 8.679 -3.950 1.00 1.00 H new ATOM 0 HA THR A 134 -3.965 7.857 -6.589 1.00 1.00 H new ATOM 0 HB THR A 134 -3.682 10.390 -6.919 1.00 1.00 H new ATOM 0 HG1 THR A 134 -5.606 11.416 -5.713 1.00 1.00 H new ATOM 0 HG21 THR A 134 -5.941 10.686 -7.868 1.00 1.00 H new ATOM 0 HG22 THR A 134 -5.320 9.061 -8.246 1.00 1.00 H new ATOM 0 HG23 THR A 134 -6.523 9.275 -6.952 1.00 1.00 H new ATOM 887 N VAL A 135 -2.331 7.580 -4.490 1.00 1.00 N ATOM 888 CA VAL A 135 -1.056 7.520 -3.797 1.00 1.00 C ATOM 889 C VAL A 135 -0.934 8.722 -2.858 1.00 1.00 C ATOM 890 O VAL A 135 -1.832 9.559 -2.796 1.00 1.00 O ATOM 891 CB VAL A 135 0.088 7.434 -4.810 1.00 1.00 C ATOM 892 CG1 VAL A 135 0.336 8.791 -5.473 1.00 1.00 C ATOM 893 CG2 VAL A 135 1.364 6.904 -4.153 1.00 1.00 C ATOM 0 H VAL A 135 -2.877 6.719 -4.454 1.00 1.00 H new ATOM 0 HA VAL A 135 -0.997 6.621 -3.184 1.00 1.00 H new ATOM 0 HB VAL A 135 -0.206 6.729 -5.588 1.00 1.00 H new ATOM 0 HG11 VAL A 135 1.154 8.702 -6.188 1.00 1.00 H new ATOM 0 HG12 VAL A 135 -0.567 9.113 -5.992 1.00 1.00 H new ATOM 0 HG13 VAL A 135 0.598 9.526 -4.711 1.00 1.00 H new ATOM 0 HG21 VAL A 135 2.161 6.853 -4.895 1.00 1.00 H new ATOM 0 HG22 VAL A 135 1.662 7.573 -3.346 1.00 1.00 H new ATOM 0 HG23 VAL A 135 1.179 5.908 -3.750 1.00 1.00 H new ATOM 903 N LYS A 136 0.185 8.769 -2.151 1.00 1.00 N ATOM 904 CA LYS A 136 0.437 9.855 -1.218 1.00 1.00 C ATOM 905 C LYS A 136 1.925 9.885 -0.866 1.00 1.00 C ATOM 906 O LYS A 136 2.558 10.938 -0.919 1.00 1.00 O ATOM 907 CB LYS A 136 -0.482 9.738 0.000 1.00 1.00 C ATOM 908 CG LYS A 136 -1.233 11.047 0.248 1.00 1.00 C ATOM 909 CD LYS A 136 -0.519 11.898 1.300 1.00 1.00 C ATOM 910 CE LYS A 136 -0.568 13.382 0.932 1.00 1.00 C ATOM 911 NZ LYS A 136 -1.304 14.148 1.961 1.00 1.00 N ATOM 0 H LYS A 136 0.928 8.072 -2.205 1.00 1.00 H new ATOM 0 HA LYS A 136 0.199 10.815 -1.677 1.00 1.00 H new ATOM 0 HB2 LYS A 136 -1.196 8.929 -0.155 1.00 1.00 H new ATOM 0 HB3 LYS A 136 0.106 9.480 0.880 1.00 1.00 H new ATOM 0 HG2 LYS A 136 -1.313 11.606 -0.684 1.00 1.00 H new ATOM 0 HG3 LYS A 136 -2.249 10.831 0.579 1.00 1.00 H new ATOM 0 HD2 LYS A 136 -0.985 11.746 2.273 1.00 1.00 H new ATOM 0 HD3 LYS A 136 0.519 11.576 1.390 1.00 1.00 H new ATOM 0 HE2 LYS A 136 0.445 13.772 0.835 1.00 1.00 H new ATOM 0 HE3 LYS A 136 -1.051 13.506 -0.037 1.00 1.00 H new ATOM 0 HZ1 LYS A 136 -1.327 15.153 1.695 1.00 1.00 H new ATOM 0 HZ2 LYS A 136 -2.276 13.786 2.034 1.00 1.00 H new ATOM 0 HZ3 LYS A 136 -0.826 14.044 2.879 1.00 1.00 H new ATOM 920 N ALA A 137 2.441 8.716 -0.513 1.00 1.00 N ATOM 921 CA ALA A 137 3.843 8.596 -0.151 1.00 1.00 C ATOM 922 C ALA A 137 4.078 7.238 0.515 1.00 1.00 C ATOM 923 O ALA A 137 3.321 6.836 1.398 1.00 1.00 O ATOM 924 CB ALA A 137 4.240 9.765 0.751 1.00 1.00 C ATOM 0 H ALA A 137 1.913 7.844 -0.470 1.00 1.00 H new ATOM 0 HA ALA A 137 4.474 8.642 -1.039 1.00 1.00 H new ATOM 0 HB1 ALA A 137 5.292 9.674 1.022 1.00 1.00 H new ATOM 0 HB2 ALA A 137 4.082 10.704 0.221 1.00 1.00 H new ATOM 0 HB3 ALA A 137 3.630 9.751 1.654 1.00 1.00 H new ATOM 930 N ILE A 138 5.130 6.568 0.067 1.00 1.00 N ATOM 931 CA ILE A 138 5.474 5.265 0.608 1.00 1.00 C ATOM 932 C ILE A 138 6.561 5.431 1.672 1.00 1.00 C ATOM 933 O ILE A 138 7.549 6.129 1.451 1.00 1.00 O ATOM 934 CB ILE A 138 5.856 4.302 -0.517 1.00 1.00 C ATOM 935 CG1 ILE A 138 5.123 4.653 -1.812 1.00 1.00 C ATOM 936 CG2 ILE A 138 5.616 2.849 -0.099 1.00 1.00 C ATOM 937 CD1 ILE A 138 6.008 5.498 -2.731 1.00 1.00 C ATOM 0 H ILE A 138 5.756 6.904 -0.665 1.00 1.00 H new ATOM 0 HA ILE A 138 4.611 4.816 1.100 1.00 1.00 H new ATOM 0 HB ILE A 138 6.923 4.410 -0.712 1.00 1.00 H new ATOM 0 HG12 ILE A 138 4.827 3.738 -2.326 1.00 1.00 H new ATOM 0 HG13 ILE A 138 4.208 5.198 -1.580 1.00 1.00 H new ATOM 0 HG21 ILE A 138 5.895 2.184 -0.916 1.00 1.00 H new ATOM 0 HG22 ILE A 138 6.220 2.618 0.779 1.00 1.00 H new ATOM 0 HG23 ILE A 138 4.562 2.708 0.139 1.00 1.00 H new ATOM 0 HD11 ILE A 138 5.463 5.734 -3.645 1.00 1.00 H new ATOM 0 HD12 ILE A 138 6.282 6.423 -2.223 1.00 1.00 H new ATOM 0 HD13 ILE A 138 6.911 4.940 -2.981 1.00 1.00 H new ATOM 948 N LEU A 139 6.344 4.776 2.803 1.00 1.00 N ATOM 949 CA LEU A 139 7.293 4.842 3.901 1.00 1.00 C ATOM 950 C LEU A 139 8.055 3.517 3.991 1.00 1.00 C ATOM 951 O LEU A 139 9.272 3.509 4.165 1.00 1.00 O ATOM 952 CB LEU A 139 6.583 5.233 5.199 1.00 1.00 C ATOM 953 CG LEU A 139 5.167 5.792 5.047 1.00 1.00 C ATOM 954 CD1 LEU A 139 4.490 5.944 6.411 1.00 1.00 C ATOM 955 CD2 LEU A 139 5.177 7.105 4.262 1.00 1.00 C ATOM 0 H LEU A 139 5.524 4.197 2.983 1.00 1.00 H new ATOM 0 HA LEU A 139 8.032 5.623 3.721 1.00 1.00 H new ATOM 0 HB2 LEU A 139 6.538 4.355 5.844 1.00 1.00 H new ATOM 0 HB3 LEU A 139 7.192 5.976 5.713 1.00 1.00 H new ATOM 0 HG LEU A 139 4.577 5.079 4.472 1.00 1.00 H new ATOM 0 HD11 LEU A 139 3.485 6.343 6.276 1.00 1.00 H new ATOM 0 HD12 LEU A 139 4.432 4.971 6.899 1.00 1.00 H new ATOM 0 HD13 LEU A 139 5.071 6.626 7.031 1.00 1.00 H new ATOM 0 HD21 LEU A 139 4.158 7.481 4.168 1.00 1.00 H new ATOM 0 HD22 LEU A 139 5.787 7.839 4.788 1.00 1.00 H new ATOM 0 HD23 LEU A 139 5.593 6.932 3.269 1.00 1.00 H new ATOM 966 N VAL A 140 7.305 2.432 3.868 1.00 1.00 N ATOM 967 CA VAL A 140 7.895 1.105 3.934 1.00 1.00 C ATOM 968 C VAL A 140 8.762 0.875 2.694 1.00 1.00 C ATOM 969 O VAL A 140 8.553 1.508 1.659 1.00 1.00 O ATOM 970 CB VAL A 140 6.797 0.052 4.098 1.00 1.00 C ATOM 971 CG1 VAL A 140 5.873 0.028 2.879 1.00 1.00 C ATOM 972 CG2 VAL A 140 7.398 -1.331 4.359 1.00 1.00 C ATOM 0 H VAL A 140 6.295 2.444 3.723 1.00 1.00 H new ATOM 0 HA VAL A 140 8.544 1.018 4.806 1.00 1.00 H new ATOM 0 HB VAL A 140 6.198 0.326 4.966 1.00 1.00 H new ATOM 0 HG11 VAL A 140 5.102 -0.729 3.022 1.00 1.00 H new ATOM 0 HG12 VAL A 140 5.405 1.005 2.758 1.00 1.00 H new ATOM 0 HG13 VAL A 140 6.453 -0.209 1.987 1.00 1.00 H new ATOM 0 HG21 VAL A 140 6.596 -2.061 4.472 1.00 1.00 H new ATOM 0 HG22 VAL A 140 8.033 -1.616 3.520 1.00 1.00 H new ATOM 0 HG23 VAL A 140 7.994 -1.303 5.271 1.00 1.00 H new ATOM 982 N GLU A 141 9.717 -0.031 2.839 1.00 1.00 N ATOM 983 CA GLU A 141 10.618 -0.352 1.744 1.00 1.00 C ATOM 984 C GLU A 141 10.335 -1.762 1.222 1.00 1.00 C ATOM 985 O GLU A 141 9.802 -2.602 1.946 1.00 1.00 O ATOM 986 CB GLU A 141 12.078 -0.209 2.175 1.00 1.00 C ATOM 987 CG GLU A 141 12.704 1.054 1.579 1.00 1.00 C ATOM 988 CD GLU A 141 14.228 0.931 1.514 1.00 1.00 C ATOM 989 OE1 GLU A 141 14.750 -0.144 1.184 1.00 1.00 O ATOM 990 OE2 GLU A 141 14.875 2.005 1.820 1.00 1.00 O ATOM 0 H GLU A 141 9.887 -0.554 3.698 1.00 1.00 H new ATOM 0 HA GLU A 141 10.443 0.357 0.934 1.00 1.00 H new ATOM 0 HB2 GLU A 141 12.138 -0.170 3.263 1.00 1.00 H new ATOM 0 HB3 GLU A 141 12.643 -1.085 1.856 1.00 1.00 H new ATOM 0 HG2 GLU A 141 12.306 1.224 0.579 1.00 1.00 H new ATOM 0 HG3 GLU A 141 12.431 1.920 2.182 1.00 1.00 H new ATOM 996 N SER A 142 10.706 -1.980 -0.032 1.00 1.00 N ATOM 997 CA SER A 142 10.500 -3.273 -0.660 1.00 1.00 C ATOM 998 C SER A 142 11.447 -4.308 -0.049 1.00 1.00 C ATOM 999 O SER A 142 12.587 -4.445 -0.487 1.00 1.00 O ATOM 1000 CB SER A 142 10.708 -3.191 -2.173 1.00 1.00 C ATOM 1001 OG SER A 142 11.981 -2.645 -2.508 1.00 1.00 O ATOM 0 H SER A 142 11.148 -1.282 -0.630 1.00 1.00 H new ATOM 0 HA SER A 142 9.470 -3.580 -0.479 1.00 1.00 H new ATOM 0 HB2 SER A 142 10.615 -4.187 -2.606 1.00 1.00 H new ATOM 0 HB3 SER A 142 9.923 -2.577 -2.614 1.00 1.00 H new ATOM 0 HG SER A 142 12.668 -3.040 -1.932 1.00 1.00 H new ATOM 1006 N GLY A 143 10.939 -5.010 0.954 1.00 1.00 N ATOM 1007 CA GLY A 143 11.726 -6.028 1.628 1.00 1.00 C ATOM 1008 C GLY A 143 11.831 -5.736 3.127 1.00 1.00 C ATOM 1009 O GLY A 143 12.072 -6.640 3.924 1.00 1.00 O ATOM 0 H GLY A 143 9.992 -4.893 1.316 1.00 1.00 H new ATOM 0 HA2 GLY A 143 11.270 -7.006 1.475 1.00 1.00 H new ATOM 0 HA3 GLY A 143 12.724 -6.070 1.191 1.00 1.00 H new ATOM 1013 N GLN A 144 11.643 -4.468 3.465 1.00 1.00 N ATOM 1014 CA GLN A 144 11.714 -4.045 4.853 1.00 1.00 C ATOM 1015 C GLN A 144 10.626 -4.738 5.675 1.00 1.00 C ATOM 1016 O GLN A 144 9.572 -5.088 5.147 1.00 1.00 O ATOM 1017 CB GLN A 144 11.603 -2.523 4.969 1.00 1.00 C ATOM 1018 CG GLN A 144 12.704 -1.961 5.871 1.00 1.00 C ATOM 1019 CD GLN A 144 13.411 -0.781 5.203 1.00 1.00 C ATOM 1020 OE1 GLN A 144 14.437 -0.923 4.559 1.00 1.00 O ATOM 1021 NE2 GLN A 144 12.806 0.389 5.392 1.00 1.00 N ATOM 0 H GLN A 144 11.442 -3.720 2.801 1.00 1.00 H new ATOM 0 HA GLN A 144 12.685 -4.337 5.252 1.00 1.00 H new ATOM 0 HB2 GLN A 144 11.674 -2.073 3.979 1.00 1.00 H new ATOM 0 HB3 GLN A 144 10.626 -2.255 5.372 1.00 1.00 H new ATOM 0 HG2 GLN A 144 12.274 -1.642 6.820 1.00 1.00 H new ATOM 0 HG3 GLN A 144 13.429 -2.743 6.097 1.00 1.00 H new ATOM 0 HE21 GLN A 144 11.949 0.437 5.943 1.00 1.00 H new ATOM 0 HE22 GLN A 144 13.200 1.238 4.986 1.00 1.00 H new ATOM 1028 N PRO A 145 10.926 -4.921 6.989 1.00 1.00 N ATOM 1029 CA PRO A 145 9.985 -5.566 7.889 1.00 1.00 C ATOM 1030 C PRO A 145 8.835 -4.622 8.248 1.00 1.00 C ATOM 1031 O PRO A 145 8.933 -3.413 8.045 1.00 1.00 O ATOM 1032 CB PRO A 145 10.815 -5.976 9.095 1.00 1.00 C ATOM 1033 CG PRO A 145 12.083 -5.141 9.034 1.00 1.00 C ATOM 1034 CD PRO A 145 12.164 -4.519 7.650 1.00 1.00 C ATOM 0 HA PRO A 145 9.500 -6.433 7.441 1.00 1.00 H new ATOM 0 HB2 PRO A 145 10.272 -5.794 10.022 1.00 1.00 H new ATOM 0 HB3 PRO A 145 11.047 -7.041 9.065 1.00 1.00 H new ATOM 0 HG2 PRO A 145 12.067 -4.366 9.801 1.00 1.00 H new ATOM 0 HG3 PRO A 145 12.958 -5.761 9.226 1.00 1.00 H new ATOM 0 HD2 PRO A 145 12.247 -3.434 7.708 1.00 1.00 H new ATOM 0 HD3 PRO A 145 13.038 -4.877 7.106 1.00 1.00 H new ATOM 1039 N VAL A 146 7.771 -5.212 8.773 1.00 1.00 N ATOM 1040 CA VAL A 146 6.604 -4.439 9.162 1.00 1.00 C ATOM 1041 C VAL A 146 6.007 -5.034 10.439 1.00 1.00 C ATOM 1042 O VAL A 146 6.224 -6.205 10.745 1.00 1.00 O ATOM 1043 CB VAL A 146 5.604 -4.384 8.004 1.00 1.00 C ATOM 1044 CG1 VAL A 146 6.260 -3.825 6.741 1.00 1.00 C ATOM 1045 CG2 VAL A 146 4.993 -5.762 7.742 1.00 1.00 C ATOM 0 H VAL A 146 7.693 -6.216 8.938 1.00 1.00 H new ATOM 0 HA VAL A 146 6.883 -3.409 9.383 1.00 1.00 H new ATOM 0 HB VAL A 146 4.797 -3.709 8.289 1.00 1.00 H new ATOM 0 HG11 VAL A 146 5.529 -3.796 5.933 1.00 1.00 H new ATOM 0 HG12 VAL A 146 6.625 -2.817 6.936 1.00 1.00 H new ATOM 0 HG13 VAL A 146 7.095 -4.463 6.452 1.00 1.00 H new ATOM 0 HG21 VAL A 146 4.286 -5.695 6.915 1.00 1.00 H new ATOM 0 HG22 VAL A 146 5.783 -6.468 7.488 1.00 1.00 H new ATOM 0 HG23 VAL A 146 4.473 -6.106 8.636 1.00 1.00 H new ATOM 1055 N GLU A 147 5.265 -4.198 11.152 1.00 1.00 N ATOM 1056 CA GLU A 147 4.636 -4.625 12.390 1.00 1.00 C ATOM 1057 C GLU A 147 3.225 -4.042 12.497 1.00 1.00 C ATOM 1058 O GLU A 147 3.003 -2.880 12.160 1.00 1.00 O ATOM 1059 CB GLU A 147 5.485 -4.233 13.601 1.00 1.00 C ATOM 1060 CG GLU A 147 5.148 -5.105 14.812 1.00 1.00 C ATOM 1061 CD GLU A 147 6.419 -5.638 15.475 1.00 1.00 C ATOM 1062 OE1 GLU A 147 6.717 -6.837 15.368 1.00 1.00 O ATOM 1063 OE2 GLU A 147 7.109 -4.758 16.118 1.00 1.00 O ATOM 0 H GLU A 147 5.086 -3.227 10.895 1.00 1.00 H new ATOM 0 HA GLU A 147 4.559 -5.712 12.379 1.00 1.00 H new ATOM 0 HB2 GLU A 147 6.542 -4.336 13.357 1.00 1.00 H new ATOM 0 HB3 GLU A 147 5.315 -3.184 13.845 1.00 1.00 H new ATOM 0 HG2 GLU A 147 4.573 -4.525 15.534 1.00 1.00 H new ATOM 0 HG3 GLU A 147 4.519 -5.939 14.500 1.00 1.00 H new ATOM 1069 N PHE A 148 2.309 -4.876 12.967 1.00 1.00 N ATOM 1070 CA PHE A 148 0.925 -4.458 13.121 1.00 1.00 C ATOM 1071 C PHE A 148 0.836 -3.136 13.888 1.00 1.00 C ATOM 1072 O PHE A 148 0.782 -3.129 15.117 1.00 1.00 O ATOM 1073 CB PHE A 148 0.217 -5.549 13.926 1.00 1.00 C ATOM 1074 CG PHE A 148 -1.310 -5.440 13.910 1.00 1.00 C ATOM 1075 CD1 PHE A 148 -1.920 -4.340 14.426 1.00 1.00 C ATOM 1076 CD2 PHE A 148 -2.057 -6.445 13.378 1.00 1.00 C ATOM 1077 CE1 PHE A 148 -3.336 -4.240 14.411 1.00 1.00 C ATOM 1078 CE2 PHE A 148 -3.473 -6.345 13.362 1.00 1.00 C ATOM 1079 CZ PHE A 148 -4.083 -5.245 13.879 1.00 1.00 C ATOM 0 H PHE A 148 2.498 -5.839 13.246 1.00 1.00 H new ATOM 0 HA PHE A 148 0.467 -4.312 12.143 1.00 1.00 H new ATOM 0 HB2 PHE A 148 0.506 -6.523 13.532 1.00 1.00 H new ATOM 0 HB3 PHE A 148 0.564 -5.508 14.959 1.00 1.00 H new ATOM 0 HD1 PHE A 148 -1.327 -3.542 14.848 1.00 1.00 H new ATOM 0 HD2 PHE A 148 -1.573 -7.319 12.968 1.00 1.00 H new ATOM 0 HE1 PHE A 148 -3.820 -3.366 14.822 1.00 1.00 H new ATOM 0 HE2 PHE A 148 -4.066 -7.143 12.939 1.00 1.00 H new ATOM 0 HZ PHE A 148 -5.160 -5.169 13.867 1.00 1.00 H new ATOM 1088 N ASP A 149 0.822 -2.049 13.129 1.00 1.00 N ATOM 1089 CA ASP A 149 0.739 -0.725 13.721 1.00 1.00 C ATOM 1090 C ASP A 149 1.444 0.281 12.810 1.00 1.00 C ATOM 1091 O ASP A 149 0.894 1.338 12.502 1.00 1.00 O ATOM 1092 CB ASP A 149 1.427 -0.688 15.087 1.00 1.00 C ATOM 1093 CG ASP A 149 2.748 -1.455 15.167 1.00 1.00 C ATOM 1094 OD1 ASP A 149 3.669 -1.226 14.369 1.00 1.00 O ATOM 1095 OD2 ASP A 149 2.813 -2.333 16.111 1.00 1.00 O ATOM 0 H ASP A 149 0.867 -2.059 12.110 1.00 1.00 H new ATOM 0 HA ASP A 149 -0.315 -0.475 13.841 1.00 1.00 H new ATOM 0 HB2 ASP A 149 1.611 0.352 15.356 1.00 1.00 H new ATOM 0 HB3 ASP A 149 0.743 -1.094 15.833 1.00 1.00 H new ATOM 1100 N GLU A 150 2.651 -0.082 12.403 1.00 1.00 N ATOM 1101 CA GLU A 150 3.438 0.775 11.532 1.00 1.00 C ATOM 1102 C GLU A 150 2.746 0.933 10.177 1.00 1.00 C ATOM 1103 O GLU A 150 2.172 -0.021 9.654 1.00 1.00 O ATOM 1104 CB GLU A 150 4.858 0.231 11.363 1.00 1.00 C ATOM 1105 CG GLU A 150 5.697 0.491 12.616 1.00 1.00 C ATOM 1106 CD GLU A 150 6.075 1.970 12.726 1.00 1.00 C ATOM 1107 OE1 GLU A 150 7.177 2.361 12.312 1.00 1.00 O ATOM 1108 OE2 GLU A 150 5.177 2.725 13.262 1.00 1.00 O ATOM 0 H GLU A 150 3.104 -0.959 12.660 1.00 1.00 H new ATOM 0 HA GLU A 150 3.515 1.758 11.996 1.00 1.00 H new ATOM 0 HB2 GLU A 150 4.820 -0.840 11.162 1.00 1.00 H new ATOM 0 HB3 GLU A 150 5.331 0.700 10.500 1.00 1.00 H new ATOM 0 HG2 GLU A 150 5.138 0.188 13.501 1.00 1.00 H new ATOM 0 HG3 GLU A 150 6.601 -0.118 12.586 1.00 1.00 H new ATOM 1114 N PRO A 151 2.826 2.177 9.632 1.00 1.00 N ATOM 1115 CA PRO A 151 2.215 2.471 8.347 1.00 1.00 C ATOM 1116 C PRO A 151 3.036 1.879 7.200 1.00 1.00 C ATOM 1117 O PRO A 151 4.246 1.697 7.327 1.00 1.00 O ATOM 1118 CB PRO A 151 2.127 3.988 8.292 1.00 1.00 C ATOM 1119 CG PRO A 151 3.107 4.501 9.334 1.00 1.00 C ATOM 1120 CD PRO A 151 3.498 3.331 10.222 1.00 1.00 C ATOM 0 HA PRO A 151 1.227 2.023 8.239 1.00 1.00 H new ATOM 0 HB2 PRO A 151 2.383 4.358 7.299 1.00 1.00 H new ATOM 0 HB3 PRO A 151 1.114 4.328 8.508 1.00 1.00 H new ATOM 0 HG2 PRO A 151 3.988 4.926 8.853 1.00 1.00 H new ATOM 0 HG3 PRO A 151 2.653 5.295 9.927 1.00 1.00 H new ATOM 0 HD2 PRO A 151 4.579 3.193 10.241 1.00 1.00 H new ATOM 0 HD3 PRO A 151 3.179 3.491 11.252 1.00 1.00 H new ATOM 1125 N LEU A 152 2.345 1.593 6.106 1.00 1.00 N ATOM 1126 CA LEU A 152 2.996 1.025 4.938 1.00 1.00 C ATOM 1127 C LEU A 152 3.131 2.102 3.860 1.00 1.00 C ATOM 1128 O LEU A 152 4.204 2.677 3.684 1.00 1.00 O ATOM 1129 CB LEU A 152 2.251 -0.226 4.466 1.00 1.00 C ATOM 1130 CG LEU A 152 2.174 -1.379 5.469 1.00 1.00 C ATOM 1131 CD1 LEU A 152 1.347 -2.538 4.911 1.00 1.00 C ATOM 1132 CD2 LEU A 152 3.573 -1.828 5.896 1.00 1.00 C ATOM 0 H LEU A 152 1.341 1.744 6.004 1.00 1.00 H new ATOM 0 HA LEU A 152 4.004 0.694 5.187 1.00 1.00 H new ATOM 0 HB2 LEU A 152 1.235 0.061 4.194 1.00 1.00 H new ATOM 0 HB3 LEU A 152 2.733 -0.591 3.559 1.00 1.00 H new ATOM 0 HG LEU A 152 1.663 -1.020 6.362 1.00 1.00 H new ATOM 0 HD11 LEU A 152 1.309 -3.344 5.644 1.00 1.00 H new ATOM 0 HD12 LEU A 152 0.335 -2.193 4.697 1.00 1.00 H new ATOM 0 HD13 LEU A 152 1.807 -2.904 3.993 1.00 1.00 H new ATOM 0 HD21 LEU A 152 3.490 -2.648 6.609 1.00 1.00 H new ATOM 0 HD22 LEU A 152 4.131 -2.162 5.021 1.00 1.00 H new ATOM 0 HD23 LEU A 152 4.096 -0.993 6.363 1.00 1.00 H new ATOM 1143 N VAL A 153 2.028 2.344 3.168 1.00 1.00 N ATOM 1144 CA VAL A 153 2.010 3.342 2.112 1.00 1.00 C ATOM 1145 C VAL A 153 0.811 4.270 2.313 1.00 1.00 C ATOM 1146 O VAL A 153 -0.275 3.818 2.673 1.00 1.00 O ATOM 1147 CB VAL A 153 2.012 2.657 0.744 1.00 1.00 C ATOM 1148 CG1 VAL A 153 2.406 3.640 -0.361 1.00 1.00 C ATOM 1149 CG2 VAL A 153 2.933 1.435 0.744 1.00 1.00 C ATOM 0 H VAL A 153 1.140 1.866 3.318 1.00 1.00 H new ATOM 0 HA VAL A 153 2.908 3.958 2.154 1.00 1.00 H new ATOM 0 HB VAL A 153 0.998 2.313 0.541 1.00 1.00 H new ATOM 0 HG11 VAL A 153 2.400 3.128 -1.323 1.00 1.00 H new ATOM 0 HG12 VAL A 153 1.694 4.465 -0.385 1.00 1.00 H new ATOM 0 HG13 VAL A 153 3.405 4.028 -0.163 1.00 1.00 H new ATOM 0 HG21 VAL A 153 2.916 0.967 -0.240 1.00 1.00 H new ATOM 0 HG22 VAL A 153 3.951 1.746 0.980 1.00 1.00 H new ATOM 0 HG23 VAL A 153 2.589 0.720 1.492 1.00 1.00 H new ATOM 1159 N VAL A 154 1.048 5.551 2.074 1.00 1.00 N ATOM 1160 CA VAL A 154 0.001 6.547 2.225 1.00 1.00 C ATOM 1161 C VAL A 154 -0.626 6.832 0.860 1.00 1.00 C ATOM 1162 O VAL A 154 0.079 7.140 -0.100 1.00 1.00 O ATOM 1163 CB VAL A 154 0.565 7.801 2.898 1.00 1.00 C ATOM 1164 CG1 VAL A 154 -0.562 8.720 3.376 1.00 1.00 C ATOM 1165 CG2 VAL A 154 1.498 7.432 4.052 1.00 1.00 C ATOM 0 H VAL A 154 1.950 5.922 1.777 1.00 1.00 H new ATOM 0 HA VAL A 154 -0.791 6.174 2.875 1.00 1.00 H new ATOM 0 HB VAL A 154 1.150 8.345 2.156 1.00 1.00 H new ATOM 0 HG11 VAL A 154 -0.135 9.603 3.850 1.00 1.00 H new ATOM 0 HG12 VAL A 154 -1.170 9.024 2.524 1.00 1.00 H new ATOM 0 HG13 VAL A 154 -1.185 8.188 4.095 1.00 1.00 H new ATOM 0 HG21 VAL A 154 1.885 8.341 4.512 1.00 1.00 H new ATOM 0 HG22 VAL A 154 0.947 6.855 4.795 1.00 1.00 H new ATOM 0 HG23 VAL A 154 2.328 6.836 3.672 1.00 1.00 H new ATOM 1175 N ILE A 155 -1.946 6.720 0.815 1.00 1.00 N ATOM 1176 CA ILE A 155 -2.676 6.963 -0.418 1.00 1.00 C ATOM 1177 C ILE A 155 -3.482 8.256 -0.282 1.00 1.00 C ATOM 1178 O ILE A 155 -3.692 8.748 0.826 1.00 1.00 O ATOM 1179 CB ILE A 155 -3.527 5.744 -0.784 1.00 1.00 C ATOM 1180 CG1 ILE A 155 -2.644 4.541 -1.123 1.00 1.00 C ATOM 1181 CG2 ILE A 155 -4.502 6.076 -1.915 1.00 1.00 C ATOM 1182 CD1 ILE A 155 -2.361 3.699 0.124 1.00 1.00 C ATOM 0 H ILE A 155 -2.528 6.464 1.612 1.00 1.00 H new ATOM 0 HA ILE A 155 -1.985 7.104 -1.249 1.00 1.00 H new ATOM 0 HB ILE A 155 -4.124 5.470 0.086 1.00 1.00 H new ATOM 0 HG12 ILE A 155 -3.135 3.926 -1.877 1.00 1.00 H new ATOM 0 HG13 ILE A 155 -1.704 4.885 -1.555 1.00 1.00 H new ATOM 0 HG21 ILE A 155 -5.094 5.193 -2.156 1.00 1.00 H new ATOM 0 HG22 ILE A 155 -5.164 6.882 -1.600 1.00 1.00 H new ATOM 0 HG23 ILE A 155 -3.943 6.389 -2.797 1.00 1.00 H new ATOM 0 HD11 ILE A 155 -1.732 2.851 -0.145 1.00 1.00 H new ATOM 0 HD12 ILE A 155 -1.848 4.310 0.867 1.00 1.00 H new ATOM 0 HD13 ILE A 155 -3.301 3.336 0.539 1.00 1.00 H new ATOM 1193 N GLU A 156 -3.911 8.771 -1.425 1.00 1.00 N ATOM 1194 CA GLU A 156 -4.689 9.997 -1.448 1.00 1.00 C ATOM 1195 C GLU A 156 -6.057 9.747 -2.084 1.00 1.00 C ATOM 1196 O GLU A 156 -6.621 8.663 -1.945 1.00 1.00 O ATOM 1197 CB GLU A 156 -3.938 11.109 -2.183 1.00 1.00 C ATOM 1198 CG GLU A 156 -4.653 12.452 -2.026 1.00 1.00 C ATOM 1199 CD GLU A 156 -5.222 12.931 -3.364 1.00 1.00 C ATOM 1200 OE1 GLU A 156 -4.583 13.740 -4.054 1.00 1.00 O ATOM 1201 OE2 GLU A 156 -6.369 12.433 -3.678 1.00 1.00 O ATOM 0 H GLU A 156 -3.734 8.361 -2.342 1.00 1.00 H new ATOM 0 HA GLU A 156 -4.843 10.325 -0.420 1.00 1.00 H new ATOM 0 HB2 GLU A 156 -2.923 11.186 -1.793 1.00 1.00 H new ATOM 0 HB3 GLU A 156 -3.855 10.859 -3.241 1.00 1.00 H new ATOM 0 HG2 GLU A 156 -5.458 12.356 -1.298 1.00 1.00 H new ATOM 0 HG3 GLU A 156 -3.957 13.195 -1.636 1.00 1.00 H new