USER MOD reduce.3.24.130724 H: found=0, std=0, add=602, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 598 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 157 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 159 ASN : amide:sc= -0.113 K(o=-0.11,f=-2!) USER MOD Single : A 134 MET CE :methyl -134:sc= 0 (180deg=-3.53!) USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 140 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 143 SER OG : rot 180:sc= 0 USER MOD Single : A 145 TYR OH : rot 180:sc= 0 USER MOD Single : A 149 TYR OH : rot 180:sc= 0 USER MOD Single : A 150 TYR OH : rot 165:sc= -2.47! USER MOD Single : A 153 ASN : amide:sc= 0 X(o=0,f=-0.021) USER MOD Single : A 154 MET CE :methyl 149:sc= -0.123 (180deg=-0.927) USER MOD Single : A 155 HIS :FLIP no HD1:sc= -0.781 F(o=-1.6,f=-0.78) USER MOD Single : A 160 GLN : amide:sc= -0.11 X(o=-0.11,f=0) USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 174 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 177 HIS : no HD1:sc= -0.209 X(o=-0.21,f=0) USER MOD Single : A 178 ASN : amide:sc= -0.0762 X(o=-0.076,f=0) USER MOD Single : A 179 CYS SG : rot 180:sc= 0 USER MOD Single : A 181 ASN : amide:sc= 0 X(o=0,f=0.14) USER MOD Single : A 183 THR OG1 : rot -150:sc= 0.00981 USER MOD Single : A 185 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 186 GLN : amide:sc= -0.157 X(o=-0.16,f=-0.0027) USER MOD Single : A 187 HIS : no HD1:sc= 0 X(o=0,f=-0.02) USER MOD Single : A 188 THR OG1 : rot 180:sc= 0 USER MOD Single : A 190 THR OG1 : rot 180:sc= 0 USER MOD Single : A 191 THR OG1 : rot -170:sc= -0.32 USER MOD Single : A 192 THR OG1 : rot -91:sc= 1.21 USER MOD Single : A 193 THR OG1 : rot 98:sc= 1.21 USER MOD Single : A 194 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 197 ASN : amide:sc= -0.105 X(o=-0.1,f=-0.00087) USER MOD Single : A 199 THR OG1 : rot 180:sc= 0.0614 USER MOD Single : A 201 THR OG1 : rot 180:sc= 0 USER MOD Single : A 204 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 205 MET CE :methyl -160:sc= -1.65 (180deg=-2.22!) USER MOD Single : A 206 MET CE :methyl -144:sc= -0.258 (180deg=-0.801) USER MOD Single : A 212 GLN : amide:sc= -0.417 K(o=-0.42,f=-4!) USER MOD Single : A 213 MET CE :methyl -119:sc= -2.89 (180deg=-8.54!) USER MOD Single : A 214 CYS SG : rot 73:sc= 0.00565 USER MOD Single : A 216 THR OG1 : rot 68:sc= 1.24 USER MOD Single : A 217 GLN : amide:sc= -0.209 K(o=-0.21,f=-1.7!) USER MOD Single : A 218 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 108 N ALA A 133 13.801 -10.636 -14.119 1.00 0.00 N ATOM 109 CA ALA A 133 14.972 -10.370 -14.946 1.00 0.00 C ATOM 110 C ALA A 133 14.575 -10.125 -16.398 1.00 0.00 C ATOM 111 O ALA A 133 13.392 -10.011 -16.717 1.00 0.00 O ATOM 112 CB ALA A 133 15.957 -11.526 -14.853 1.00 0.00 C ATOM 0 HA ALA A 133 15.453 -9.466 -14.572 1.00 0.00 H new ATOM 0 HB1 ALA A 133 16.826 -11.314 -15.475 1.00 0.00 H new ATOM 0 HB2 ALA A 133 16.274 -11.652 -13.818 1.00 0.00 H new ATOM 0 HB3 ALA A 133 15.477 -12.441 -15.199 1.00 0.00 H new ATOM 118 N MET A 134 15.571 -10.046 -17.274 1.00 0.00 N ATOM 119 CA MET A 134 15.325 -9.816 -18.692 1.00 0.00 C ATOM 120 C MET A 134 16.196 -10.728 -19.550 1.00 0.00 C ATOM 121 O MET A 134 17.367 -10.951 -19.244 1.00 0.00 O ATOM 122 CB MET A 134 15.594 -8.353 -19.048 1.00 0.00 C ATOM 123 CG MET A 134 14.922 -7.366 -18.107 1.00 0.00 C ATOM 124 SD MET A 134 13.128 -7.345 -18.287 1.00 0.00 S ATOM 125 CE MET A 134 12.683 -6.084 -17.096 1.00 0.00 C ATOM 0 H MET A 134 16.556 -10.138 -17.026 1.00 0.00 H new ATOM 0 HA MET A 134 14.279 -10.045 -18.895 1.00 0.00 H new ATOM 0 HB2 MET A 134 16.670 -8.177 -19.039 1.00 0.00 H new ATOM 0 HB3 MET A 134 15.249 -8.166 -20.065 1.00 0.00 H new ATOM 0 HG2 MET A 134 15.177 -7.620 -17.078 1.00 0.00 H new ATOM 0 HG3 MET A 134 15.314 -6.366 -18.295 1.00 0.00 H new ATOM 0 HE1 MET A 134 11.845 -6.433 -16.493 1.00 0.00 H new ATOM 0 HE2 MET A 134 13.535 -5.878 -16.448 1.00 0.00 H new ATOM 0 HE3 MET A 134 12.398 -5.172 -17.621 1.00 0.00 H new ATOM 135 N SER A 135 15.616 -11.253 -20.625 1.00 0.00 N ATOM 136 CA SER A 135 16.339 -12.144 -21.525 1.00 0.00 C ATOM 137 C SER A 135 17.066 -11.351 -22.607 1.00 0.00 C ATOM 138 O SER A 135 16.642 -10.258 -22.982 1.00 0.00 O ATOM 139 CB SER A 135 15.376 -13.143 -22.170 1.00 0.00 C ATOM 140 OG SER A 135 15.654 -14.466 -21.746 1.00 0.00 O ATOM 0 H SER A 135 14.648 -11.077 -20.894 1.00 0.00 H new ATOM 0 HA SER A 135 17.079 -12.689 -20.939 1.00 0.00 H new ATOM 0 HB2 SER A 135 14.350 -12.883 -21.911 1.00 0.00 H new ATOM 0 HB3 SER A 135 15.456 -13.081 -23.255 1.00 0.00 H new ATOM 0 HG SER A 135 15.024 -15.085 -22.171 1.00 0.00 H new ATOM 146 N ARG A 136 18.165 -11.910 -23.104 1.00 0.00 N ATOM 147 CA ARG A 136 18.953 -11.255 -24.141 1.00 0.00 C ATOM 148 C ARG A 136 19.535 -9.939 -23.633 1.00 0.00 C ATOM 149 O ARG A 136 19.088 -8.852 -24.000 1.00 0.00 O ATOM 150 CB ARG A 136 18.093 -11.000 -25.380 1.00 0.00 C ATOM 151 CG ARG A 136 17.263 -12.201 -25.804 1.00 0.00 C ATOM 152 CD ARG A 136 16.402 -11.884 -27.016 1.00 0.00 C ATOM 153 NE ARG A 136 15.139 -11.255 -26.641 1.00 0.00 N ATOM 154 CZ ARG A 136 14.077 -11.206 -27.438 1.00 0.00 C ATOM 155 NH1 ARG A 136 14.126 -11.747 -28.647 1.00 0.00 N ATOM 156 NH2 ARG A 136 12.963 -10.616 -27.024 1.00 0.00 N ATOM 0 H ARG A 136 18.530 -12.815 -22.805 1.00 0.00 H new ATOM 0 HA ARG A 136 19.777 -11.917 -24.408 1.00 0.00 H new ATOM 0 HB2 ARG A 136 17.427 -10.160 -25.183 1.00 0.00 H new ATOM 0 HB3 ARG A 136 18.740 -10.706 -26.207 1.00 0.00 H new ATOM 0 HG2 ARG A 136 17.923 -13.038 -26.034 1.00 0.00 H new ATOM 0 HG3 ARG A 136 16.627 -12.515 -24.977 1.00 0.00 H new ATOM 0 HD2 ARG A 136 16.951 -11.223 -27.687 1.00 0.00 H new ATOM 0 HD3 ARG A 136 16.200 -12.802 -27.567 1.00 0.00 H new ATOM 0 HE ARG A 136 15.068 -10.830 -25.717 1.00 0.00 H new ATOM 0 HH11 ARG A 136 14.980 -12.202 -28.968 1.00 0.00 H new ATOM 0 HH12 ARG A 136 13.309 -11.708 -29.257 1.00 0.00 H new ATOM 0 HH21 ARG A 136 12.922 -10.200 -26.094 1.00 0.00 H new ATOM 0 HH22 ARG A 136 12.148 -10.579 -27.636 1.00 0.00 H new ATOM 170 N PRO A 137 20.555 -10.038 -22.768 1.00 0.00 N ATOM 171 CA PRO A 137 21.220 -8.866 -22.191 1.00 0.00 C ATOM 172 C PRO A 137 22.040 -8.098 -23.222 1.00 0.00 C ATOM 173 O PRO A 137 22.412 -6.946 -23.000 1.00 0.00 O ATOM 174 CB PRO A 137 22.134 -9.468 -21.121 1.00 0.00 C ATOM 175 CG PRO A 137 22.392 -10.861 -21.582 1.00 0.00 C ATOM 176 CD PRO A 137 21.139 -11.302 -22.287 1.00 0.00 C ATOM 0 HA PRO A 137 20.504 -8.142 -21.802 1.00 0.00 H new ATOM 0 HB2 PRO A 137 23.062 -8.903 -21.030 1.00 0.00 H new ATOM 0 HB3 PRO A 137 21.657 -9.457 -20.141 1.00 0.00 H new ATOM 0 HG2 PRO A 137 23.251 -10.898 -22.253 1.00 0.00 H new ATOM 0 HG3 PRO A 137 22.617 -11.515 -20.740 1.00 0.00 H new ATOM 0 HD2 PRO A 137 21.359 -11.982 -23.110 1.00 0.00 H new ATOM 0 HD3 PRO A 137 20.462 -11.827 -21.613 1.00 0.00 H new ATOM 184 N ILE A 138 22.318 -8.744 -24.350 1.00 0.00 N ATOM 185 CA ILE A 138 23.093 -8.121 -25.415 1.00 0.00 C ATOM 186 C ILE A 138 22.261 -7.089 -26.169 1.00 0.00 C ATOM 187 O ILE A 138 21.457 -7.437 -27.034 1.00 0.00 O ATOM 188 CB ILE A 138 23.620 -9.167 -26.415 1.00 0.00 C ATOM 189 CG1 ILE A 138 24.491 -10.199 -25.695 1.00 0.00 C ATOM 190 CG2 ILE A 138 24.403 -8.489 -27.528 1.00 0.00 C ATOM 191 CD1 ILE A 138 23.718 -11.396 -25.189 1.00 0.00 C ATOM 0 H ILE A 138 22.018 -9.698 -24.549 1.00 0.00 H new ATOM 0 HA ILE A 138 23.940 -7.626 -24.940 1.00 0.00 H new ATOM 0 HB ILE A 138 22.769 -9.684 -26.859 1.00 0.00 H new ATOM 0 HG12 ILE A 138 25.271 -10.542 -26.375 1.00 0.00 H new ATOM 0 HG13 ILE A 138 24.990 -9.717 -24.854 1.00 0.00 H new ATOM 0 HG21 ILE A 138 24.769 -9.242 -28.226 1.00 0.00 H new ATOM 0 HG22 ILE A 138 23.754 -7.790 -28.055 1.00 0.00 H new ATOM 0 HG23 ILE A 138 25.248 -7.949 -27.101 1.00 0.00 H new ATOM 0 HD11 ILE A 138 24.400 -12.085 -24.690 1.00 0.00 H new ATOM 0 HD12 ILE A 138 22.956 -11.065 -24.484 1.00 0.00 H new ATOM 0 HD13 ILE A 138 23.241 -11.902 -26.028 1.00 0.00 H new ATOM 203 N ILE A 139 22.460 -5.818 -25.835 1.00 0.00 N ATOM 204 CA ILE A 139 21.730 -4.735 -26.482 1.00 0.00 C ATOM 205 C ILE A 139 22.436 -4.280 -27.755 1.00 0.00 C ATOM 206 O ILE A 139 23.657 -4.389 -27.874 1.00 0.00 O ATOM 207 CB ILE A 139 21.564 -3.527 -25.541 1.00 0.00 C ATOM 208 CG1 ILE A 139 20.587 -2.515 -26.143 1.00 0.00 C ATOM 209 CG2 ILE A 139 22.912 -2.876 -25.273 1.00 0.00 C ATOM 210 CD1 ILE A 139 19.670 -1.880 -25.122 1.00 0.00 C ATOM 0 H ILE A 139 23.121 -5.513 -25.120 1.00 0.00 H new ATOM 0 HA ILE A 139 20.745 -5.126 -26.735 1.00 0.00 H new ATOM 0 HB ILE A 139 21.157 -3.877 -24.592 1.00 0.00 H new ATOM 0 HG12 ILE A 139 21.153 -1.732 -26.648 1.00 0.00 H new ATOM 0 HG13 ILE A 139 19.983 -3.012 -26.902 1.00 0.00 H new ATOM 0 HG21 ILE A 139 22.778 -2.024 -24.607 1.00 0.00 H new ATOM 0 HG22 ILE A 139 23.580 -3.600 -24.807 1.00 0.00 H new ATOM 0 HG23 ILE A 139 23.345 -2.536 -26.214 1.00 0.00 H new ATOM 0 HD11 ILE A 139 19.005 -1.174 -25.619 1.00 0.00 H new ATOM 0 HD12 ILE A 139 19.078 -2.654 -24.634 1.00 0.00 H new ATOM 0 HD13 ILE A 139 20.265 -1.354 -24.376 1.00 0.00 H new ATOM 222 N HIS A 140 21.659 -3.769 -28.705 1.00 0.00 N ATOM 223 CA HIS A 140 22.210 -3.295 -29.970 1.00 0.00 C ATOM 224 C HIS A 140 23.358 -2.318 -29.730 1.00 0.00 C ATOM 225 O HIS A 140 23.137 -1.157 -29.385 1.00 0.00 O ATOM 226 CB HIS A 140 21.120 -2.623 -30.805 1.00 0.00 C ATOM 227 CG HIS A 140 20.210 -3.594 -31.493 1.00 0.00 C ATOM 228 ND1 HIS A 140 19.506 -3.284 -32.638 1.00 0.00 N ATOM 229 CD2 HIS A 140 19.891 -4.874 -31.192 1.00 0.00 C ATOM 230 CE1 HIS A 140 18.793 -4.332 -33.011 1.00 0.00 C ATOM 231 NE2 HIS A 140 19.009 -5.310 -32.150 1.00 0.00 N ATOM 0 H HIS A 140 20.647 -3.673 -28.623 1.00 0.00 H new ATOM 0 HA HIS A 140 22.596 -4.156 -30.515 1.00 0.00 H new ATOM 0 HB2 HIS A 140 20.526 -1.976 -30.160 1.00 0.00 H new ATOM 0 HB3 HIS A 140 21.589 -1.984 -31.553 1.00 0.00 H new ATOM 0 HD2 HIS A 140 20.261 -5.446 -30.354 1.00 0.00 H new ATOM 0 HE1 HIS A 140 18.144 -4.381 -33.873 1.00 0.00 H new ATOM 0 HE2 HIS A 140 18.589 -6.239 -32.190 1.00 0.00 H new ATOM 239 N PHE A 141 24.584 -2.796 -29.915 1.00 0.00 N ATOM 240 CA PHE A 141 25.766 -1.966 -29.717 1.00 0.00 C ATOM 241 C PHE A 141 25.724 -0.736 -30.619 1.00 0.00 C ATOM 242 O PHE A 141 25.565 0.389 -30.146 1.00 0.00 O ATOM 243 CB PHE A 141 27.035 -2.774 -29.997 1.00 0.00 C ATOM 244 CG PHE A 141 27.059 -4.110 -29.312 1.00 0.00 C ATOM 245 CD1 PHE A 141 27.414 -4.212 -27.976 1.00 0.00 C ATOM 246 CD2 PHE A 141 26.726 -5.264 -30.003 1.00 0.00 C ATOM 247 CE1 PHE A 141 27.436 -5.440 -27.342 1.00 0.00 C ATOM 248 CE2 PHE A 141 26.747 -6.495 -29.374 1.00 0.00 C ATOM 249 CZ PHE A 141 27.103 -6.583 -28.042 1.00 0.00 C ATOM 0 H PHE A 141 24.785 -3.754 -30.202 1.00 0.00 H new ATOM 0 HA PHE A 141 25.776 -1.634 -28.679 1.00 0.00 H new ATOM 0 HB2 PHE A 141 27.130 -2.924 -31.072 1.00 0.00 H new ATOM 0 HB3 PHE A 141 27.902 -2.196 -29.678 1.00 0.00 H new ATOM 0 HD1 PHE A 141 27.676 -3.322 -27.424 1.00 0.00 H new ATOM 0 HD2 PHE A 141 26.447 -5.201 -31.044 1.00 0.00 H new ATOM 0 HE1 PHE A 141 27.713 -5.506 -26.300 1.00 0.00 H new ATOM 0 HE2 PHE A 141 26.485 -7.387 -29.924 1.00 0.00 H new ATOM 0 HZ PHE A 141 27.121 -7.544 -27.549 1.00 0.00 H new ATOM 259 N GLY A 142 25.868 -0.958 -31.922 1.00 0.00 N ATOM 260 CA GLY A 142 25.844 0.140 -32.869 1.00 0.00 C ATOM 261 C GLY A 142 27.228 0.689 -33.156 1.00 0.00 C ATOM 262 O GLY A 142 27.441 1.357 -34.168 1.00 0.00 O ATOM 0 H GLY A 142 26.001 -1.880 -32.338 1.00 0.00 H new ATOM 0 HA2 GLY A 142 25.390 -0.198 -33.801 1.00 0.00 H new ATOM 0 HA3 GLY A 142 25.213 0.939 -32.478 1.00 0.00 H new ATOM 266 N SER A 143 28.170 0.409 -32.262 1.00 0.00 N ATOM 267 CA SER A 143 29.540 0.884 -32.421 1.00 0.00 C ATOM 268 C SER A 143 30.534 -0.128 -31.859 1.00 0.00 C ATOM 269 O SER A 143 30.577 -0.368 -30.652 1.00 0.00 O ATOM 270 CB SER A 143 29.718 2.233 -31.723 1.00 0.00 C ATOM 271 OG SER A 143 28.555 2.590 -30.997 1.00 0.00 O ATOM 0 H SER A 143 28.010 -0.144 -31.420 1.00 0.00 H new ATOM 0 HA SER A 143 29.735 1.006 -33.486 1.00 0.00 H new ATOM 0 HB2 SER A 143 30.572 2.186 -31.047 1.00 0.00 H new ATOM 0 HB3 SER A 143 29.939 3.002 -32.463 1.00 0.00 H new ATOM 0 HG SER A 143 28.696 3.455 -30.559 1.00 0.00 H new ATOM 277 N ASP A 144 31.332 -0.718 -32.742 1.00 0.00 N ATOM 278 CA ASP A 144 32.327 -1.703 -32.336 1.00 0.00 C ATOM 279 C ASP A 144 33.205 -1.157 -31.213 1.00 0.00 C ATOM 280 O ASP A 144 33.585 -1.888 -30.298 1.00 0.00 O ATOM 281 CB ASP A 144 33.195 -2.105 -33.529 1.00 0.00 C ATOM 282 CG ASP A 144 33.429 -3.601 -33.598 1.00 0.00 C ATOM 283 OD1 ASP A 144 34.119 -4.136 -32.705 1.00 0.00 O ATOM 284 OD2 ASP A 144 32.919 -4.238 -34.543 1.00 0.00 O ATOM 0 H ASP A 144 31.309 -0.531 -33.744 1.00 0.00 H new ATOM 0 HA ASP A 144 31.801 -2.583 -31.967 1.00 0.00 H new ATOM 0 HB2 ASP A 144 32.717 -1.772 -34.450 1.00 0.00 H new ATOM 0 HB3 ASP A 144 34.155 -1.593 -33.465 1.00 0.00 H new ATOM 289 N TYR A 145 33.523 0.130 -31.291 1.00 0.00 N ATOM 290 CA TYR A 145 34.359 0.773 -30.284 1.00 0.00 C ATOM 291 C TYR A 145 33.689 0.735 -28.914 1.00 0.00 C ATOM 292 O TYR A 145 34.282 0.287 -27.934 1.00 0.00 O ATOM 293 CB TYR A 145 34.651 2.221 -30.682 1.00 0.00 C ATOM 294 CG TYR A 145 35.078 2.379 -32.124 1.00 0.00 C ATOM 295 CD1 TYR A 145 36.272 1.834 -32.579 1.00 0.00 C ATOM 296 CD2 TYR A 145 34.286 3.072 -33.031 1.00 0.00 C ATOM 297 CE1 TYR A 145 36.666 1.976 -33.895 1.00 0.00 C ATOM 298 CE2 TYR A 145 34.671 3.218 -34.350 1.00 0.00 C ATOM 299 CZ TYR A 145 35.862 2.669 -34.777 1.00 0.00 C ATOM 300 OH TYR A 145 36.251 2.812 -36.089 1.00 0.00 O ATOM 0 H TYR A 145 33.215 0.749 -32.041 1.00 0.00 H new ATOM 0 HA TYR A 145 35.298 0.223 -30.224 1.00 0.00 H new ATOM 0 HB2 TYR A 145 33.760 2.824 -30.508 1.00 0.00 H new ATOM 0 HB3 TYR A 145 35.434 2.616 -30.035 1.00 0.00 H new ATOM 0 HD1 TYR A 145 36.903 1.290 -31.892 1.00 0.00 H new ATOM 0 HD2 TYR A 145 33.353 3.504 -32.699 1.00 0.00 H new ATOM 0 HE1 TYR A 145 37.598 1.547 -34.232 1.00 0.00 H new ATOM 0 HE2 TYR A 145 34.043 3.759 -35.042 1.00 0.00 H new ATOM 0 HH TYR A 145 35.573 3.325 -36.577 1.00 0.00 H new ATOM 310 N GLU A 146 32.448 1.208 -28.857 1.00 0.00 N ATOM 311 CA GLU A 146 31.696 1.229 -27.608 1.00 0.00 C ATOM 312 C GLU A 146 31.443 -0.188 -27.101 1.00 0.00 C ATOM 313 O GLU A 146 31.344 -0.420 -25.896 1.00 0.00 O ATOM 314 CB GLU A 146 30.364 1.958 -27.800 1.00 0.00 C ATOM 315 CG GLU A 146 30.507 3.467 -27.913 1.00 0.00 C ATOM 316 CD GLU A 146 29.327 4.210 -27.318 1.00 0.00 C ATOM 317 OE1 GLU A 146 28.176 3.864 -27.655 1.00 0.00 O ATOM 318 OE2 GLU A 146 29.556 5.139 -26.515 1.00 0.00 O ATOM 0 H GLU A 146 31.943 1.581 -29.660 1.00 0.00 H new ATOM 0 HA GLU A 146 32.290 1.762 -26.866 1.00 0.00 H new ATOM 0 HB2 GLU A 146 29.878 1.579 -28.699 1.00 0.00 H new ATOM 0 HB3 GLU A 146 29.708 1.725 -26.961 1.00 0.00 H new ATOM 0 HG2 GLU A 146 31.421 3.781 -27.409 1.00 0.00 H new ATOM 0 HG3 GLU A 146 30.612 3.741 -28.963 1.00 0.00 H new ATOM 325 N ASP A 147 31.340 -1.132 -28.030 1.00 0.00 N ATOM 326 CA ASP A 147 31.100 -2.527 -27.679 1.00 0.00 C ATOM 327 C ASP A 147 32.223 -3.067 -26.799 1.00 0.00 C ATOM 328 O ASP A 147 31.988 -3.885 -25.909 1.00 0.00 O ATOM 329 CB ASP A 147 30.972 -3.379 -28.943 1.00 0.00 C ATOM 330 CG ASP A 147 30.396 -4.752 -28.660 1.00 0.00 C ATOM 331 OD1 ASP A 147 30.321 -5.131 -27.473 1.00 0.00 O ATOM 332 OD2 ASP A 147 30.021 -5.449 -29.627 1.00 0.00 O ATOM 0 H ASP A 147 31.419 -0.957 -29.032 1.00 0.00 H new ATOM 0 HA ASP A 147 30.166 -2.579 -27.119 1.00 0.00 H new ATOM 0 HB2 ASP A 147 30.336 -2.863 -29.663 1.00 0.00 H new ATOM 0 HB3 ASP A 147 31.953 -3.488 -29.405 1.00 0.00 H new ATOM 337 N ARG A 148 33.442 -2.605 -27.054 1.00 0.00 N ATOM 338 CA ARG A 148 34.602 -3.044 -26.286 1.00 0.00 C ATOM 339 C ARG A 148 34.417 -2.740 -24.802 1.00 0.00 C ATOM 340 O ARG A 148 34.589 -3.615 -23.953 1.00 0.00 O ATOM 341 CB ARG A 148 35.870 -2.362 -26.803 1.00 0.00 C ATOM 342 CG ARG A 148 36.158 -2.643 -28.269 1.00 0.00 C ATOM 343 CD ARG A 148 36.251 -4.136 -28.543 1.00 0.00 C ATOM 344 NE ARG A 148 37.179 -4.436 -29.629 1.00 0.00 N ATOM 345 CZ ARG A 148 37.245 -5.618 -30.233 1.00 0.00 C ATOM 346 NH1 ARG A 148 36.442 -6.604 -29.859 1.00 0.00 N ATOM 347 NH2 ARG A 148 38.117 -5.814 -31.215 1.00 0.00 N ATOM 0 H ARG A 148 33.653 -1.927 -27.786 1.00 0.00 H new ATOM 0 HA ARG A 148 34.702 -4.122 -26.409 1.00 0.00 H new ATOM 0 HB2 ARG A 148 35.778 -1.285 -26.659 1.00 0.00 H new ATOM 0 HB3 ARG A 148 36.719 -2.692 -26.205 1.00 0.00 H new ATOM 0 HG2 ARG A 148 35.372 -2.207 -28.885 1.00 0.00 H new ATOM 0 HG3 ARG A 148 37.092 -2.160 -28.556 1.00 0.00 H new ATOM 0 HD2 ARG A 148 36.573 -4.651 -27.638 1.00 0.00 H new ATOM 0 HD3 ARG A 148 35.263 -4.521 -28.794 1.00 0.00 H new ATOM 0 HE ARG A 148 37.811 -3.699 -29.941 1.00 0.00 H new ATOM 0 HH11 ARG A 148 35.771 -6.457 -29.105 1.00 0.00 H new ATOM 0 HH12 ARG A 148 36.495 -7.510 -30.325 1.00 0.00 H new ATOM 0 HH21 ARG A 148 38.736 -5.057 -31.506 1.00 0.00 H new ATOM 0 HH22 ARG A 148 38.168 -6.721 -31.679 1.00 0.00 H new ATOM 361 N TYR A 149 34.068 -1.496 -24.497 1.00 0.00 N ATOM 362 CA TYR A 149 33.863 -1.076 -23.116 1.00 0.00 C ATOM 363 C TYR A 149 32.542 -1.614 -22.573 1.00 0.00 C ATOM 364 O TYR A 149 32.462 -2.051 -21.425 1.00 0.00 O ATOM 365 CB TYR A 149 33.884 0.450 -23.016 1.00 0.00 C ATOM 366 CG TYR A 149 35.219 1.010 -22.581 1.00 0.00 C ATOM 367 CD1 TYR A 149 35.834 0.569 -21.415 1.00 0.00 C ATOM 368 CD2 TYR A 149 35.868 1.980 -23.336 1.00 0.00 C ATOM 369 CE1 TYR A 149 37.053 1.078 -21.014 1.00 0.00 C ATOM 370 CE2 TYR A 149 37.088 2.494 -22.943 1.00 0.00 C ATOM 371 CZ TYR A 149 37.677 2.040 -21.781 1.00 0.00 C ATOM 372 OH TYR A 149 38.892 2.549 -21.385 1.00 0.00 O ATOM 0 H TYR A 149 33.921 -0.760 -25.188 1.00 0.00 H new ATOM 0 HA TYR A 149 34.676 -1.484 -22.515 1.00 0.00 H new ATOM 0 HB2 TYR A 149 33.621 0.873 -23.985 1.00 0.00 H new ATOM 0 HB3 TYR A 149 33.118 0.770 -22.310 1.00 0.00 H new ATOM 0 HD1 TYR A 149 35.350 -0.185 -20.812 1.00 0.00 H new ATOM 0 HD2 TYR A 149 35.410 2.338 -24.246 1.00 0.00 H new ATOM 0 HE1 TYR A 149 37.516 0.725 -20.104 1.00 0.00 H new ATOM 0 HE2 TYR A 149 37.578 3.247 -23.542 1.00 0.00 H new ATOM 0 HH TYR A 149 39.195 3.216 -22.036 1.00 0.00 H new ATOM 382 N TYR A 150 31.509 -1.579 -23.407 1.00 0.00 N ATOM 383 CA TYR A 150 30.191 -2.061 -23.012 1.00 0.00 C ATOM 384 C TYR A 150 30.260 -3.510 -22.541 1.00 0.00 C ATOM 385 O TYR A 150 29.429 -3.957 -21.749 1.00 0.00 O ATOM 386 CB TYR A 150 29.210 -1.938 -24.179 1.00 0.00 C ATOM 387 CG TYR A 150 27.879 -2.609 -23.924 1.00 0.00 C ATOM 388 CD1 TYR A 150 27.689 -3.954 -24.216 1.00 0.00 C ATOM 389 CD2 TYR A 150 26.811 -1.897 -23.391 1.00 0.00 C ATOM 390 CE1 TYR A 150 26.475 -4.571 -23.985 1.00 0.00 C ATOM 391 CE2 TYR A 150 25.593 -2.506 -23.155 1.00 0.00 C ATOM 392 CZ TYR A 150 25.430 -3.843 -23.454 1.00 0.00 C ATOM 393 OH TYR A 150 24.219 -4.453 -23.222 1.00 0.00 O ATOM 0 H TYR A 150 31.559 -1.222 -24.361 1.00 0.00 H new ATOM 0 HA TYR A 150 29.839 -1.445 -22.184 1.00 0.00 H new ATOM 0 HB2 TYR A 150 29.041 -0.882 -24.391 1.00 0.00 H new ATOM 0 HB3 TYR A 150 29.662 -2.373 -25.070 1.00 0.00 H new ATOM 0 HD1 TYR A 150 28.505 -4.527 -24.631 1.00 0.00 H new ATOM 0 HD2 TYR A 150 26.935 -0.850 -23.157 1.00 0.00 H new ATOM 0 HE1 TYR A 150 26.344 -5.617 -24.219 1.00 0.00 H new ATOM 0 HE2 TYR A 150 24.774 -1.939 -22.739 1.00 0.00 H new ATOM 0 HH TYR A 150 23.674 -3.887 -22.636 1.00 0.00 H new ATOM 403 N ARG A 151 31.256 -4.239 -23.033 1.00 0.00 N ATOM 404 CA ARG A 151 31.435 -5.638 -22.663 1.00 0.00 C ATOM 405 C ARG A 151 31.959 -5.760 -21.235 1.00 0.00 C ATOM 406 O ARG A 151 31.665 -6.730 -20.538 1.00 0.00 O ATOM 407 CB ARG A 151 32.398 -6.325 -23.633 1.00 0.00 C ATOM 408 CG ARG A 151 32.147 -7.816 -23.786 1.00 0.00 C ATOM 409 CD ARG A 151 31.045 -8.095 -24.796 1.00 0.00 C ATOM 410 NE ARG A 151 31.535 -8.035 -26.171 1.00 0.00 N ATOM 411 CZ ARG A 151 30.785 -8.317 -27.231 1.00 0.00 C ATOM 412 NH1 ARG A 151 29.518 -8.675 -27.074 1.00 0.00 N ATOM 413 NH2 ARG A 151 31.302 -8.240 -28.450 1.00 0.00 N ATOM 0 H ARG A 151 31.952 -3.884 -23.689 1.00 0.00 H new ATOM 0 HA ARG A 151 30.464 -6.130 -22.718 1.00 0.00 H new ATOM 0 HB2 ARG A 151 32.317 -5.849 -24.610 1.00 0.00 H new ATOM 0 HB3 ARG A 151 33.420 -6.171 -23.287 1.00 0.00 H new ATOM 0 HG2 ARG A 151 33.066 -8.310 -24.103 1.00 0.00 H new ATOM 0 HG3 ARG A 151 31.873 -8.241 -22.820 1.00 0.00 H new ATOM 0 HD2 ARG A 151 30.619 -9.080 -24.605 1.00 0.00 H new ATOM 0 HD3 ARG A 151 30.242 -7.370 -24.665 1.00 0.00 H new ATOM 0 HE ARG A 151 32.505 -7.762 -26.326 1.00 0.00 H new ATOM 0 HH11 ARG A 151 29.117 -8.734 -26.138 1.00 0.00 H new ATOM 0 HH12 ARG A 151 28.944 -8.891 -27.889 1.00 0.00 H new ATOM 0 HH21 ARG A 151 32.276 -7.964 -28.574 1.00 0.00 H new ATOM 0 HH22 ARG A 151 30.726 -8.457 -29.263 1.00 0.00 H new ATOM 427 N GLU A 152 32.737 -4.771 -20.809 1.00 0.00 N ATOM 428 CA GLU A 152 33.303 -4.769 -19.466 1.00 0.00 C ATOM 429 C GLU A 152 32.384 -4.043 -18.488 1.00 0.00 C ATOM 430 O GLU A 152 32.519 -4.180 -17.273 1.00 0.00 O ATOM 431 CB GLU A 152 34.684 -4.109 -19.470 1.00 0.00 C ATOM 432 CG GLU A 152 35.662 -4.750 -20.441 1.00 0.00 C ATOM 433 CD GLU A 152 37.028 -4.980 -19.825 1.00 0.00 C ATOM 434 OE1 GLU A 152 37.518 -4.077 -19.115 1.00 0.00 O ATOM 435 OE2 GLU A 152 37.608 -6.062 -20.054 1.00 0.00 O ATOM 0 H GLU A 152 32.990 -3.961 -21.375 1.00 0.00 H new ATOM 0 HA GLU A 152 33.404 -5.805 -19.142 1.00 0.00 H new ATOM 0 HB2 GLU A 152 34.573 -3.055 -19.723 1.00 0.00 H new ATOM 0 HB3 GLU A 152 35.102 -4.154 -18.464 1.00 0.00 H new ATOM 0 HG2 GLU A 152 35.257 -5.702 -20.784 1.00 0.00 H new ATOM 0 HG3 GLU A 152 35.766 -4.113 -21.320 1.00 0.00 H new ATOM 442 N ASN A 153 31.448 -3.269 -19.029 1.00 0.00 N ATOM 443 CA ASN A 153 30.506 -2.520 -18.206 1.00 0.00 C ATOM 444 C ASN A 153 29.183 -3.267 -18.076 1.00 0.00 C ATOM 445 O ASN A 153 28.452 -3.091 -17.101 1.00 0.00 O ATOM 446 CB ASN A 153 30.265 -1.133 -18.805 1.00 0.00 C ATOM 447 CG ASN A 153 31.312 -0.125 -18.372 1.00 0.00 C ATOM 448 OD1 ASN A 153 31.412 0.216 -17.193 1.00 0.00 O ATOM 449 ND2 ASN A 153 32.101 0.355 -19.326 1.00 0.00 N ATOM 0 H ASN A 153 31.322 -3.144 -20.034 1.00 0.00 H new ATOM 0 HA ASN A 153 30.939 -2.409 -17.212 1.00 0.00 H new ATOM 0 HB2 ASN A 153 30.263 -1.206 -19.893 1.00 0.00 H new ATOM 0 HB3 ASN A 153 29.278 -0.778 -18.507 1.00 0.00 H new ATOM 0 HD21 ASN A 153 32.826 1.035 -19.095 1.00 0.00 H new ATOM 0 HD22 ASN A 153 31.982 0.044 -20.290 1.00 0.00 H new ATOM 456 N MET A 154 28.881 -4.102 -19.065 1.00 0.00 N ATOM 457 CA MET A 154 27.647 -4.878 -19.060 1.00 0.00 C ATOM 458 C MET A 154 27.488 -5.639 -17.747 1.00 0.00 C ATOM 459 O MET A 154 26.370 -5.902 -17.302 1.00 0.00 O ATOM 460 CB MET A 154 27.630 -5.858 -20.236 1.00 0.00 C ATOM 461 CG MET A 154 28.806 -6.820 -20.242 1.00 0.00 C ATOM 462 SD MET A 154 28.293 -8.544 -20.370 1.00 0.00 S ATOM 463 CE MET A 154 27.248 -8.479 -21.823 1.00 0.00 C ATOM 0 H MET A 154 29.474 -4.258 -19.880 1.00 0.00 H new ATOM 0 HA MET A 154 26.812 -4.185 -19.162 1.00 0.00 H new ATOM 0 HB2 MET A 154 26.703 -6.431 -20.208 1.00 0.00 H new ATOM 0 HB3 MET A 154 27.628 -5.294 -21.169 1.00 0.00 H new ATOM 0 HG2 MET A 154 29.464 -6.578 -21.077 1.00 0.00 H new ATOM 0 HG3 MET A 154 29.386 -6.684 -19.329 1.00 0.00 H new ATOM 0 HE1 MET A 154 27.299 -9.431 -22.351 1.00 0.00 H new ATOM 0 HE2 MET A 154 26.218 -8.285 -21.522 1.00 0.00 H new ATOM 0 HE3 MET A 154 27.590 -7.681 -22.482 1.00 0.00 H new ATOM 473 N HIS A 155 28.613 -5.990 -17.132 1.00 0.00 N ATOM 474 CA HIS A 155 28.597 -6.720 -15.869 1.00 0.00 C ATOM 475 C HIS A 155 27.756 -5.988 -14.828 1.00 0.00 C ATOM 476 O HIS A 155 27.213 -6.603 -13.910 1.00 0.00 O ATOM 477 CB HIS A 155 30.022 -6.910 -15.349 1.00 0.00 C ATOM 478 CG HIS A 155 30.571 -5.704 -14.651 1.00 0.00 C ATOM 479 ND1 HIS A 155 30.681 -4.418 -15.060 1.00 0.00 N flip ATOM 480 CD2 HIS A 155 31.089 -5.744 -13.374 1.00 0.00 C flip ATOM 481 CE1 HIS A 155 31.258 -3.712 -14.033 1.00 0.00 C flip ATOM 482 NE2 HIS A 155 31.493 -4.535 -13.027 1.00 0.00 N flip ATOM 0 H HIS A 155 29.546 -5.781 -17.487 1.00 0.00 H new ATOM 0 HA HIS A 155 28.150 -7.698 -16.048 1.00 0.00 H new ATOM 0 HB2 HIS A 155 30.039 -7.756 -14.662 1.00 0.00 H new ATOM 0 HB3 HIS A 155 30.674 -7.164 -16.185 1.00 0.00 H new ATOM 0 HD2 HIS A 155 31.154 -6.626 -12.754 1.00 0.00 H new ATOM 0 HE1 HIS A 155 31.483 -2.656 -14.046 1.00 0.00 H new ATOM 0 HE2 HIS A 155 31.915 -4.280 -12.134 1.00 0.00 H new ATOM 490 N ARG A 156 27.653 -4.671 -14.978 1.00 0.00 N ATOM 491 CA ARG A 156 26.880 -3.856 -14.049 1.00 0.00 C ATOM 492 C ARG A 156 25.668 -3.241 -14.745 1.00 0.00 C ATOM 493 O ARG A 156 25.031 -2.331 -14.214 1.00 0.00 O ATOM 494 CB ARG A 156 27.756 -2.751 -13.456 1.00 0.00 C ATOM 495 CG ARG A 156 27.357 -2.348 -12.046 1.00 0.00 C ATOM 496 CD ARG A 156 27.767 -3.401 -11.029 1.00 0.00 C ATOM 497 NE ARG A 156 26.620 -4.153 -10.526 1.00 0.00 N ATOM 498 CZ ARG A 156 26.693 -5.020 -9.523 1.00 0.00 C ATOM 499 NH1 ARG A 156 27.851 -5.244 -8.918 1.00 0.00 N ATOM 500 NH2 ARG A 156 25.605 -5.666 -9.122 1.00 0.00 N ATOM 0 H ARG A 156 28.095 -4.147 -15.733 1.00 0.00 H new ATOM 0 HA ARG A 156 26.527 -4.501 -13.245 1.00 0.00 H new ATOM 0 HB2 ARG A 156 28.793 -3.086 -13.449 1.00 0.00 H new ATOM 0 HB3 ARG A 156 27.708 -1.875 -14.103 1.00 0.00 H new ATOM 0 HG2 ARG A 156 27.823 -1.395 -11.793 1.00 0.00 H new ATOM 0 HG3 ARG A 156 26.278 -2.197 -12.001 1.00 0.00 H new ATOM 0 HD2 ARG A 156 28.479 -4.088 -11.486 1.00 0.00 H new ATOM 0 HD3 ARG A 156 28.279 -2.920 -10.195 1.00 0.00 H new ATOM 0 HE ARG A 156 25.714 -4.004 -10.969 1.00 0.00 H new ATOM 0 HH11 ARG A 156 28.690 -4.750 -9.223 1.00 0.00 H new ATOM 0 HH12 ARG A 156 27.903 -5.911 -8.148 1.00 0.00 H new ATOM 0 HH21 ARG A 156 24.712 -5.497 -9.584 1.00 0.00 H new ATOM 0 HH22 ARG A 156 25.662 -6.332 -8.351 1.00 0.00 H new ATOM 514 N TYR A 157 25.357 -3.744 -15.934 1.00 0.00 N ATOM 515 CA TYR A 157 24.225 -3.242 -16.704 1.00 0.00 C ATOM 516 C TYR A 157 22.957 -3.221 -15.855 1.00 0.00 C ATOM 517 O TYR A 157 22.810 -3.973 -14.892 1.00 0.00 O ATOM 518 CB TYR A 157 24.005 -4.105 -17.948 1.00 0.00 C ATOM 519 CG TYR A 157 23.208 -5.361 -17.680 1.00 0.00 C ATOM 520 CD1 TYR A 157 23.570 -6.233 -16.660 1.00 0.00 C ATOM 521 CD2 TYR A 157 22.094 -5.678 -18.448 1.00 0.00 C ATOM 522 CE1 TYR A 157 22.845 -7.383 -16.412 1.00 0.00 C ATOM 523 CE2 TYR A 157 21.362 -6.825 -18.206 1.00 0.00 C ATOM 524 CZ TYR A 157 21.742 -7.674 -17.188 1.00 0.00 C ATOM 525 OH TYR A 157 21.017 -8.818 -16.945 1.00 0.00 O ATOM 0 H TYR A 157 25.873 -4.499 -16.386 1.00 0.00 H new ATOM 0 HA TYR A 157 24.451 -2.222 -17.013 1.00 0.00 H new ATOM 0 HB2 TYR A 157 23.490 -3.513 -18.704 1.00 0.00 H new ATOM 0 HB3 TYR A 157 24.974 -4.381 -18.364 1.00 0.00 H new ATOM 0 HD1 TYR A 157 24.433 -6.008 -16.051 1.00 0.00 H new ATOM 0 HD2 TYR A 157 21.795 -5.017 -19.248 1.00 0.00 H new ATOM 0 HE1 TYR A 157 23.140 -8.050 -15.615 1.00 0.00 H new ATOM 0 HE2 TYR A 157 20.497 -7.055 -18.811 1.00 0.00 H new ATOM 0 HH TYR A 157 20.272 -8.874 -17.579 1.00 0.00 H new ATOM 535 N PRO A 158 22.017 -2.337 -16.222 1.00 0.00 N ATOM 536 CA PRO A 158 20.743 -2.195 -15.510 1.00 0.00 C ATOM 537 C PRO A 158 19.829 -3.399 -15.711 1.00 0.00 C ATOM 538 O PRO A 158 19.461 -3.729 -16.837 1.00 0.00 O ATOM 539 CB PRO A 158 20.124 -0.943 -16.136 1.00 0.00 C ATOM 540 CG PRO A 158 20.731 -0.860 -17.494 1.00 0.00 C ATOM 541 CD PRO A 158 22.124 -1.409 -17.360 1.00 0.00 C ATOM 0 HA PRO A 158 20.885 -2.123 -14.432 1.00 0.00 H new ATOM 0 HB2 PRO A 158 19.038 -1.023 -16.192 1.00 0.00 H new ATOM 0 HB3 PRO A 158 20.348 -0.054 -15.547 1.00 0.00 H new ATOM 0 HG2 PRO A 158 20.152 -1.436 -18.216 1.00 0.00 H new ATOM 0 HG3 PRO A 158 20.750 0.170 -17.850 1.00 0.00 H new ATOM 0 HD2 PRO A 158 22.443 -1.921 -18.268 1.00 0.00 H new ATOM 0 HD3 PRO A 158 22.850 -0.619 -17.168 1.00 0.00 H new ATOM 549 N ASN A 159 19.468 -4.052 -14.611 1.00 0.00 N ATOM 550 CA ASN A 159 18.596 -5.220 -14.668 1.00 0.00 C ATOM 551 C ASN A 159 17.363 -5.022 -13.792 1.00 0.00 C ATOM 552 O ASN A 159 16.795 -5.984 -13.277 1.00 0.00 O ATOM 553 CB ASN A 159 19.357 -6.471 -14.222 1.00 0.00 C ATOM 554 CG ASN A 159 18.770 -7.742 -14.804 1.00 0.00 C ATOM 555 OD1 ASN A 159 17.864 -7.697 -15.637 1.00 0.00 O ATOM 556 ND2 ASN A 159 19.286 -8.886 -14.368 1.00 0.00 N ATOM 0 H ASN A 159 19.765 -3.793 -13.670 1.00 0.00 H new ATOM 0 HA ASN A 159 18.269 -5.349 -15.700 1.00 0.00 H new ATOM 0 HB2 ASN A 159 20.401 -6.385 -14.523 1.00 0.00 H new ATOM 0 HB3 ASN A 159 19.343 -6.533 -13.134 1.00 0.00 H new ATOM 0 HD21 ASN A 159 18.932 -9.774 -14.724 1.00 0.00 H new ATOM 0 HD22 ASN A 159 20.036 -8.877 -13.677 1.00 0.00 H new ATOM 563 N GLN A 160 16.955 -3.768 -13.630 1.00 0.00 N ATOM 564 CA GLN A 160 15.789 -3.443 -12.817 1.00 0.00 C ATOM 565 C GLN A 160 15.338 -2.007 -13.059 1.00 0.00 C ATOM 566 O GLN A 160 16.161 -1.101 -13.190 1.00 0.00 O ATOM 567 CB GLN A 160 16.101 -3.649 -11.333 1.00 0.00 C ATOM 568 CG GLN A 160 15.277 -4.749 -10.684 1.00 0.00 C ATOM 569 CD GLN A 160 16.120 -5.930 -10.247 1.00 0.00 C ATOM 570 OE1 GLN A 160 17.002 -5.797 -9.397 1.00 0.00 O ATOM 571 NE2 GLN A 160 15.854 -7.095 -10.825 1.00 0.00 N ATOM 0 H GLN A 160 17.414 -2.960 -14.051 1.00 0.00 H new ATOM 0 HA GLN A 160 14.979 -4.112 -13.107 1.00 0.00 H new ATOM 0 HB2 GLN A 160 17.159 -3.886 -11.222 1.00 0.00 H new ATOM 0 HB3 GLN A 160 15.927 -2.714 -10.801 1.00 0.00 H new ATOM 0 HG2 GLN A 160 14.752 -4.342 -9.819 1.00 0.00 H new ATOM 0 HG3 GLN A 160 14.517 -5.091 -11.386 1.00 0.00 H new ATOM 0 HE21 GLN A 160 15.114 -7.160 -11.524 1.00 0.00 H new ATOM 0 HE22 GLN A 160 16.389 -7.925 -10.570 1.00 0.00 H new ATOM 580 N VAL A 161 14.026 -1.805 -13.118 1.00 0.00 N ATOM 581 CA VAL A 161 13.465 -0.478 -13.344 1.00 0.00 C ATOM 582 C VAL A 161 12.442 -0.123 -12.271 1.00 0.00 C ATOM 583 O VAL A 161 11.857 -1.005 -11.641 1.00 0.00 O ATOM 584 CB VAL A 161 12.797 -0.379 -14.728 1.00 0.00 C ATOM 585 CG1 VAL A 161 13.835 -0.503 -15.833 1.00 0.00 C ATOM 586 CG2 VAL A 161 11.719 -1.443 -14.876 1.00 0.00 C ATOM 0 H VAL A 161 13.331 -2.544 -13.012 1.00 0.00 H new ATOM 0 HA VAL A 161 14.294 0.228 -13.298 1.00 0.00 H new ATOM 0 HB VAL A 161 12.325 0.600 -14.815 1.00 0.00 H new ATOM 0 HG11 VAL A 161 13.344 -0.431 -16.803 1.00 0.00 H new ATOM 0 HG12 VAL A 161 14.567 0.299 -15.736 1.00 0.00 H new ATOM 0 HG13 VAL A 161 14.339 -1.466 -15.752 1.00 0.00 H new ATOM 0 HG21 VAL A 161 11.257 -1.359 -15.860 1.00 0.00 H new ATOM 0 HG22 VAL A 161 12.166 -2.431 -14.768 1.00 0.00 H new ATOM 0 HG23 VAL A 161 10.961 -1.302 -14.106 1.00 0.00 H new ATOM 596 N TYR A 162 12.231 1.172 -12.069 1.00 0.00 N ATOM 597 CA TYR A 162 11.279 1.644 -11.070 1.00 0.00 C ATOM 598 C TYR A 162 10.490 2.841 -11.592 1.00 0.00 C ATOM 599 O TYR A 162 11.063 3.795 -12.119 1.00 0.00 O ATOM 600 CB TYR A 162 12.008 2.023 -9.780 1.00 0.00 C ATOM 601 CG TYR A 162 12.956 0.955 -9.283 1.00 0.00 C ATOM 602 CD1 TYR A 162 14.282 0.929 -9.698 1.00 0.00 C ATOM 603 CD2 TYR A 162 12.526 -0.027 -8.399 1.00 0.00 C ATOM 604 CE1 TYR A 162 15.151 -0.046 -9.247 1.00 0.00 C ATOM 605 CE2 TYR A 162 13.389 -1.004 -7.943 1.00 0.00 C ATOM 606 CZ TYR A 162 14.700 -1.010 -8.370 1.00 0.00 C ATOM 607 OH TYR A 162 15.564 -1.982 -7.918 1.00 0.00 O ATOM 0 H TYR A 162 12.706 1.914 -12.583 1.00 0.00 H new ATOM 0 HA TYR A 162 10.580 0.835 -10.860 1.00 0.00 H new ATOM 0 HB2 TYR A 162 12.567 2.944 -9.946 1.00 0.00 H new ATOM 0 HB3 TYR A 162 11.271 2.232 -9.004 1.00 0.00 H new ATOM 0 HD1 TYR A 162 14.639 1.683 -10.384 1.00 0.00 H new ATOM 0 HD2 TYR A 162 11.500 -0.026 -8.063 1.00 0.00 H new ATOM 0 HE1 TYR A 162 16.178 -0.053 -9.580 1.00 0.00 H new ATOM 0 HE2 TYR A 162 13.039 -1.760 -7.255 1.00 0.00 H new ATOM 0 HH TYR A 162 15.089 -2.583 -7.306 1.00 0.00 H new ATOM 797 N ASN A 174 5.928 10.951 -23.133 1.00 0.00 N ATOM 798 CA ASN A 174 7.164 11.618 -22.740 1.00 0.00 C ATOM 799 C ASN A 174 7.704 11.039 -21.436 1.00 0.00 C ATOM 800 O ASN A 174 8.913 11.014 -21.208 1.00 0.00 O ATOM 801 CB ASN A 174 6.931 13.122 -22.586 1.00 0.00 C ATOM 802 CG ASN A 174 7.302 13.896 -23.836 1.00 0.00 C ATOM 803 OD1 ASN A 174 6.433 14.305 -24.607 1.00 0.00 O ATOM 804 ND2 ASN A 174 8.597 14.101 -24.042 1.00 0.00 N ATOM 0 HA ASN A 174 7.902 11.451 -23.524 1.00 0.00 H new ATOM 0 HB2 ASN A 174 5.883 13.302 -22.349 1.00 0.00 H new ATOM 0 HB3 ASN A 174 7.517 13.493 -21.745 1.00 0.00 H new ATOM 0 HD21 ASN A 174 8.907 14.616 -24.866 1.00 0.00 H new ATOM 0 HD22 ASN A 174 9.282 13.744 -23.376 1.00 0.00 H new ATOM 811 N PHE A 175 6.798 10.573 -20.582 1.00 0.00 N ATOM 812 CA PHE A 175 7.182 9.994 -19.300 1.00 0.00 C ATOM 813 C PHE A 175 8.118 8.806 -19.499 1.00 0.00 C ATOM 814 O PHE A 175 8.955 8.512 -18.645 1.00 0.00 O ATOM 815 CB PHE A 175 5.939 9.554 -18.523 1.00 0.00 C ATOM 816 CG PHE A 175 5.588 10.471 -17.386 1.00 0.00 C ATOM 817 CD1 PHE A 175 4.839 11.615 -17.607 1.00 0.00 C ATOM 818 CD2 PHE A 175 6.007 10.187 -16.096 1.00 0.00 C ATOM 819 CE1 PHE A 175 4.515 12.460 -16.562 1.00 0.00 C ATOM 820 CE2 PHE A 175 5.686 11.029 -15.047 1.00 0.00 C ATOM 821 CZ PHE A 175 4.938 12.166 -15.281 1.00 0.00 C ATOM 0 H PHE A 175 5.793 10.585 -20.755 1.00 0.00 H new ATOM 0 HA PHE A 175 7.709 10.757 -18.727 1.00 0.00 H new ATOM 0 HB2 PHE A 175 5.093 9.497 -19.208 1.00 0.00 H new ATOM 0 HB3 PHE A 175 6.101 8.549 -18.133 1.00 0.00 H new ATOM 0 HD1 PHE A 175 4.504 11.849 -18.607 1.00 0.00 H new ATOM 0 HD2 PHE A 175 6.591 9.298 -15.908 1.00 0.00 H new ATOM 0 HE1 PHE A 175 3.931 13.350 -16.747 1.00 0.00 H new ATOM 0 HE2 PHE A 175 6.020 10.798 -14.046 1.00 0.00 H new ATOM 0 HZ PHE A 175 4.684 12.824 -14.463 1.00 0.00 H new ATOM 831 N VAL A 176 7.970 8.126 -20.631 1.00 0.00 N ATOM 832 CA VAL A 176 8.802 6.970 -20.943 1.00 0.00 C ATOM 833 C VAL A 176 10.282 7.335 -20.917 1.00 0.00 C ATOM 834 O VAL A 176 11.116 6.560 -20.447 1.00 0.00 O ATOM 835 CB VAL A 176 8.454 6.384 -22.324 1.00 0.00 C ATOM 836 CG1 VAL A 176 9.222 5.094 -22.566 1.00 0.00 C ATOM 837 CG2 VAL A 176 6.955 6.152 -22.442 1.00 0.00 C ATOM 0 H VAL A 176 7.281 8.356 -21.348 1.00 0.00 H new ATOM 0 HA VAL A 176 8.602 6.220 -20.177 1.00 0.00 H new ATOM 0 HB VAL A 176 8.749 7.103 -23.089 1.00 0.00 H new ATOM 0 HG11 VAL A 176 8.963 4.695 -23.547 1.00 0.00 H new ATOM 0 HG12 VAL A 176 10.293 5.295 -22.527 1.00 0.00 H new ATOM 0 HG13 VAL A 176 8.962 4.366 -21.798 1.00 0.00 H new ATOM 0 HG21 VAL A 176 6.727 5.738 -23.424 1.00 0.00 H new ATOM 0 HG22 VAL A 176 6.633 5.453 -21.670 1.00 0.00 H new ATOM 0 HG23 VAL A 176 6.429 7.099 -22.317 1.00 0.00 H new ATOM 847 N HIS A 177 10.603 8.521 -21.424 1.00 0.00 N ATOM 848 CA HIS A 177 11.984 8.991 -21.458 1.00 0.00 C ATOM 849 C HIS A 177 12.489 9.293 -20.050 1.00 0.00 C ATOM 850 O HIS A 177 13.593 8.898 -19.679 1.00 0.00 O ATOM 851 CB HIS A 177 12.099 10.239 -22.333 1.00 0.00 C ATOM 852 CG HIS A 177 11.732 10.002 -23.766 1.00 0.00 C ATOM 853 ND1 HIS A 177 12.581 9.398 -24.669 1.00 0.00 N ATOM 854 CD2 HIS A 177 10.600 10.290 -24.449 1.00 0.00 C ATOM 855 CE1 HIS A 177 11.987 9.326 -25.847 1.00 0.00 C ATOM 856 NE2 HIS A 177 10.783 9.860 -25.740 1.00 0.00 N ATOM 0 H HIS A 177 9.926 9.175 -21.817 1.00 0.00 H new ATOM 0 HA HIS A 177 12.601 8.200 -21.885 1.00 0.00 H new ATOM 0 HB2 HIS A 177 11.455 11.019 -21.926 1.00 0.00 H new ATOM 0 HB3 HIS A 177 13.122 10.613 -22.286 1.00 0.00 H new ATOM 0 HD2 HIS A 177 9.717 10.769 -24.052 1.00 0.00 H new ATOM 0 HE1 HIS A 177 12.413 8.903 -26.745 1.00 0.00 H new ATOM 0 HE2 HIS A 177 10.101 9.940 -26.494 1.00 0.00 H new ATOM 864 N ASN A 178 11.673 9.998 -19.272 1.00 0.00 N ATOM 865 CA ASN A 178 12.039 10.355 -17.906 1.00 0.00 C ATOM 866 C ASN A 178 12.242 9.106 -17.054 1.00 0.00 C ATOM 867 O ASN A 178 13.154 9.046 -16.229 1.00 0.00 O ATOM 868 CB ASN A 178 10.959 11.241 -17.283 1.00 0.00 C ATOM 869 CG ASN A 178 11.050 12.680 -17.752 1.00 0.00 C ATOM 870 OD1 ASN A 178 11.488 13.560 -17.011 1.00 0.00 O ATOM 871 ND2 ASN A 178 10.635 12.926 -18.989 1.00 0.00 N ATOM 0 H ASN A 178 10.755 10.333 -19.564 1.00 0.00 H new ATOM 0 HA ASN A 178 12.978 10.907 -17.939 1.00 0.00 H new ATOM 0 HB2 ASN A 178 9.976 10.842 -17.533 1.00 0.00 H new ATOM 0 HB3 ASN A 178 11.049 11.209 -16.197 1.00 0.00 H new ATOM 0 HD21 ASN A 178 10.672 13.875 -19.360 1.00 0.00 H new ATOM 0 HD22 ASN A 178 10.279 12.166 -19.568 1.00 0.00 H new ATOM 878 N CYS A 179 11.387 8.110 -17.260 1.00 0.00 N ATOM 879 CA CYS A 179 11.471 6.862 -16.511 1.00 0.00 C ATOM 880 C CYS A 179 12.871 6.262 -16.610 1.00 0.00 C ATOM 881 O CYS A 179 13.324 5.561 -15.705 1.00 0.00 O ATOM 882 CB CYS A 179 10.437 5.860 -17.030 1.00 0.00 C ATOM 883 SG CYS A 179 8.964 5.698 -15.972 1.00 0.00 S ATOM 0 H CYS A 179 10.627 8.143 -17.940 1.00 0.00 H new ATOM 0 HA CYS A 179 11.261 7.081 -15.464 1.00 0.00 H new ATOM 0 HB2 CYS A 179 10.122 6.163 -18.029 1.00 0.00 H new ATOM 0 HB3 CYS A 179 10.910 4.883 -17.128 1.00 0.00 H new ATOM 0 HG CYS A 179 8.148 4.831 -16.494 1.00 0.00 H new ATOM 888 N VAL A 180 13.552 6.542 -17.717 1.00 0.00 N ATOM 889 CA VAL A 180 14.900 6.031 -17.935 1.00 0.00 C ATOM 890 C VAL A 180 15.904 6.724 -17.021 1.00 0.00 C ATOM 891 O VAL A 180 16.877 6.115 -16.577 1.00 0.00 O ATOM 892 CB VAL A 180 15.341 6.219 -19.399 1.00 0.00 C ATOM 893 CG1 VAL A 180 16.667 5.517 -19.651 1.00 0.00 C ATOM 894 CG2 VAL A 180 14.268 5.707 -20.348 1.00 0.00 C ATOM 0 H VAL A 180 13.192 7.120 -18.477 1.00 0.00 H new ATOM 0 HA VAL A 180 14.877 4.966 -17.704 1.00 0.00 H new ATOM 0 HB VAL A 180 15.480 7.284 -19.585 1.00 0.00 H new ATOM 0 HG11 VAL A 180 16.963 5.660 -20.690 1.00 0.00 H new ATOM 0 HG12 VAL A 180 17.431 5.935 -18.995 1.00 0.00 H new ATOM 0 HG13 VAL A 180 16.559 4.451 -19.448 1.00 0.00 H new ATOM 0 HG21 VAL A 180 14.596 5.848 -21.378 1.00 0.00 H new ATOM 0 HG22 VAL A 180 14.095 4.647 -20.164 1.00 0.00 H new ATOM 0 HG23 VAL A 180 13.343 6.259 -20.183 1.00 0.00 H new ATOM 904 N ASN A 181 15.660 8.000 -16.742 1.00 0.00 N ATOM 905 CA ASN A 181 16.544 8.776 -15.880 1.00 0.00 C ATOM 906 C ASN A 181 16.381 8.362 -14.420 1.00 0.00 C ATOM 907 O ASN A 181 17.312 8.481 -13.623 1.00 0.00 O ATOM 908 CB ASN A 181 16.256 10.271 -16.033 1.00 0.00 C ATOM 909 CG ASN A 181 17.521 11.108 -16.023 1.00 0.00 C ATOM 910 OD1 ASN A 181 18.434 10.864 -15.234 1.00 0.00 O ATOM 911 ND2 ASN A 181 17.580 12.100 -16.903 1.00 0.00 N ATOM 0 H ASN A 181 14.858 8.518 -17.100 1.00 0.00 H new ATOM 0 HA ASN A 181 17.572 8.578 -16.183 1.00 0.00 H new ATOM 0 HB2 ASN A 181 15.719 10.441 -16.966 1.00 0.00 H new ATOM 0 HB3 ASN A 181 15.602 10.597 -15.224 1.00 0.00 H new ATOM 0 HD21 ASN A 181 18.406 12.697 -16.944 1.00 0.00 H new ATOM 0 HD22 ASN A 181 16.799 12.266 -17.538 1.00 0.00 H new ATOM 918 N ILE A 182 15.192 7.876 -14.078 1.00 0.00 N ATOM 919 CA ILE A 182 14.908 7.443 -12.716 1.00 0.00 C ATOM 920 C ILE A 182 15.841 6.314 -12.292 1.00 0.00 C ATOM 921 O ILE A 182 16.366 6.311 -11.178 1.00 0.00 O ATOM 922 CB ILE A 182 13.449 6.973 -12.568 1.00 0.00 C ATOM 923 CG1 ILE A 182 12.486 8.094 -12.962 1.00 0.00 C ATOM 924 CG2 ILE A 182 13.183 6.515 -11.141 1.00 0.00 C ATOM 925 CD1 ILE A 182 12.644 9.347 -12.130 1.00 0.00 C ATOM 0 H ILE A 182 14.411 7.773 -14.725 1.00 0.00 H new ATOM 0 HA ILE A 182 15.070 8.306 -12.070 1.00 0.00 H new ATOM 0 HB ILE A 182 13.285 6.128 -13.237 1.00 0.00 H new ATOM 0 HG12 ILE A 182 12.641 8.343 -14.012 1.00 0.00 H new ATOM 0 HG13 ILE A 182 11.462 7.732 -12.868 1.00 0.00 H new ATOM 0 HG21 ILE A 182 12.148 6.186 -11.052 1.00 0.00 H new ATOM 0 HG22 ILE A 182 13.849 5.689 -10.894 1.00 0.00 H new ATOM 0 HG23 ILE A 182 13.361 7.342 -10.454 1.00 0.00 H new ATOM 0 HD11 ILE A 182 11.929 10.099 -12.465 1.00 0.00 H new ATOM 0 HD12 ILE A 182 12.460 9.113 -11.081 1.00 0.00 H new ATOM 0 HD13 ILE A 182 13.657 9.733 -12.243 1.00 0.00 H new ATOM 937 N THR A 183 16.045 5.354 -13.189 1.00 0.00 N ATOM 938 CA THR A 183 16.914 4.218 -12.909 1.00 0.00 C ATOM 939 C THR A 183 18.355 4.669 -12.698 1.00 0.00 C ATOM 940 O THR A 183 19.008 4.261 -11.737 1.00 0.00 O ATOM 941 CB THR A 183 16.874 3.185 -14.051 1.00 0.00 C ATOM 942 OG1 THR A 183 15.552 3.111 -14.598 1.00 0.00 O ATOM 943 CG2 THR A 183 17.299 1.812 -13.553 1.00 0.00 C ATOM 0 H THR A 183 15.620 5.341 -14.116 1.00 0.00 H new ATOM 0 HA THR A 183 16.543 3.753 -11.996 1.00 0.00 H new ATOM 0 HB THR A 183 17.571 3.505 -14.826 1.00 0.00 H new ATOM 0 HG1 THR A 183 15.390 2.207 -14.941 1.00 0.00 H new ATOM 0 HG21 THR A 183 17.263 1.099 -14.377 1.00 0.00 H new ATOM 0 HG22 THR A 183 18.316 1.865 -13.163 1.00 0.00 H new ATOM 0 HG23 THR A 183 16.623 1.487 -12.762 1.00 0.00 H new ATOM 951 N ILE A 184 18.845 5.511 -13.601 1.00 0.00 N ATOM 952 CA ILE A 184 20.209 6.018 -13.512 1.00 0.00 C ATOM 953 C ILE A 184 20.433 6.765 -12.201 1.00 0.00 C ATOM 954 O ILE A 184 21.481 6.631 -11.568 1.00 0.00 O ATOM 955 CB ILE A 184 20.539 6.956 -14.687 1.00 0.00 C ATOM 956 CG1 ILE A 184 20.305 6.242 -16.020 1.00 0.00 C ATOM 957 CG2 ILE A 184 21.977 7.445 -14.587 1.00 0.00 C ATOM 958 CD1 ILE A 184 21.124 4.981 -16.182 1.00 0.00 C ATOM 0 H ILE A 184 18.318 5.857 -14.403 1.00 0.00 H new ATOM 0 HA ILE A 184 20.871 5.153 -13.552 1.00 0.00 H new ATOM 0 HB ILE A 184 19.877 7.821 -14.639 1.00 0.00 H new ATOM 0 HG12 ILE A 184 19.248 5.993 -16.109 1.00 0.00 H new ATOM 0 HG13 ILE A 184 20.541 6.926 -16.835 1.00 0.00 H new ATOM 0 HG21 ILE A 184 22.195 8.107 -15.425 1.00 0.00 H new ATOM 0 HG22 ILE A 184 22.113 7.987 -13.651 1.00 0.00 H new ATOM 0 HG23 ILE A 184 22.654 6.591 -14.613 1.00 0.00 H new ATOM 0 HD11 ILE A 184 20.907 4.528 -17.149 1.00 0.00 H new ATOM 0 HD12 ILE A 184 22.185 5.226 -16.126 1.00 0.00 H new ATOM 0 HD13 ILE A 184 20.871 4.279 -15.388 1.00 0.00 H new ATOM 970 N LYS A 185 19.441 7.551 -11.797 1.00 0.00 N ATOM 971 CA LYS A 185 19.526 8.317 -10.560 1.00 0.00 C ATOM 972 C LYS A 185 19.848 7.409 -9.378 1.00 0.00 C ATOM 973 O LYS A 185 20.906 7.529 -8.761 1.00 0.00 O ATOM 974 CB LYS A 185 18.213 9.059 -10.304 1.00 0.00 C ATOM 975 CG LYS A 185 18.334 10.174 -9.280 1.00 0.00 C ATOM 976 CD LYS A 185 17.276 10.053 -8.195 1.00 0.00 C ATOM 977 CE LYS A 185 17.813 10.491 -6.841 1.00 0.00 C ATOM 978 NZ LYS A 185 17.873 11.974 -6.723 1.00 0.00 N ATOM 0 H LYS A 185 18.568 7.674 -12.309 1.00 0.00 H new ATOM 0 HA LYS A 185 20.332 9.043 -10.667 1.00 0.00 H new ATOM 0 HB2 LYS A 185 17.853 9.478 -11.244 1.00 0.00 H new ATOM 0 HB3 LYS A 185 17.462 8.345 -9.965 1.00 0.00 H new ATOM 0 HG2 LYS A 185 19.325 10.147 -8.827 1.00 0.00 H new ATOM 0 HG3 LYS A 185 18.237 11.139 -9.778 1.00 0.00 H new ATOM 0 HD2 LYS A 185 16.411 10.662 -8.459 1.00 0.00 H new ATOM 0 HD3 LYS A 185 16.932 9.020 -8.134 1.00 0.00 H new ATOM 0 HE2 LYS A 185 17.179 10.089 -6.051 1.00 0.00 H new ATOM 0 HE3 LYS A 185 18.809 10.074 -6.693 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 18.244 12.233 -5.787 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 18.498 12.356 -7.461 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 16.919 12.370 -6.839 1.00 0.00 H new ATOM 992 N GLN A 186 18.929 6.499 -9.069 1.00 0.00 N ATOM 993 CA GLN A 186 19.117 5.570 -7.961 1.00 0.00 C ATOM 994 C GLN A 186 20.383 4.743 -8.153 1.00 0.00 C ATOM 995 O GLN A 186 20.983 4.273 -7.185 1.00 0.00 O ATOM 996 CB GLN A 186 17.904 4.646 -7.833 1.00 0.00 C ATOM 997 CG GLN A 186 16.896 5.106 -6.792 1.00 0.00 C ATOM 998 CD GLN A 186 15.465 4.997 -7.278 1.00 0.00 C ATOM 999 OE1 GLN A 186 14.637 4.326 -6.662 1.00 0.00 O ATOM 1000 NE2 GLN A 186 15.165 5.660 -8.389 1.00 0.00 N ATOM 0 H GLN A 186 18.048 6.386 -9.570 1.00 0.00 H new ATOM 0 HA GLN A 186 19.221 6.152 -7.045 1.00 0.00 H new ATOM 0 HB2 GLN A 186 17.408 4.575 -8.801 1.00 0.00 H new ATOM 0 HB3 GLN A 186 18.247 3.644 -7.577 1.00 0.00 H new ATOM 0 HG2 GLN A 186 17.015 4.509 -5.888 1.00 0.00 H new ATOM 0 HG3 GLN A 186 17.106 6.141 -6.521 1.00 0.00 H new ATOM 0 HE21 GLN A 186 15.883 6.204 -8.868 1.00 0.00 H new ATOM 0 HE22 GLN A 186 14.217 5.625 -8.763 1.00 0.00 H new ATOM 1009 N HIS A 187 20.786 4.568 -9.408 1.00 0.00 N ATOM 1010 CA HIS A 187 21.983 3.797 -9.727 1.00 0.00 C ATOM 1011 C HIS A 187 23.186 4.314 -8.945 1.00 0.00 C ATOM 1012 O HIS A 187 24.110 3.561 -8.635 1.00 0.00 O ATOM 1013 CB HIS A 187 22.270 3.858 -11.227 1.00 0.00 C ATOM 1014 CG HIS A 187 22.699 2.547 -11.809 1.00 0.00 C ATOM 1015 ND1 HIS A 187 21.859 1.458 -11.912 1.00 0.00 N ATOM 1016 CD2 HIS A 187 23.888 2.152 -12.322 1.00 0.00 C ATOM 1017 CE1 HIS A 187 22.512 0.450 -12.461 1.00 0.00 C ATOM 1018 NE2 HIS A 187 23.746 0.846 -12.721 1.00 0.00 N ATOM 0 H HIS A 187 20.301 4.950 -10.220 1.00 0.00 H new ATOM 0 HA HIS A 187 21.805 2.760 -9.441 1.00 0.00 H new ATOM 0 HB2 HIS A 187 21.375 4.201 -11.746 1.00 0.00 H new ATOM 0 HB3 HIS A 187 23.048 4.599 -11.410 1.00 0.00 H new ATOM 0 HD2 HIS A 187 24.782 2.753 -12.402 1.00 0.00 H new ATOM 0 HE1 HIS A 187 22.107 -0.531 -12.663 1.00 0.00 H new ATOM 0 HE2 HIS A 187 24.474 0.274 -13.149 1.00 0.00 H new ATOM 1026 N THR A 188 23.171 5.605 -8.629 1.00 0.00 N ATOM 1027 CA THR A 188 24.261 6.224 -7.885 1.00 0.00 C ATOM 1028 C THR A 188 24.518 5.490 -6.574 1.00 0.00 C ATOM 1029 O THR A 188 25.647 5.448 -6.085 1.00 0.00 O ATOM 1030 CB THR A 188 23.965 7.705 -7.582 1.00 0.00 C ATOM 1031 OG1 THR A 188 25.133 8.338 -7.046 1.00 0.00 O ATOM 1032 CG2 THR A 188 22.813 7.836 -6.597 1.00 0.00 C ATOM 0 H THR A 188 22.415 6.243 -8.877 1.00 0.00 H new ATOM 0 HA THR A 188 25.149 6.160 -8.514 1.00 0.00 H new ATOM 0 HB THR A 188 23.682 8.195 -8.514 1.00 0.00 H new ATOM 0 HG1 THR A 188 24.937 9.280 -6.857 1.00 0.00 H new ATOM 0 HG21 THR A 188 22.622 8.891 -6.398 1.00 0.00 H new ATOM 0 HG22 THR A 188 21.919 7.379 -7.020 1.00 0.00 H new ATOM 0 HG23 THR A 188 23.072 7.332 -5.666 1.00 0.00 H new ATOM 1040 N VAL A 189 23.463 4.911 -6.008 1.00 0.00 N ATOM 1041 CA VAL A 189 23.575 4.177 -4.754 1.00 0.00 C ATOM 1042 C VAL A 189 24.379 2.895 -4.937 1.00 0.00 C ATOM 1043 O VAL A 189 25.204 2.540 -4.094 1.00 0.00 O ATOM 1044 CB VAL A 189 22.188 3.823 -4.185 1.00 0.00 C ATOM 1045 CG1 VAL A 189 22.326 3.061 -2.876 1.00 0.00 C ATOM 1046 CG2 VAL A 189 21.354 5.081 -3.994 1.00 0.00 C ATOM 0 H VAL A 189 22.521 4.937 -6.399 1.00 0.00 H new ATOM 0 HA VAL A 189 24.093 4.830 -4.051 1.00 0.00 H new ATOM 0 HB VAL A 189 21.675 3.179 -4.900 1.00 0.00 H new ATOM 0 HG11 VAL A 189 21.336 2.820 -2.489 1.00 0.00 H new ATOM 0 HG12 VAL A 189 22.883 2.140 -3.048 1.00 0.00 H new ATOM 0 HG13 VAL A 189 22.858 3.677 -2.151 1.00 0.00 H new ATOM 0 HG21 VAL A 189 20.377 4.812 -3.591 1.00 0.00 H new ATOM 0 HG22 VAL A 189 21.861 5.752 -3.300 1.00 0.00 H new ATOM 0 HG23 VAL A 189 21.226 5.582 -4.954 1.00 0.00 H new ATOM 1056 N THR A 190 24.135 2.203 -6.045 1.00 0.00 N ATOM 1057 CA THR A 190 24.835 0.959 -6.340 1.00 0.00 C ATOM 1058 C THR A 190 26.267 1.228 -6.790 1.00 0.00 C ATOM 1059 O THR A 190 27.145 0.377 -6.646 1.00 0.00 O ATOM 1060 CB THR A 190 24.110 0.151 -7.432 1.00 0.00 C ATOM 1061 OG1 THR A 190 22.767 -0.131 -7.022 1.00 0.00 O ATOM 1062 CG2 THR A 190 24.842 -1.152 -7.718 1.00 0.00 C ATOM 0 H THR A 190 23.457 2.483 -6.754 1.00 0.00 H new ATOM 0 HA THR A 190 24.849 0.378 -5.418 1.00 0.00 H new ATOM 0 HB THR A 190 24.094 0.748 -8.344 1.00 0.00 H new ATOM 0 HG1 THR A 190 22.312 -0.644 -7.722 1.00 0.00 H new ATOM 0 HG21 THR A 190 24.311 -1.705 -8.493 1.00 0.00 H new ATOM 0 HG22 THR A 190 25.854 -0.934 -8.058 1.00 0.00 H new ATOM 0 HG23 THR A 190 24.886 -1.752 -6.809 1.00 0.00 H new ATOM 1070 N THR A 191 26.497 2.419 -7.335 1.00 0.00 N ATOM 1071 CA THR A 191 27.823 2.800 -7.807 1.00 0.00 C ATOM 1072 C THR A 191 28.860 2.669 -6.697 1.00 0.00 C ATOM 1073 O THR A 191 30.047 2.477 -6.961 1.00 0.00 O ATOM 1074 CB THR A 191 27.836 4.246 -8.338 1.00 0.00 C ATOM 1075 OG1 THR A 191 26.692 4.472 -9.170 1.00 0.00 O ATOM 1076 CG2 THR A 191 29.106 4.520 -9.128 1.00 0.00 C ATOM 0 H THR A 191 25.782 3.136 -7.460 1.00 0.00 H new ATOM 0 HA THR A 191 28.077 2.120 -8.620 1.00 0.00 H new ATOM 0 HB THR A 191 27.804 4.924 -7.485 1.00 0.00 H new ATOM 0 HG1 THR A 191 26.786 5.333 -9.628 1.00 0.00 H new ATOM 0 HG21 THR A 191 29.093 5.547 -9.493 1.00 0.00 H new ATOM 0 HG22 THR A 191 29.973 4.375 -8.484 1.00 0.00 H new ATOM 0 HG23 THR A 191 29.163 3.835 -9.974 1.00 0.00 H new ATOM 1084 N THR A 192 28.404 2.774 -5.452 1.00 0.00 N ATOM 1085 CA THR A 192 29.292 2.667 -4.302 1.00 0.00 C ATOM 1086 C THR A 192 30.062 1.352 -4.321 1.00 0.00 C ATOM 1087 O THR A 192 31.163 1.256 -3.778 1.00 0.00 O ATOM 1088 CB THR A 192 28.512 2.773 -2.978 1.00 0.00 C ATOM 1089 OG1 THR A 192 27.519 1.744 -2.911 1.00 0.00 O ATOM 1090 CG2 THR A 192 27.847 4.136 -2.849 1.00 0.00 C ATOM 0 H THR A 192 27.425 2.933 -5.215 1.00 0.00 H new ATOM 0 HA THR A 192 29.995 3.497 -4.368 1.00 0.00 H new ATOM 0 HB THR A 192 29.217 2.651 -2.156 1.00 0.00 H new ATOM 0 HG1 THR A 192 26.677 2.078 -3.284 1.00 0.00 H new ATOM 0 HG21 THR A 192 27.302 4.187 -1.906 1.00 0.00 H new ATOM 0 HG22 THR A 192 28.608 4.916 -2.871 1.00 0.00 H new ATOM 0 HG23 THR A 192 27.154 4.282 -3.677 1.00 0.00 H new ATOM 1098 N THR A 193 29.476 0.338 -4.950 1.00 0.00 N ATOM 1099 CA THR A 193 30.106 -0.973 -5.040 1.00 0.00 C ATOM 1100 C THR A 193 31.528 -0.864 -5.580 1.00 0.00 C ATOM 1101 O THR A 193 32.395 -1.671 -5.244 1.00 0.00 O ATOM 1102 CB THR A 193 29.298 -1.925 -5.942 1.00 0.00 C ATOM 1103 OG1 THR A 193 27.917 -1.903 -5.565 1.00 0.00 O ATOM 1104 CG2 THR A 193 29.833 -3.346 -5.846 1.00 0.00 C ATOM 0 H THR A 193 28.565 0.400 -5.405 1.00 0.00 H new ATOM 0 HA THR A 193 30.134 -1.380 -4.029 1.00 0.00 H new ATOM 0 HB THR A 193 29.398 -1.585 -6.973 1.00 0.00 H new ATOM 0 HG1 THR A 193 27.425 -1.300 -6.160 1.00 0.00 H new ATOM 0 HG21 THR A 193 29.247 -4.000 -6.492 1.00 0.00 H new ATOM 0 HG22 THR A 193 30.876 -3.364 -6.162 1.00 0.00 H new ATOM 0 HG23 THR A 193 29.760 -3.693 -4.815 1.00 0.00 H new ATOM 1112 N LYS A 194 31.761 0.140 -6.419 1.00 0.00 N ATOM 1113 CA LYS A 194 33.079 0.357 -7.004 1.00 0.00 C ATOM 1114 C LYS A 194 33.722 1.622 -6.444 1.00 0.00 C ATOM 1115 O LYS A 194 34.917 1.853 -6.622 1.00 0.00 O ATOM 1116 CB LYS A 194 32.972 0.458 -8.528 1.00 0.00 C ATOM 1117 CG LYS A 194 34.283 0.195 -9.248 1.00 0.00 C ATOM 1118 CD LYS A 194 34.379 0.990 -10.540 1.00 0.00 C ATOM 1119 CE LYS A 194 35.163 0.235 -11.602 1.00 0.00 C ATOM 1120 NZ LYS A 194 34.267 -0.522 -12.519 1.00 0.00 N ATOM 0 H LYS A 194 31.054 0.816 -6.709 1.00 0.00 H new ATOM 0 HA LYS A 194 33.709 -0.494 -6.745 1.00 0.00 H new ATOM 0 HB2 LYS A 194 32.225 -0.254 -8.879 1.00 0.00 H new ATOM 0 HB3 LYS A 194 32.614 1.453 -8.794 1.00 0.00 H new ATOM 0 HG2 LYS A 194 35.116 0.457 -8.596 1.00 0.00 H new ATOM 0 HG3 LYS A 194 34.372 -0.869 -9.467 1.00 0.00 H new ATOM 0 HD2 LYS A 194 33.377 1.206 -10.911 1.00 0.00 H new ATOM 0 HD3 LYS A 194 34.860 1.948 -10.344 1.00 0.00 H new ATOM 0 HE2 LYS A 194 35.763 0.938 -12.179 1.00 0.00 H new ATOM 0 HE3 LYS A 194 35.856 -0.455 -11.120 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 34.839 -1.023 -13.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 33.713 -1.211 -11.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 33.622 0.139 -12.998 1.00 0.00 H new ATOM 1134 N GLY A 195 32.920 2.437 -5.766 1.00 0.00 N ATOM 1135 CA GLY A 195 33.429 3.667 -5.189 1.00 0.00 C ATOM 1136 C GLY A 195 34.031 4.590 -6.230 1.00 0.00 C ATOM 1137 O GLY A 195 35.138 5.097 -6.053 1.00 0.00 O ATOM 0 H GLY A 195 31.927 2.267 -5.606 1.00 0.00 H new ATOM 0 HA2 GLY A 195 32.620 4.185 -4.673 1.00 0.00 H new ATOM 0 HA3 GLY A 195 34.184 3.428 -4.440 1.00 0.00 H new ATOM 1141 N GLU A 196 33.300 4.807 -7.319 1.00 0.00 N ATOM 1142 CA GLU A 196 33.770 5.674 -8.394 1.00 0.00 C ATOM 1143 C GLU A 196 32.613 6.455 -9.009 1.00 0.00 C ATOM 1144 O GLU A 196 31.462 6.302 -8.603 1.00 0.00 O ATOM 1145 CB GLU A 196 34.474 4.849 -9.473 1.00 0.00 C ATOM 1146 CG GLU A 196 35.990 4.919 -9.401 1.00 0.00 C ATOM 1147 CD GLU A 196 36.644 4.834 -10.766 1.00 0.00 C ATOM 1148 OE1 GLU A 196 36.467 3.802 -11.446 1.00 0.00 O ATOM 1149 OE2 GLU A 196 37.333 5.801 -11.155 1.00 0.00 O ATOM 0 H GLU A 196 32.381 4.395 -7.480 1.00 0.00 H new ATOM 0 HA GLU A 196 34.479 6.384 -7.969 1.00 0.00 H new ATOM 0 HB2 GLU A 196 34.162 3.808 -9.384 1.00 0.00 H new ATOM 0 HB3 GLU A 196 34.149 5.196 -10.454 1.00 0.00 H new ATOM 0 HG2 GLU A 196 36.284 5.851 -8.919 1.00 0.00 H new ATOM 0 HG3 GLU A 196 36.358 4.106 -8.775 1.00 0.00 H new ATOM 1156 N ASN A 197 32.928 7.292 -9.992 1.00 0.00 N ATOM 1157 CA ASN A 197 31.915 8.098 -10.663 1.00 0.00 C ATOM 1158 C ASN A 197 31.644 7.571 -12.069 1.00 0.00 C ATOM 1159 O ASN A 197 32.340 6.679 -12.554 1.00 0.00 O ATOM 1160 CB ASN A 197 32.360 9.561 -10.732 1.00 0.00 C ATOM 1161 CG ASN A 197 31.575 10.448 -9.784 1.00 0.00 C ATOM 1162 OD1 ASN A 197 31.120 11.528 -10.162 1.00 0.00 O ATOM 1163 ND2 ASN A 197 31.414 9.996 -8.546 1.00 0.00 N ATOM 0 H ASN A 197 33.876 7.430 -10.341 1.00 0.00 H new ATOM 0 HA ASN A 197 30.993 8.032 -10.085 1.00 0.00 H new ATOM 0 HB2 ASN A 197 33.421 9.627 -10.493 1.00 0.00 H new ATOM 0 HB3 ASN A 197 32.240 9.927 -11.752 1.00 0.00 H new ATOM 0 HD21 ASN A 197 30.896 10.550 -7.864 1.00 0.00 H new ATOM 0 HD22 ASN A 197 31.809 9.095 -8.277 1.00 0.00 H new ATOM 1170 N PHE A 198 30.629 8.130 -12.719 1.00 0.00 N ATOM 1171 CA PHE A 198 30.265 7.717 -14.070 1.00 0.00 C ATOM 1172 C PHE A 198 30.387 8.882 -15.047 1.00 0.00 C ATOM 1173 O PHE A 198 29.897 9.981 -14.785 1.00 0.00 O ATOM 1174 CB PHE A 198 28.838 7.166 -14.091 1.00 0.00 C ATOM 1175 CG PHE A 198 27.841 8.058 -13.408 1.00 0.00 C ATOM 1176 CD1 PHE A 198 27.593 7.931 -12.050 1.00 0.00 C ATOM 1177 CD2 PHE A 198 27.153 9.025 -14.123 1.00 0.00 C ATOM 1178 CE1 PHE A 198 26.676 8.750 -11.420 1.00 0.00 C ATOM 1179 CE2 PHE A 198 26.234 9.847 -13.498 1.00 0.00 C ATOM 1180 CZ PHE A 198 25.997 9.710 -12.144 1.00 0.00 C ATOM 0 H PHE A 198 30.044 8.870 -12.332 1.00 0.00 H new ATOM 0 HA PHE A 198 30.955 6.932 -14.381 1.00 0.00 H new ATOM 0 HB2 PHE A 198 28.530 7.016 -15.126 1.00 0.00 H new ATOM 0 HB3 PHE A 198 28.828 6.188 -13.610 1.00 0.00 H new ATOM 0 HD1 PHE A 198 28.123 7.183 -11.478 1.00 0.00 H new ATOM 0 HD2 PHE A 198 27.337 9.138 -15.181 1.00 0.00 H new ATOM 0 HE1 PHE A 198 26.490 8.639 -10.362 1.00 0.00 H new ATOM 0 HE2 PHE A 198 25.702 10.595 -14.067 1.00 0.00 H new ATOM 0 HZ PHE A 198 25.282 10.353 -11.652 1.00 0.00 H new ATOM 1190 N THR A 199 31.045 8.635 -16.175 1.00 0.00 N ATOM 1191 CA THR A 199 31.233 9.663 -17.191 1.00 0.00 C ATOM 1192 C THR A 199 30.019 9.760 -18.107 1.00 0.00 C ATOM 1193 O THR A 199 29.196 8.847 -18.160 1.00 0.00 O ATOM 1194 CB THR A 199 32.485 9.386 -18.045 1.00 0.00 C ATOM 1195 OG1 THR A 199 32.469 8.033 -18.514 1.00 0.00 O ATOM 1196 CG2 THR A 199 33.753 9.634 -17.242 1.00 0.00 C ATOM 0 H THR A 199 31.457 7.731 -16.408 1.00 0.00 H new ATOM 0 HA THR A 199 31.363 10.608 -16.664 1.00 0.00 H new ATOM 0 HB THR A 199 32.474 10.066 -18.897 1.00 0.00 H new ATOM 0 HG1 THR A 199 33.267 7.866 -19.057 1.00 0.00 H new ATOM 0 HG21 THR A 199 34.624 9.432 -17.866 1.00 0.00 H new ATOM 0 HG22 THR A 199 33.777 10.672 -16.911 1.00 0.00 H new ATOM 0 HG23 THR A 199 33.768 8.976 -16.373 1.00 0.00 H new ATOM 1204 N GLU A 200 29.914 10.872 -18.828 1.00 0.00 N ATOM 1205 CA GLU A 200 28.799 11.087 -19.742 1.00 0.00 C ATOM 1206 C GLU A 200 28.763 10.007 -20.820 1.00 0.00 C ATOM 1207 O GLU A 200 27.705 9.694 -21.368 1.00 0.00 O ATOM 1208 CB GLU A 200 28.902 12.468 -20.392 1.00 0.00 C ATOM 1209 CG GLU A 200 29.105 13.596 -19.395 1.00 0.00 C ATOM 1210 CD GLU A 200 28.215 14.791 -19.677 1.00 0.00 C ATOM 1211 OE1 GLU A 200 27.025 14.584 -19.993 1.00 0.00 O ATOM 1212 OE2 GLU A 200 28.710 15.934 -19.582 1.00 0.00 O ATOM 0 H GLU A 200 30.587 11.637 -18.797 1.00 0.00 H new ATOM 0 HA GLU A 200 27.875 11.033 -19.166 1.00 0.00 H new ATOM 0 HB2 GLU A 200 29.731 12.466 -21.100 1.00 0.00 H new ATOM 0 HB3 GLU A 200 27.994 12.659 -20.965 1.00 0.00 H new ATOM 0 HG2 GLU A 200 28.904 13.227 -18.389 1.00 0.00 H new ATOM 0 HG3 GLU A 200 30.148 13.911 -19.416 1.00 0.00 H new ATOM 1219 N THR A 201 29.927 9.440 -21.121 1.00 0.00 N ATOM 1220 CA THR A 201 30.031 8.397 -22.133 1.00 0.00 C ATOM 1221 C THR A 201 29.667 7.033 -21.557 1.00 0.00 C ATOM 1222 O THR A 201 28.977 6.241 -22.200 1.00 0.00 O ATOM 1223 CB THR A 201 31.451 8.328 -22.726 1.00 0.00 C ATOM 1224 OG1 THR A 201 31.910 9.645 -23.051 1.00 0.00 O ATOM 1225 CG2 THR A 201 31.475 7.455 -23.972 1.00 0.00 C ATOM 0 H THR A 201 30.812 9.686 -20.677 1.00 0.00 H new ATOM 0 HA THR A 201 29.327 8.654 -22.924 1.00 0.00 H new ATOM 0 HB THR A 201 32.112 7.887 -21.980 1.00 0.00 H new ATOM 0 HG1 THR A 201 32.814 9.593 -23.426 1.00 0.00 H new ATOM 0 HG21 THR A 201 32.488 7.421 -24.373 1.00 0.00 H new ATOM 0 HG22 THR A 201 31.152 6.446 -23.716 1.00 0.00 H new ATOM 0 HG23 THR A 201 30.802 7.872 -24.721 1.00 0.00 H new ATOM 1233 N ASP A 202 30.133 6.766 -20.342 1.00 0.00 N ATOM 1234 CA ASP A 202 29.855 5.497 -19.678 1.00 0.00 C ATOM 1235 C ASP A 202 28.382 5.397 -19.294 1.00 0.00 C ATOM 1236 O ASP A 202 27.759 4.347 -19.451 1.00 0.00 O ATOM 1237 CB ASP A 202 30.731 5.346 -18.434 1.00 0.00 C ATOM 1238 CG ASP A 202 30.525 4.014 -17.740 1.00 0.00 C ATOM 1239 OD1 ASP A 202 29.961 3.097 -18.372 1.00 0.00 O ATOM 1240 OD2 ASP A 202 30.927 3.889 -16.564 1.00 0.00 O ATOM 0 H ASP A 202 30.705 7.411 -19.797 1.00 0.00 H new ATOM 0 HA ASP A 202 30.086 4.691 -20.375 1.00 0.00 H new ATOM 0 HB2 ASP A 202 31.779 5.447 -18.716 1.00 0.00 H new ATOM 0 HB3 ASP A 202 30.509 6.154 -17.737 1.00 0.00 H new ATOM 1245 N VAL A 203 27.832 6.496 -18.788 1.00 0.00 N ATOM 1246 CA VAL A 203 26.432 6.532 -18.381 1.00 0.00 C ATOM 1247 C VAL A 203 25.506 6.360 -19.580 1.00 0.00 C ATOM 1248 O VAL A 203 24.420 5.791 -19.464 1.00 0.00 O ATOM 1249 CB VAL A 203 26.089 7.853 -17.667 1.00 0.00 C ATOM 1250 CG1 VAL A 203 26.282 9.034 -18.607 1.00 0.00 C ATOM 1251 CG2 VAL A 203 24.666 7.815 -17.131 1.00 0.00 C ATOM 0 H VAL A 203 28.334 7.373 -18.650 1.00 0.00 H new ATOM 0 HA VAL A 203 26.283 5.704 -17.689 1.00 0.00 H new ATOM 0 HB VAL A 203 26.768 7.976 -16.823 1.00 0.00 H new ATOM 0 HG11 VAL A 203 26.035 9.959 -18.085 1.00 0.00 H new ATOM 0 HG12 VAL A 203 27.320 9.070 -18.937 1.00 0.00 H new ATOM 0 HG13 VAL A 203 25.629 8.920 -19.473 1.00 0.00 H new ATOM 0 HG21 VAL A 203 24.441 8.756 -16.630 1.00 0.00 H new ATOM 0 HG22 VAL A 203 23.970 7.668 -17.957 1.00 0.00 H new ATOM 0 HG23 VAL A 203 24.566 6.993 -16.422 1.00 0.00 H new ATOM 1261 N LYS A 204 25.943 6.854 -20.733 1.00 0.00 N ATOM 1262 CA LYS A 204 25.155 6.754 -21.956 1.00 0.00 C ATOM 1263 C LYS A 204 25.075 5.308 -22.435 1.00 0.00 C ATOM 1264 O LYS A 204 24.047 4.872 -22.952 1.00 0.00 O ATOM 1265 CB LYS A 204 25.763 7.633 -23.052 1.00 0.00 C ATOM 1266 CG LYS A 204 25.176 9.033 -23.105 1.00 0.00 C ATOM 1267 CD LYS A 204 25.587 9.762 -24.373 1.00 0.00 C ATOM 1268 CE LYS A 204 25.341 11.259 -24.260 1.00 0.00 C ATOM 1269 NZ LYS A 204 25.218 11.903 -25.596 1.00 0.00 N ATOM 0 H LYS A 204 26.839 7.328 -20.847 1.00 0.00 H new ATOM 0 HA LYS A 204 24.145 7.102 -21.738 1.00 0.00 H new ATOM 0 HB2 LYS A 204 26.839 7.705 -22.893 1.00 0.00 H new ATOM 0 HB3 LYS A 204 25.615 7.149 -24.018 1.00 0.00 H new ATOM 0 HG2 LYS A 204 24.089 8.975 -23.054 1.00 0.00 H new ATOM 0 HG3 LYS A 204 25.506 9.600 -22.235 1.00 0.00 H new ATOM 0 HD2 LYS A 204 26.643 9.580 -24.573 1.00 0.00 H new ATOM 0 HD3 LYS A 204 25.029 9.363 -25.220 1.00 0.00 H new ATOM 0 HE2 LYS A 204 24.431 11.435 -23.687 1.00 0.00 H new ATOM 0 HE3 LYS A 204 26.160 11.721 -23.708 1.00 0.00 H new ATOM 0 HZ1 LYS A 204 25.051 12.922 -25.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 204 26.096 11.757 -26.134 1.00 0.00 H new ATOM 0 HZ3 LYS A 204 24.421 11.480 -26.113 1.00 0.00 H new ATOM 1283 N MET A 205 26.166 4.570 -22.258 1.00 0.00 N ATOM 1284 CA MET A 205 26.217 3.172 -22.670 1.00 0.00 C ATOM 1285 C MET A 205 25.153 2.352 -21.946 1.00 0.00 C ATOM 1286 O MET A 205 24.384 1.624 -22.573 1.00 0.00 O ATOM 1287 CB MET A 205 27.603 2.587 -22.394 1.00 0.00 C ATOM 1288 CG MET A 205 28.733 3.372 -23.040 1.00 0.00 C ATOM 1289 SD MET A 205 29.691 2.383 -24.203 1.00 0.00 S ATOM 1290 CE MET A 205 31.315 2.453 -23.451 1.00 0.00 C ATOM 0 H MET A 205 27.026 4.916 -21.832 1.00 0.00 H new ATOM 0 HA MET A 205 26.018 3.128 -23.741 1.00 0.00 H new ATOM 0 HB2 MET A 205 27.766 2.552 -21.317 1.00 0.00 H new ATOM 0 HB3 MET A 205 27.633 1.559 -22.755 1.00 0.00 H new ATOM 0 HG2 MET A 205 28.319 4.236 -23.559 1.00 0.00 H new ATOM 0 HG3 MET A 205 29.395 3.754 -22.263 1.00 0.00 H new ATOM 0 HE1 MET A 205 32.072 2.210 -24.197 1.00 0.00 H new ATOM 0 HE2 MET A 205 31.495 3.457 -23.066 1.00 0.00 H new ATOM 0 HE3 MET A 205 31.368 1.735 -22.632 1.00 0.00 H new ATOM 1300 N MET A 206 25.115 2.477 -20.624 1.00 0.00 N ATOM 1301 CA MET A 206 24.145 1.748 -19.815 1.00 0.00 C ATOM 1302 C MET A 206 22.743 2.319 -20.001 1.00 0.00 C ATOM 1303 O MET A 206 21.758 1.582 -20.004 1.00 0.00 O ATOM 1304 CB MET A 206 24.538 1.800 -18.338 1.00 0.00 C ATOM 1305 CG MET A 206 26.012 1.526 -18.091 1.00 0.00 C ATOM 1306 SD MET A 206 26.427 1.485 -16.336 1.00 0.00 S ATOM 1307 CE MET A 206 25.850 3.098 -15.814 1.00 0.00 C ATOM 0 H MET A 206 25.744 3.076 -20.090 1.00 0.00 H new ATOM 0 HA MET A 206 24.142 0.709 -20.146 1.00 0.00 H new ATOM 0 HB2 MET A 206 24.288 2.783 -17.938 1.00 0.00 H new ATOM 0 HB3 MET A 206 23.944 1.071 -17.787 1.00 0.00 H new ATOM 0 HG2 MET A 206 26.282 0.573 -18.546 1.00 0.00 H new ATOM 0 HG3 MET A 206 26.608 2.295 -18.583 1.00 0.00 H new ATOM 0 HE1 MET A 206 26.522 3.496 -15.054 1.00 0.00 H new ATOM 0 HE2 MET A 206 25.830 3.772 -16.670 1.00 0.00 H new ATOM 0 HE3 MET A 206 24.846 3.009 -15.399 1.00 0.00 H new ATOM 1317 N GLU A 207 22.662 3.637 -20.157 1.00 0.00 N ATOM 1318 CA GLU A 207 21.380 4.306 -20.343 1.00 0.00 C ATOM 1319 C GLU A 207 20.593 3.668 -21.484 1.00 0.00 C ATOM 1320 O GLU A 207 19.367 3.572 -21.429 1.00 0.00 O ATOM 1321 CB GLU A 207 21.593 5.795 -20.625 1.00 0.00 C ATOM 1322 CG GLU A 207 21.650 6.650 -19.370 1.00 0.00 C ATOM 1323 CD GLU A 207 20.455 7.575 -19.239 1.00 0.00 C ATOM 1324 OE1 GLU A 207 19.348 7.174 -19.655 1.00 0.00 O ATOM 1325 OE2 GLU A 207 20.627 8.697 -18.720 1.00 0.00 O ATOM 0 H GLU A 207 23.468 4.262 -20.158 1.00 0.00 H new ATOM 0 HA GLU A 207 20.805 4.196 -19.423 1.00 0.00 H new ATOM 0 HB2 GLU A 207 22.521 5.921 -21.183 1.00 0.00 H new ATOM 0 HB3 GLU A 207 20.786 6.154 -21.263 1.00 0.00 H new ATOM 0 HG2 GLU A 207 21.700 6.002 -18.495 1.00 0.00 H new ATOM 0 HG3 GLU A 207 22.564 7.243 -19.380 1.00 0.00 H new ATOM 1332 N ARG A 208 21.308 3.234 -22.517 1.00 0.00 N ATOM 1333 CA ARG A 208 20.678 2.607 -23.672 1.00 0.00 C ATOM 1334 C ARG A 208 19.927 1.343 -23.263 1.00 0.00 C ATOM 1335 O ARG A 208 18.897 1.004 -23.846 1.00 0.00 O ATOM 1336 CB ARG A 208 21.728 2.268 -24.731 1.00 0.00 C ATOM 1337 CG ARG A 208 21.591 3.081 -26.008 1.00 0.00 C ATOM 1338 CD ARG A 208 22.663 2.713 -27.022 1.00 0.00 C ATOM 1339 NE ARG A 208 22.096 2.095 -28.218 1.00 0.00 N ATOM 1340 CZ ARG A 208 21.554 2.786 -29.215 1.00 0.00 C ATOM 1341 NH1 ARG A 208 21.506 4.110 -29.159 1.00 0.00 N ATOM 1342 NH2 ARG A 208 21.059 2.152 -30.270 1.00 0.00 N ATOM 0 H ARG A 208 22.324 3.305 -22.577 1.00 0.00 H new ATOM 0 HA ARG A 208 19.963 3.314 -24.092 1.00 0.00 H new ATOM 0 HB2 ARG A 208 22.721 2.431 -24.311 1.00 0.00 H new ATOM 0 HB3 ARG A 208 21.656 1.208 -24.976 1.00 0.00 H new ATOM 0 HG2 ARG A 208 20.605 2.914 -26.443 1.00 0.00 H new ATOM 0 HG3 ARG A 208 21.660 4.143 -25.773 1.00 0.00 H new ATOM 0 HD2 ARG A 208 23.217 3.608 -27.304 1.00 0.00 H new ATOM 0 HD3 ARG A 208 23.376 2.028 -26.563 1.00 0.00 H new ATOM 0 HE ARG A 208 22.117 1.078 -28.292 1.00 0.00 H new ATOM 0 HH11 ARG A 208 21.886 4.600 -28.349 1.00 0.00 H new ATOM 0 HH12 ARG A 208 21.089 4.638 -29.926 1.00 0.00 H new ATOM 0 HH21 ARG A 208 21.094 1.134 -30.316 1.00 0.00 H new ATOM 0 HH22 ARG A 208 20.643 2.683 -31.035 1.00 0.00 H new ATOM 1356 N VAL A 209 20.450 0.651 -22.256 1.00 0.00 N ATOM 1357 CA VAL A 209 19.829 -0.575 -21.767 1.00 0.00 C ATOM 1358 C VAL A 209 18.599 -0.268 -20.920 1.00 0.00 C ATOM 1359 O VAL A 209 17.611 -1.002 -20.952 1.00 0.00 O ATOM 1360 CB VAL A 209 20.817 -1.411 -20.933 1.00 0.00 C ATOM 1361 CG1 VAL A 209 20.163 -2.702 -20.466 1.00 0.00 C ATOM 1362 CG2 VAL A 209 22.077 -1.702 -21.735 1.00 0.00 C ATOM 0 H VAL A 209 21.302 0.918 -21.763 1.00 0.00 H new ATOM 0 HA VAL A 209 19.529 -1.149 -22.644 1.00 0.00 H new ATOM 0 HB VAL A 209 21.099 -0.835 -20.051 1.00 0.00 H new ATOM 0 HG11 VAL A 209 20.877 -3.279 -19.878 1.00 0.00 H new ATOM 0 HG12 VAL A 209 19.293 -2.468 -19.853 1.00 0.00 H new ATOM 0 HG13 VAL A 209 19.850 -3.285 -21.332 1.00 0.00 H new ATOM 0 HG21 VAL A 209 22.764 -2.294 -21.131 1.00 0.00 H new ATOM 0 HG22 VAL A 209 21.815 -2.258 -22.635 1.00 0.00 H new ATOM 0 HG23 VAL A 209 22.555 -0.763 -22.014 1.00 0.00 H new ATOM 1372 N VAL A 210 18.666 0.822 -20.163 1.00 0.00 N ATOM 1373 CA VAL A 210 17.557 1.228 -19.308 1.00 0.00 C ATOM 1374 C VAL A 210 16.285 1.442 -20.121 1.00 0.00 C ATOM 1375 O VAL A 210 15.181 1.192 -19.641 1.00 0.00 O ATOM 1376 CB VAL A 210 17.885 2.522 -18.539 1.00 0.00 C ATOM 1377 CG1 VAL A 210 16.723 2.921 -17.643 1.00 0.00 C ATOM 1378 CG2 VAL A 210 19.160 2.350 -17.728 1.00 0.00 C ATOM 0 H VAL A 210 19.477 1.440 -20.124 1.00 0.00 H new ATOM 0 HA VAL A 210 17.397 0.420 -18.594 1.00 0.00 H new ATOM 0 HB VAL A 210 18.046 3.322 -19.261 1.00 0.00 H new ATOM 0 HG11 VAL A 210 16.974 3.837 -17.108 1.00 0.00 H new ATOM 0 HG12 VAL A 210 15.835 3.088 -18.252 1.00 0.00 H new ATOM 0 HG13 VAL A 210 16.527 2.124 -16.926 1.00 0.00 H new ATOM 0 HG21 VAL A 210 19.377 3.273 -17.191 1.00 0.00 H new ATOM 0 HG22 VAL A 210 19.030 1.537 -17.014 1.00 0.00 H new ATOM 0 HG23 VAL A 210 19.988 2.116 -18.397 1.00 0.00 H new ATOM 1388 N GLU A 211 16.450 1.906 -21.356 1.00 0.00 N ATOM 1389 CA GLU A 211 15.314 2.154 -22.236 1.00 0.00 C ATOM 1390 C GLU A 211 14.699 0.842 -22.712 1.00 0.00 C ATOM 1391 O GLU A 211 13.485 0.653 -22.641 1.00 0.00 O ATOM 1392 CB GLU A 211 15.747 2.994 -23.440 1.00 0.00 C ATOM 1393 CG GLU A 211 14.677 3.118 -24.512 1.00 0.00 C ATOM 1394 CD GLU A 211 14.841 4.366 -25.358 1.00 0.00 C ATOM 1395 OE1 GLU A 211 14.459 5.457 -24.887 1.00 0.00 O ATOM 1396 OE2 GLU A 211 15.353 4.250 -26.491 1.00 0.00 O ATOM 0 H GLU A 211 17.358 2.117 -21.769 1.00 0.00 H new ATOM 0 HA GLU A 211 14.562 2.704 -21.670 1.00 0.00 H new ATOM 0 HB2 GLU A 211 16.023 3.991 -23.096 1.00 0.00 H new ATOM 0 HB3 GLU A 211 16.640 2.550 -23.880 1.00 0.00 H new ATOM 0 HG2 GLU A 211 14.710 2.240 -25.157 1.00 0.00 H new ATOM 0 HG3 GLU A 211 13.695 3.130 -24.040 1.00 0.00 H new ATOM 1403 N GLN A 212 15.545 -0.060 -23.198 1.00 0.00 N ATOM 1404 CA GLN A 212 15.084 -1.354 -23.687 1.00 0.00 C ATOM 1405 C GLN A 212 14.235 -2.062 -22.636 1.00 0.00 C ATOM 1406 O GLN A 212 13.313 -2.807 -22.968 1.00 0.00 O ATOM 1407 CB GLN A 212 16.276 -2.232 -24.072 1.00 0.00 C ATOM 1408 CG GLN A 212 16.187 -2.795 -25.481 1.00 0.00 C ATOM 1409 CD GLN A 212 16.372 -1.733 -26.547 1.00 0.00 C ATOM 1410 OE1 GLN A 212 15.961 -0.585 -26.373 1.00 0.00 O ATOM 1411 NE2 GLN A 212 16.993 -2.111 -27.658 1.00 0.00 N ATOM 0 H GLN A 212 16.553 0.081 -23.264 1.00 0.00 H new ATOM 0 HA GLN A 212 14.468 -1.182 -24.570 1.00 0.00 H new ATOM 0 HB2 GLN A 212 17.192 -1.648 -23.980 1.00 0.00 H new ATOM 0 HB3 GLN A 212 16.352 -3.057 -23.364 1.00 0.00 H new ATOM 0 HG2 GLN A 212 16.945 -3.568 -25.608 1.00 0.00 H new ATOM 0 HG3 GLN A 212 15.218 -3.275 -25.616 1.00 0.00 H new ATOM 0 HE21 GLN A 212 17.317 -3.073 -27.759 1.00 0.00 H new ATOM 0 HE22 GLN A 212 17.146 -1.439 -28.410 1.00 0.00 H new ATOM 1420 N MET A 213 14.552 -1.824 -21.368 1.00 0.00 N ATOM 1421 CA MET A 213 13.817 -2.439 -20.268 1.00 0.00 C ATOM 1422 C MET A 213 12.419 -1.841 -20.148 1.00 0.00 C ATOM 1423 O MET A 213 11.440 -2.560 -19.941 1.00 0.00 O ATOM 1424 CB MET A 213 14.577 -2.257 -18.953 1.00 0.00 C ATOM 1425 CG MET A 213 14.712 -3.538 -18.147 1.00 0.00 C ATOM 1426 SD MET A 213 16.419 -3.892 -17.686 1.00 0.00 S ATOM 1427 CE MET A 213 16.915 -2.318 -16.990 1.00 0.00 C ATOM 0 H MET A 213 15.312 -1.210 -21.076 1.00 0.00 H new ATOM 0 HA MET A 213 13.721 -3.504 -20.479 1.00 0.00 H new ATOM 0 HB2 MET A 213 15.572 -1.867 -19.169 1.00 0.00 H new ATOM 0 HB3 MET A 213 14.065 -1.509 -18.348 1.00 0.00 H new ATOM 0 HG2 MET A 213 14.105 -3.461 -17.245 1.00 0.00 H new ATOM 0 HG3 MET A 213 14.316 -4.371 -18.728 1.00 0.00 H new ATOM 0 HE1 MET A 213 17.745 -1.910 -17.567 1.00 0.00 H new ATOM 0 HE2 MET A 213 16.075 -1.625 -17.023 1.00 0.00 H new ATOM 0 HE3 MET A 213 17.228 -2.460 -15.956 1.00 0.00 H new ATOM 1437 N CYS A 214 12.331 -0.521 -20.278 1.00 0.00 N ATOM 1438 CA CYS A 214 11.053 0.174 -20.183 1.00 0.00 C ATOM 1439 C CYS A 214 10.038 -0.418 -21.158 1.00 0.00 C ATOM 1440 O CYS A 214 8.855 -0.541 -20.839 1.00 0.00 O ATOM 1441 CB CYS A 214 11.238 1.666 -20.466 1.00 0.00 C ATOM 1442 SG CYS A 214 11.959 2.602 -19.079 1.00 0.00 S ATOM 0 H CYS A 214 13.130 0.089 -20.450 1.00 0.00 H new ATOM 0 HA CYS A 214 10.673 0.048 -19.169 1.00 0.00 H new ATOM 0 HB2 CYS A 214 11.878 1.782 -21.341 1.00 0.00 H new ATOM 0 HB3 CYS A 214 10.271 2.100 -20.719 1.00 0.00 H new ATOM 0 HG CYS A 214 13.223 2.316 -18.973 1.00 0.00 H new ATOM 1447 N ILE A 215 10.510 -0.782 -22.345 1.00 0.00 N ATOM 1448 CA ILE A 215 9.645 -1.361 -23.365 1.00 0.00 C ATOM 1449 C ILE A 215 9.310 -2.813 -23.042 1.00 0.00 C ATOM 1450 O ILE A 215 8.213 -3.290 -23.335 1.00 0.00 O ATOM 1451 CB ILE A 215 10.295 -1.294 -24.760 1.00 0.00 C ATOM 1452 CG1 ILE A 215 10.662 0.150 -25.106 1.00 0.00 C ATOM 1453 CG2 ILE A 215 9.359 -1.875 -25.809 1.00 0.00 C ATOM 1454 CD1 ILE A 215 9.468 1.074 -25.188 1.00 0.00 C ATOM 0 H ILE A 215 11.486 -0.686 -22.624 1.00 0.00 H new ATOM 0 HA ILE A 215 8.728 -0.772 -23.372 1.00 0.00 H new ATOM 0 HB ILE A 215 11.209 -1.888 -24.748 1.00 0.00 H new ATOM 0 HG12 ILE A 215 11.354 0.530 -24.355 1.00 0.00 H new ATOM 0 HG13 ILE A 215 11.188 0.164 -26.061 1.00 0.00 H new ATOM 0 HG21 ILE A 215 9.832 -1.820 -26.789 1.00 0.00 H new ATOM 0 HG22 ILE A 215 9.143 -2.916 -25.568 1.00 0.00 H new ATOM 0 HG23 ILE A 215 8.430 -1.306 -25.823 1.00 0.00 H new ATOM 0 HD11 ILE A 215 9.803 2.081 -25.437 1.00 0.00 H new ATOM 0 HD12 ILE A 215 8.785 0.718 -25.959 1.00 0.00 H new ATOM 0 HD13 ILE A 215 8.954 1.090 -24.227 1.00 0.00 H new ATOM 1466 N THR A 216 10.263 -3.513 -22.434 1.00 0.00 N ATOM 1467 CA THR A 216 10.070 -4.911 -22.069 1.00 0.00 C ATOM 1468 C THR A 216 8.972 -5.060 -21.022 1.00 0.00 C ATOM 1469 O THR A 216 8.135 -5.958 -21.111 1.00 0.00 O ATOM 1470 CB THR A 216 11.369 -5.535 -21.526 1.00 0.00 C ATOM 1471 OG1 THR A 216 12.430 -5.357 -22.472 1.00 0.00 O ATOM 1472 CG2 THR A 216 11.180 -7.017 -21.241 1.00 0.00 C ATOM 0 H THR A 216 11.176 -3.134 -22.184 1.00 0.00 H new ATOM 0 HA THR A 216 9.776 -5.436 -22.978 1.00 0.00 H new ATOM 0 HB THR A 216 11.626 -5.032 -20.593 1.00 0.00 H new ATOM 0 HG1 THR A 216 12.663 -4.407 -22.528 1.00 0.00 H new ATOM 0 HG21 THR A 216 12.111 -7.436 -20.859 1.00 0.00 H new ATOM 0 HG22 THR A 216 10.392 -7.147 -20.499 1.00 0.00 H new ATOM 0 HG23 THR A 216 10.902 -7.532 -22.161 1.00 0.00 H new ATOM 1480 N GLN A 217 8.981 -4.174 -20.032 1.00 0.00 N ATOM 1481 CA GLN A 217 7.985 -4.208 -18.967 1.00 0.00 C ATOM 1482 C GLN A 217 6.574 -4.238 -19.544 1.00 0.00 C ATOM 1483 O GLN A 217 5.677 -4.867 -18.982 1.00 0.00 O ATOM 1484 CB GLN A 217 8.148 -2.995 -18.049 1.00 0.00 C ATOM 1485 CG GLN A 217 9.337 -3.101 -17.107 1.00 0.00 C ATOM 1486 CD GLN A 217 8.951 -3.618 -15.736 1.00 0.00 C ATOM 1487 OE1 GLN A 217 7.822 -3.429 -15.283 1.00 0.00 O ATOM 1488 NE2 GLN A 217 9.890 -4.276 -15.065 1.00 0.00 N ATOM 0 H GLN A 217 9.667 -3.424 -19.945 1.00 0.00 H new ATOM 0 HA GLN A 217 8.140 -5.117 -18.386 1.00 0.00 H new ATOM 0 HB2 GLN A 217 8.258 -2.099 -18.660 1.00 0.00 H new ATOM 0 HB3 GLN A 217 7.239 -2.870 -17.461 1.00 0.00 H new ATOM 0 HG2 GLN A 217 10.084 -3.764 -17.544 1.00 0.00 H new ATOM 0 HG3 GLN A 217 9.802 -2.121 -17.004 1.00 0.00 H new ATOM 0 HE21 GLN A 217 10.813 -4.410 -15.478 1.00 0.00 H new ATOM 0 HE22 GLN A 217 9.688 -4.647 -14.137 1.00 0.00 H new ATOM 1497 N TYR A 218 6.384 -3.554 -20.667 1.00 0.00 N ATOM 1498 CA TYR A 218 5.080 -3.500 -21.317 1.00 0.00 C ATOM 1499 C TYR A 218 5.027 -4.449 -22.510 1.00 0.00 C ATOM 1500 O TYR A 218 5.799 -4.314 -23.460 1.00 0.00 O ATOM 1501 CB TYR A 218 4.773 -2.073 -21.774 1.00 0.00 C ATOM 1502 CG TYR A 218 4.680 -1.080 -20.636 1.00 0.00 C ATOM 1503 CD1 TYR A 218 3.897 -1.346 -19.520 1.00 0.00 C ATOM 1504 CD2 TYR A 218 5.374 0.122 -20.679 1.00 0.00 C ATOM 1505 CE1 TYR A 218 3.808 -0.442 -18.479 1.00 0.00 C ATOM 1506 CE2 TYR A 218 5.293 1.031 -19.642 1.00 0.00 C ATOM 1507 CZ TYR A 218 4.508 0.745 -18.544 1.00 0.00 C ATOM 1508 OH TYR A 218 4.423 1.648 -17.510 1.00 0.00 O ATOM 0 H TYR A 218 7.116 -3.030 -21.146 1.00 0.00 H new ATOM 0 HA TYR A 218 4.328 -3.812 -20.592 1.00 0.00 H new ATOM 0 HB2 TYR A 218 5.549 -1.747 -22.467 1.00 0.00 H new ATOM 0 HB3 TYR A 218 3.832 -2.071 -22.325 1.00 0.00 H new ATOM 0 HD1 TYR A 218 3.349 -2.275 -19.465 1.00 0.00 H new ATOM 0 HD2 TYR A 218 5.988 0.350 -21.538 1.00 0.00 H new ATOM 0 HE1 TYR A 218 3.194 -0.663 -17.619 1.00 0.00 H new ATOM 0 HE2 TYR A 218 5.841 1.960 -19.690 1.00 0.00 H new ATOM 0 HH TYR A 218 4.977 2.431 -17.713 1.00 0.00 H new