USER MOD reduce.3.24.130724 H: found=0, std=0, add=590, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 590 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 203 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 207 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 179 THR OG1 : rot 110:sc= 0.385 USER MOD Set 2.2: A 181 SER OG : rot 180:sc= 0.156 USER MOD Set 2.3: A 182 GLN : amide:sc= 0.309 X(o=0.85,f=0.4) USER MOD Set 3.1: A 162 TYR OH : rot -116:sc= 0.193 USER MOD Set 3.2: A 209 SER OG : rot 79:sc= 0.99 USER MOD Single : A 161 SER OG : rot 180:sc= 0 USER MOD Single : A 167 THR OG1 : rot 78:sc= 0.629 USER MOD Single : A 168 LYS NZ :NH3+ 157:sc= -0.0909 (180deg=-0.416) USER MOD Single : A 172 SER OG : rot 78:sc= 1.36 USER MOD Single : A 173 SER OG : rot -65:sc= 1.29 USER MOD Single : A 176 LYS NZ :NH3+ 152:sc= 1.04 (180deg=0.591) USER MOD Single : A 184 TYR OH : rot 180:sc= 0 USER MOD Single : A 187 MET CE :methyl -159:sc= 0 (180deg=-0.337) USER MOD Single : A 189 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 190 SER OG : rot 178:sc= 0.00493 USER MOD Single : A 193 TYR OH : rot 180:sc= 0 USER MOD Single : A 195 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0557) USER MOD Single : A 197 LYS NZ :NH3+ -161:sc= 1.27 (180deg=1.2) USER MOD Single : A 200 SER OG : rot 180:sc= 0 USER MOD Single : A 201 ASN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 202 SER OG : rot 170:sc= 0 USER MOD Single : A 208 ASN : amide:sc= -0.276 K(o=-0.28,f=-2.1!) USER MOD Single : A 212 HIS : no HD1:sc= -0.0536 X(o=-0.054,f=0) USER MOD Single : A 213 ASN : amide:sc= -0.285 K(o=-0.28,f=-0.89) USER MOD Single : A 215 SER OG : rot 180:sc= 0 USER MOD Single : A 217 HIS : no HE2:sc= -0.128 K(o=-0.13,f=-0.63) USER MOD Single : A 218 SER OG : rot 180:sc= 0.0115 USER MOD Single : A 219 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 224 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 232 SER OG : rot 26:sc= 0.271 USER MOD Single : A 235 MET CE :methyl -179:sc= -0.122 (180deg=-0.129) USER MOD Single : A 237 ASN : amide:sc= -0.671 K(o=-0.67,f=-3.6!) USER MOD ----------------------------------------------------------------- ATOM 116 N LEU A 160 -13.137 14.724 -1.727 1.00 0.00 N ATOM 117 CA LEU A 160 -13.653 15.489 -2.862 1.00 0.00 C ATOM 118 C LEU A 160 -15.146 15.185 -2.977 1.00 0.00 C ATOM 119 O LEU A 160 -15.552 14.020 -2.989 1.00 0.00 O ATOM 120 CB LEU A 160 -12.934 15.120 -4.172 1.00 0.00 C ATOM 121 CG LEU A 160 -11.586 15.793 -4.446 1.00 0.00 C ATOM 122 CD1 LEU A 160 -11.004 15.205 -5.735 1.00 0.00 C ATOM 123 CD2 LEU A 160 -11.661 17.311 -4.577 1.00 0.00 C ATOM 0 HA LEU A 160 -13.479 16.552 -2.696 1.00 0.00 H new ATOM 0 HB2 LEU A 160 -12.780 14.041 -4.180 1.00 0.00 H new ATOM 0 HB3 LEU A 160 -13.602 15.353 -5.001 1.00 0.00 H new ATOM 0 HG LEU A 160 -10.952 15.595 -3.582 1.00 0.00 H new ATOM 0 HD11 LEU A 160 -10.043 15.673 -5.947 1.00 0.00 H new ATOM 0 HD12 LEU A 160 -10.866 14.130 -5.615 1.00 0.00 H new ATOM 0 HD13 LEU A 160 -11.689 15.393 -6.562 1.00 0.00 H new ATOM 0 HD21 LEU A 160 -10.665 17.709 -4.770 1.00 0.00 H new ATOM 0 HD22 LEU A 160 -12.323 17.573 -5.403 1.00 0.00 H new ATOM 0 HD23 LEU A 160 -12.049 17.737 -3.652 1.00 0.00 H new ATOM 135 N SER A 161 -15.955 16.229 -3.047 1.00 0.00 N ATOM 136 CA SER A 161 -17.405 16.083 -3.107 1.00 0.00 C ATOM 137 C SER A 161 -17.840 15.645 -4.496 1.00 0.00 C ATOM 138 O SER A 161 -17.070 15.732 -5.451 1.00 0.00 O ATOM 139 CB SER A 161 -18.067 17.422 -2.776 1.00 0.00 C ATOM 140 OG SER A 161 -17.703 17.857 -1.481 1.00 0.00 O ATOM 0 H SER A 161 -15.631 17.196 -3.064 1.00 0.00 H new ATOM 0 HA SER A 161 -17.708 15.326 -2.384 1.00 0.00 H new ATOM 0 HB2 SER A 161 -17.772 18.170 -3.512 1.00 0.00 H new ATOM 0 HB3 SER A 161 -19.151 17.322 -2.840 1.00 0.00 H new ATOM 0 HG SER A 161 -18.136 18.715 -1.291 1.00 0.00 H new ATOM 146 N TYR A 162 -19.086 15.202 -4.624 1.00 0.00 N ATOM 147 CA TYR A 162 -19.625 14.814 -5.929 1.00 0.00 C ATOM 148 C TYR A 162 -19.449 15.969 -6.908 1.00 0.00 C ATOM 149 O TYR A 162 -19.008 15.772 -8.029 1.00 0.00 O ATOM 150 CB TYR A 162 -21.119 14.499 -5.829 1.00 0.00 C ATOM 151 CG TYR A 162 -21.471 13.030 -5.873 1.00 0.00 C ATOM 152 CD1 TYR A 162 -21.706 12.305 -4.687 1.00 0.00 C ATOM 153 CD2 TYR A 162 -21.594 12.359 -7.108 1.00 0.00 C ATOM 154 CE1 TYR A 162 -22.071 10.931 -4.735 1.00 0.00 C ATOM 155 CE2 TYR A 162 -21.958 10.988 -7.157 1.00 0.00 C ATOM 156 CZ TYR A 162 -22.200 10.291 -5.971 1.00 0.00 C ATOM 157 OH TYR A 162 -22.565 8.970 -6.026 1.00 0.00 O ATOM 0 H TYR A 162 -19.740 15.102 -3.848 1.00 0.00 H new ATOM 0 HA TYR A 162 -19.090 13.928 -6.270 1.00 0.00 H new ATOM 0 HB2 TYR A 162 -21.501 14.920 -4.899 1.00 0.00 H new ATOM 0 HB3 TYR A 162 -21.636 15.005 -6.644 1.00 0.00 H new ATOM 0 HD1 TYR A 162 -21.608 12.798 -3.731 1.00 0.00 H new ATOM 0 HD2 TYR A 162 -21.409 12.895 -8.027 1.00 0.00 H new ATOM 0 HE1 TYR A 162 -22.248 10.385 -3.820 1.00 0.00 H new ATOM 0 HE2 TYR A 162 -22.048 10.485 -8.109 1.00 0.00 H new ATOM 0 HH TYR A 162 -21.835 8.445 -6.416 1.00 0.00 H new ATOM 167 N ALA A 163 -19.782 17.178 -6.469 1.00 0.00 N ATOM 168 CA ALA A 163 -19.668 18.365 -7.311 1.00 0.00 C ATOM 169 C ALA A 163 -18.230 18.579 -7.797 1.00 0.00 C ATOM 170 O ALA A 163 -18.006 18.939 -8.952 1.00 0.00 O ATOM 171 CB ALA A 163 -20.156 19.596 -6.537 1.00 0.00 C ATOM 0 H ALA A 163 -20.135 17.363 -5.530 1.00 0.00 H new ATOM 0 HA ALA A 163 -20.292 18.216 -8.192 1.00 0.00 H new ATOM 0 HB1 ALA A 163 -20.070 20.480 -7.168 1.00 0.00 H new ATOM 0 HB2 ALA A 163 -21.198 19.456 -6.250 1.00 0.00 H new ATOM 0 HB3 ALA A 163 -19.548 19.728 -5.642 1.00 0.00 H new ATOM 177 N ASP A 164 -17.262 18.349 -6.927 1.00 0.00 N ATOM 178 CA ASP A 164 -15.862 18.545 -7.287 1.00 0.00 C ATOM 179 C ASP A 164 -15.451 17.530 -8.337 1.00 0.00 C ATOM 180 O ASP A 164 -14.736 17.847 -9.274 1.00 0.00 O ATOM 181 CB ASP A 164 -14.954 18.377 -6.072 1.00 0.00 C ATOM 182 CG ASP A 164 -15.302 19.324 -4.952 1.00 0.00 C ATOM 183 OD1 ASP A 164 -15.248 18.887 -3.783 1.00 0.00 O ATOM 184 OD2 ASP A 164 -15.641 20.489 -5.228 1.00 0.00 O ATOM 0 H ASP A 164 -17.415 18.028 -5.971 1.00 0.00 H new ATOM 0 HA ASP A 164 -15.758 19.558 -7.676 1.00 0.00 H new ATOM 0 HB2 ASP A 164 -15.024 17.351 -5.710 1.00 0.00 H new ATOM 0 HB3 ASP A 164 -13.919 18.540 -6.372 1.00 0.00 H new ATOM 189 N LEU A 165 -15.915 16.301 -8.188 1.00 0.00 N ATOM 190 CA LEU A 165 -15.583 15.242 -9.139 1.00 0.00 C ATOM 191 C LEU A 165 -16.233 15.506 -10.497 1.00 0.00 C ATOM 192 O LEU A 165 -15.614 15.284 -11.535 1.00 0.00 O ATOM 193 CB LEU A 165 -16.021 13.886 -8.585 1.00 0.00 C ATOM 194 CG LEU A 165 -15.286 13.427 -7.314 1.00 0.00 C ATOM 195 CD1 LEU A 165 -15.956 12.176 -6.773 1.00 0.00 C ATOM 196 CD2 LEU A 165 -13.804 13.150 -7.591 1.00 0.00 C ATOM 0 H LEU A 165 -16.521 16.008 -7.422 1.00 0.00 H new ATOM 0 HA LEU A 165 -14.503 15.230 -9.282 1.00 0.00 H new ATOM 0 HB2 LEU A 165 -17.089 13.927 -8.372 1.00 0.00 H new ATOM 0 HB3 LEU A 165 -15.879 13.132 -9.359 1.00 0.00 H new ATOM 0 HG LEU A 165 -15.340 14.228 -6.576 1.00 0.00 H new ATOM 0 HD11 LEU A 165 -15.438 11.847 -5.872 1.00 0.00 H new ATOM 0 HD12 LEU A 165 -16.997 12.395 -6.534 1.00 0.00 H new ATOM 0 HD13 LEU A 165 -15.914 11.387 -7.524 1.00 0.00 H new ATOM 0 HD21 LEU A 165 -13.316 12.828 -6.671 1.00 0.00 H new ATOM 0 HD22 LEU A 165 -13.715 12.366 -8.343 1.00 0.00 H new ATOM 0 HD23 LEU A 165 -13.326 14.059 -7.956 1.00 0.00 H new ATOM 208 N ILE A 166 -17.465 15.998 -10.494 1.00 0.00 N ATOM 209 CA ILE A 166 -18.156 16.356 -11.739 1.00 0.00 C ATOM 210 C ILE A 166 -17.339 17.457 -12.415 1.00 0.00 C ATOM 211 O ILE A 166 -17.074 17.412 -13.616 1.00 0.00 O ATOM 212 CB ILE A 166 -19.608 16.881 -11.470 1.00 0.00 C ATOM 213 CG1 ILE A 166 -20.486 15.778 -10.856 1.00 0.00 C ATOM 214 CG2 ILE A 166 -20.275 17.364 -12.774 1.00 0.00 C ATOM 215 CD1 ILE A 166 -21.748 16.313 -10.141 1.00 0.00 C ATOM 0 H ILE A 166 -18.011 16.160 -9.648 1.00 0.00 H new ATOM 0 HA ILE A 166 -18.242 15.471 -12.369 1.00 0.00 H new ATOM 0 HB ILE A 166 -19.521 17.715 -10.773 1.00 0.00 H new ATOM 0 HG12 ILE A 166 -20.790 15.088 -11.643 1.00 0.00 H new ATOM 0 HG13 ILE A 166 -19.891 15.207 -10.144 1.00 0.00 H new ATOM 0 HG21 ILE A 166 -21.281 17.723 -12.557 1.00 0.00 H new ATOM 0 HG22 ILE A 166 -19.686 18.174 -13.205 1.00 0.00 H new ATOM 0 HG23 ILE A 166 -20.329 16.538 -13.483 1.00 0.00 H new ATOM 0 HD11 ILE A 166 -22.317 15.477 -9.734 1.00 0.00 H new ATOM 0 HD12 ILE A 166 -21.452 16.980 -9.331 1.00 0.00 H new ATOM 0 HD13 ILE A 166 -22.366 16.860 -10.854 1.00 0.00 H new ATOM 227 N THR A 167 -16.926 18.440 -11.633 1.00 0.00 N ATOM 228 CA THR A 167 -16.123 19.543 -12.143 1.00 0.00 C ATOM 229 C THR A 167 -14.799 19.053 -12.713 1.00 0.00 C ATOM 230 O THR A 167 -14.413 19.450 -13.807 1.00 0.00 O ATOM 231 CB THR A 167 -15.839 20.560 -11.021 1.00 0.00 C ATOM 232 OG1 THR A 167 -17.067 21.153 -10.594 1.00 0.00 O ATOM 233 CG2 THR A 167 -14.893 21.645 -11.466 1.00 0.00 C ATOM 0 H THR A 167 -17.134 18.498 -10.636 1.00 0.00 H new ATOM 0 HA THR A 167 -16.693 20.018 -12.941 1.00 0.00 H new ATOM 0 HB THR A 167 -15.367 20.021 -10.199 1.00 0.00 H new ATOM 0 HG1 THR A 167 -17.545 20.529 -10.008 1.00 0.00 H new ATOM 0 HG21 THR A 167 -14.722 22.339 -10.643 1.00 0.00 H new ATOM 0 HG22 THR A 167 -13.945 21.200 -11.768 1.00 0.00 H new ATOM 0 HG23 THR A 167 -15.327 22.183 -12.309 1.00 0.00 H new ATOM 241 N LYS A 168 -14.102 18.188 -11.993 1.00 0.00 N ATOM 242 CA LYS A 168 -12.809 17.683 -12.458 1.00 0.00 C ATOM 243 C LYS A 168 -12.944 16.881 -13.742 1.00 0.00 C ATOM 244 O LYS A 168 -12.033 16.877 -14.561 1.00 0.00 O ATOM 245 CB LYS A 168 -12.140 16.843 -11.376 1.00 0.00 C ATOM 246 CG LYS A 168 -11.563 17.683 -10.250 1.00 0.00 C ATOM 247 CD LYS A 168 -10.739 16.848 -9.278 1.00 0.00 C ATOM 248 CE LYS A 168 -9.256 16.844 -9.663 1.00 0.00 C ATOM 249 NZ LYS A 168 -8.635 18.215 -9.508 1.00 0.00 N ATOM 0 H LYS A 168 -14.402 17.820 -11.090 1.00 0.00 H new ATOM 0 HA LYS A 168 -12.181 18.547 -12.673 1.00 0.00 H new ATOM 0 HB2 LYS A 168 -12.867 16.143 -10.965 1.00 0.00 H new ATOM 0 HB3 LYS A 168 -11.344 16.249 -11.824 1.00 0.00 H new ATOM 0 HG2 LYS A 168 -10.939 18.472 -10.670 1.00 0.00 H new ATOM 0 HG3 LYS A 168 -12.374 18.172 -9.710 1.00 0.00 H new ATOM 0 HD2 LYS A 168 -10.853 17.243 -8.269 1.00 0.00 H new ATOM 0 HD3 LYS A 168 -11.116 15.825 -9.264 1.00 0.00 H new ATOM 0 HE2 LYS A 168 -8.720 16.129 -9.039 1.00 0.00 H new ATOM 0 HE3 LYS A 168 -9.149 16.510 -10.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 168 -7.606 18.119 -9.391 1.00 0.00 H new ATOM 0 HZ2 LYS A 168 -8.836 18.785 -10.355 1.00 0.00 H new ATOM 0 HZ3 LYS A 168 -9.036 18.685 -8.671 1.00 0.00 H new ATOM 263 N ALA A 169 -14.075 16.224 -13.939 1.00 0.00 N ATOM 264 CA ALA A 169 -14.320 15.514 -15.184 1.00 0.00 C ATOM 265 C ALA A 169 -14.379 16.511 -16.341 1.00 0.00 C ATOM 266 O ALA A 169 -13.778 16.303 -17.394 1.00 0.00 O ATOM 267 CB ALA A 169 -15.629 14.735 -15.093 1.00 0.00 C ATOM 0 H ALA A 169 -14.833 16.167 -13.259 1.00 0.00 H new ATOM 0 HA ALA A 169 -13.507 14.810 -15.362 1.00 0.00 H new ATOM 0 HB1 ALA A 169 -15.804 14.207 -16.030 1.00 0.00 H new ATOM 0 HB2 ALA A 169 -15.568 14.015 -14.277 1.00 0.00 H new ATOM 0 HB3 ALA A 169 -16.451 15.426 -14.907 1.00 0.00 H new ATOM 273 N ILE A 170 -15.101 17.602 -16.131 1.00 0.00 N ATOM 274 CA ILE A 170 -15.272 18.621 -17.164 1.00 0.00 C ATOM 275 C ILE A 170 -13.919 19.270 -17.442 1.00 0.00 C ATOM 276 O ILE A 170 -13.567 19.538 -18.587 1.00 0.00 O ATOM 277 CB ILE A 170 -16.308 19.689 -16.709 1.00 0.00 C ATOM 278 CG1 ILE A 170 -17.705 19.042 -16.566 1.00 0.00 C ATOM 279 CG2 ILE A 170 -16.370 20.843 -17.716 1.00 0.00 C ATOM 280 CD1 ILE A 170 -18.667 19.811 -15.647 1.00 0.00 C ATOM 0 H ILE A 170 -15.580 17.807 -15.254 1.00 0.00 H new ATOM 0 HA ILE A 170 -15.649 18.159 -18.076 1.00 0.00 H new ATOM 0 HB ILE A 170 -15.995 20.086 -15.743 1.00 0.00 H new ATOM 0 HG12 ILE A 170 -18.156 18.957 -17.555 1.00 0.00 H new ATOM 0 HG13 ILE A 170 -17.586 18.029 -16.182 1.00 0.00 H new ATOM 0 HG21 ILE A 170 -17.100 21.580 -17.381 1.00 0.00 H new ATOM 0 HG22 ILE A 170 -15.389 21.312 -17.792 1.00 0.00 H new ATOM 0 HG23 ILE A 170 -16.665 20.458 -18.692 1.00 0.00 H new ATOM 0 HD11 ILE A 170 -19.623 19.289 -15.603 1.00 0.00 H new ATOM 0 HD12 ILE A 170 -18.241 19.874 -14.646 1.00 0.00 H new ATOM 0 HD13 ILE A 170 -18.820 20.816 -16.040 1.00 0.00 H new ATOM 292 N GLU A 171 -13.153 19.503 -16.392 1.00 0.00 N ATOM 293 CA GLU A 171 -11.825 20.097 -16.514 1.00 0.00 C ATOM 294 C GLU A 171 -10.877 19.202 -17.298 1.00 0.00 C ATOM 295 O GLU A 171 -9.979 19.680 -17.989 1.00 0.00 O ATOM 296 CB GLU A 171 -11.235 20.295 -15.127 1.00 0.00 C ATOM 297 CG GLU A 171 -11.871 21.380 -14.345 1.00 0.00 C ATOM 298 CD GLU A 171 -10.951 22.575 -14.243 1.00 0.00 C ATOM 299 OE1 GLU A 171 -10.505 23.068 -15.310 1.00 0.00 O ATOM 300 OE2 GLU A 171 -10.657 23.016 -13.118 1.00 0.00 O ATOM 0 H GLU A 171 -13.428 19.289 -15.433 1.00 0.00 H new ATOM 0 HA GLU A 171 -11.936 21.045 -17.041 1.00 0.00 H new ATOM 0 HB2 GLU A 171 -11.323 19.362 -14.571 1.00 0.00 H new ATOM 0 HB3 GLU A 171 -10.171 20.509 -15.224 1.00 0.00 H new ATOM 0 HG2 GLU A 171 -12.808 21.675 -14.818 1.00 0.00 H new ATOM 0 HG3 GLU A 171 -12.118 21.019 -13.347 1.00 0.00 H new ATOM 307 N SER A 172 -11.074 17.901 -17.178 1.00 0.00 N ATOM 308 CA SER A 172 -10.207 16.931 -17.851 1.00 0.00 C ATOM 309 C SER A 172 -10.499 16.854 -19.344 1.00 0.00 C ATOM 310 O SER A 172 -9.634 16.469 -20.134 1.00 0.00 O ATOM 311 CB SER A 172 -10.388 15.544 -17.241 1.00 0.00 C ATOM 312 OG SER A 172 -10.042 15.548 -15.865 1.00 0.00 O ATOM 0 H SER A 172 -11.823 17.486 -16.624 1.00 0.00 H new ATOM 0 HA SER A 172 -9.180 17.269 -17.713 1.00 0.00 H new ATOM 0 HB2 SER A 172 -11.423 15.222 -17.359 1.00 0.00 H new ATOM 0 HB3 SER A 172 -9.767 14.824 -17.774 1.00 0.00 H new ATOM 0 HG SER A 172 -10.770 15.949 -15.346 1.00 0.00 H new ATOM 318 N SER A 173 -11.714 17.209 -19.732 1.00 0.00 N ATOM 319 CA SER A 173 -12.099 17.163 -21.139 1.00 0.00 C ATOM 320 C SER A 173 -11.393 18.264 -21.931 1.00 0.00 C ATOM 321 O SER A 173 -11.131 19.350 -21.419 1.00 0.00 O ATOM 322 CB SER A 173 -13.609 17.306 -21.274 1.00 0.00 C ATOM 323 OG SER A 173 -14.029 18.635 -21.054 1.00 0.00 O ATOM 0 H SER A 173 -12.447 17.530 -19.100 1.00 0.00 H new ATOM 0 HA SER A 173 -11.796 16.199 -21.547 1.00 0.00 H new ATOM 0 HB2 SER A 173 -13.917 16.987 -22.270 1.00 0.00 H new ATOM 0 HB3 SER A 173 -14.102 16.646 -20.561 1.00 0.00 H new ATOM 0 HG SER A 173 -13.842 18.888 -20.126 1.00 0.00 H new ATOM 329 N ALA A 174 -11.084 17.983 -23.189 1.00 0.00 N ATOM 330 CA ALA A 174 -10.368 18.942 -24.025 1.00 0.00 C ATOM 331 C ALA A 174 -11.271 20.124 -24.376 1.00 0.00 C ATOM 332 O ALA A 174 -10.810 21.242 -24.570 1.00 0.00 O ATOM 333 CB ALA A 174 -9.884 18.250 -25.302 1.00 0.00 C ATOM 0 H ALA A 174 -11.315 17.105 -23.653 1.00 0.00 H new ATOM 0 HA ALA A 174 -9.507 19.319 -23.473 1.00 0.00 H new ATOM 0 HB1 ALA A 174 -9.350 18.968 -25.925 1.00 0.00 H new ATOM 0 HB2 ALA A 174 -9.216 17.429 -25.040 1.00 0.00 H new ATOM 0 HB3 ALA A 174 -10.741 17.860 -25.852 1.00 0.00 H new ATOM 339 N GLU A 175 -12.561 19.867 -24.470 1.00 0.00 N ATOM 340 CA GLU A 175 -13.523 20.895 -24.842 1.00 0.00 C ATOM 341 C GLU A 175 -14.096 21.642 -23.644 1.00 0.00 C ATOM 342 O GLU A 175 -14.888 22.560 -23.822 1.00 0.00 O ATOM 343 CB GLU A 175 -14.680 20.255 -25.605 1.00 0.00 C ATOM 344 CG GLU A 175 -14.253 19.309 -26.714 1.00 0.00 C ATOM 345 CD GLU A 175 -14.361 17.854 -26.282 1.00 0.00 C ATOM 346 OE1 GLU A 175 -13.515 17.393 -25.474 1.00 0.00 O ATOM 347 OE2 GLU A 175 -15.304 17.179 -26.746 1.00 0.00 O ATOM 0 H GLU A 175 -12.972 18.950 -24.293 1.00 0.00 H new ATOM 0 HA GLU A 175 -12.985 21.616 -25.458 1.00 0.00 H new ATOM 0 HB2 GLU A 175 -15.307 19.709 -24.900 1.00 0.00 H new ATOM 0 HB3 GLU A 175 -15.297 21.044 -26.035 1.00 0.00 H new ATOM 0 HG2 GLU A 175 -14.875 19.475 -27.594 1.00 0.00 H new ATOM 0 HG3 GLU A 175 -13.225 19.528 -27.004 1.00 0.00 H new ATOM 354 N LYS A 176 -13.704 21.235 -22.436 1.00 0.00 N ATOM 355 CA LYS A 176 -14.231 21.794 -21.184 1.00 0.00 C ATOM 356 C LYS A 176 -15.751 21.655 -21.086 1.00 0.00 C ATOM 357 O LYS A 176 -16.424 22.513 -20.531 1.00 0.00 O ATOM 358 CB LYS A 176 -13.791 23.253 -20.985 1.00 0.00 C ATOM 359 CG LYS A 176 -12.275 23.460 -21.034 1.00 0.00 C ATOM 360 CD LYS A 176 -11.555 22.603 -19.990 1.00 0.00 C ATOM 361 CE LYS A 176 -10.134 23.091 -19.775 1.00 0.00 C ATOM 362 NZ LYS A 176 -9.440 22.384 -18.645 1.00 0.00 N ATOM 0 H LYS A 176 -13.007 20.503 -22.295 1.00 0.00 H new ATOM 0 HA LYS A 176 -13.802 21.206 -20.373 1.00 0.00 H new ATOM 0 HB2 LYS A 176 -14.256 23.870 -21.754 1.00 0.00 H new ATOM 0 HB3 LYS A 176 -14.164 23.606 -20.024 1.00 0.00 H new ATOM 0 HG2 LYS A 176 -11.905 23.210 -22.028 1.00 0.00 H new ATOM 0 HG3 LYS A 176 -12.045 24.512 -20.863 1.00 0.00 H new ATOM 0 HD2 LYS A 176 -12.101 22.636 -19.047 1.00 0.00 H new ATOM 0 HD3 LYS A 176 -11.541 21.563 -20.315 1.00 0.00 H new ATOM 0 HE2 LYS A 176 -9.563 22.948 -20.692 1.00 0.00 H new ATOM 0 HE3 LYS A 176 -10.149 24.162 -19.573 1.00 0.00 H new ATOM 0 HZ1 LYS A 176 -8.415 22.375 -18.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 176 -9.636 22.881 -17.752 1.00 0.00 H new ATOM 0 HZ3 LYS A 176 -9.789 21.406 -18.581 1.00 0.00 H new ATOM 376 N ARG A 177 -16.273 20.553 -21.612 1.00 0.00 N ATOM 377 CA ARG A 177 -17.702 20.216 -21.538 1.00 0.00 C ATOM 378 C ARG A 177 -17.829 18.713 -21.735 1.00 0.00 C ATOM 379 O ARG A 177 -17.107 18.145 -22.544 1.00 0.00 O ATOM 380 CB ARG A 177 -18.527 20.958 -22.608 1.00 0.00 C ATOM 381 CG ARG A 177 -17.940 20.943 -24.010 1.00 0.00 C ATOM 382 CD ARG A 177 -19.025 21.124 -25.064 1.00 0.00 C ATOM 383 NE ARG A 177 -18.472 21.258 -26.425 1.00 0.00 N ATOM 384 CZ ARG A 177 -17.950 20.272 -27.152 1.00 0.00 C ATOM 385 NH1 ARG A 177 -17.842 19.046 -26.709 1.00 0.00 N ATOM 386 NH2 ARG A 177 -17.517 20.534 -28.354 1.00 0.00 N ATOM 0 H ARG A 177 -15.716 19.857 -22.108 1.00 0.00 H new ATOM 0 HA ARG A 177 -18.094 20.524 -20.569 1.00 0.00 H new ATOM 0 HB2 ARG A 177 -19.523 20.517 -22.645 1.00 0.00 H new ATOM 0 HB3 ARG A 177 -18.649 21.995 -22.294 1.00 0.00 H new ATOM 0 HG2 ARG A 177 -17.200 21.738 -24.106 1.00 0.00 H new ATOM 0 HG3 ARG A 177 -17.419 20.001 -24.179 1.00 0.00 H new ATOM 0 HD2 ARG A 177 -19.703 20.271 -25.033 1.00 0.00 H new ATOM 0 HD3 ARG A 177 -19.615 22.009 -24.826 1.00 0.00 H new ATOM 0 HE ARG A 177 -18.491 22.187 -26.846 1.00 0.00 H new ATOM 0 HH11 ARG A 177 -18.165 18.813 -25.770 1.00 0.00 H new ATOM 0 HH12 ARG A 177 -17.435 18.323 -27.303 1.00 0.00 H new ATOM 0 HH21 ARG A 177 -17.581 21.482 -28.724 1.00 0.00 H new ATOM 0 HH22 ARG A 177 -17.114 19.790 -28.924 1.00 0.00 H new ATOM 400 N LEU A 178 -18.729 18.074 -21.000 1.00 0.00 N ATOM 401 CA LEU A 178 -18.937 16.624 -21.112 1.00 0.00 C ATOM 402 C LEU A 178 -20.418 16.277 -21.067 1.00 0.00 C ATOM 403 O LEU A 178 -21.219 17.038 -20.546 1.00 0.00 O ATOM 404 CB LEU A 178 -18.253 15.890 -19.950 1.00 0.00 C ATOM 405 CG LEU A 178 -16.725 15.738 -19.952 1.00 0.00 C ATOM 406 CD1 LEU A 178 -16.328 14.858 -18.792 1.00 0.00 C ATOM 407 CD2 LEU A 178 -16.234 15.099 -21.249 1.00 0.00 C ATOM 0 H LEU A 178 -19.331 18.532 -20.316 1.00 0.00 H new ATOM 0 HA LEU A 178 -18.510 16.314 -22.066 1.00 0.00 H new ATOM 0 HB2 LEU A 178 -18.530 16.404 -19.030 1.00 0.00 H new ATOM 0 HB3 LEU A 178 -18.682 14.889 -19.897 1.00 0.00 H new ATOM 0 HG LEU A 178 -16.275 16.727 -19.865 1.00 0.00 H new ATOM 0 HD11 LEU A 178 -15.245 14.740 -18.779 1.00 0.00 H new ATOM 0 HD12 LEU A 178 -16.654 15.317 -17.859 1.00 0.00 H new ATOM 0 HD13 LEU A 178 -16.798 13.881 -18.899 1.00 0.00 H new ATOM 0 HD21 LEU A 178 -15.148 15.005 -21.220 1.00 0.00 H new ATOM 0 HD22 LEU A 178 -16.681 14.111 -21.360 1.00 0.00 H new ATOM 0 HD23 LEU A 178 -16.522 15.724 -22.094 1.00 0.00 H new ATOM 419 N THR A 179 -20.780 15.117 -21.594 1.00 0.00 N ATOM 420 CA THR A 179 -22.155 14.625 -21.489 1.00 0.00 C ATOM 421 C THR A 179 -22.213 13.786 -20.216 1.00 0.00 C ATOM 422 O THR A 179 -21.176 13.413 -19.677 1.00 0.00 O ATOM 423 CB THR A 179 -22.549 13.741 -22.688 1.00 0.00 C ATOM 424 OG1 THR A 179 -21.573 12.709 -22.858 1.00 0.00 O ATOM 425 CG2 THR A 179 -22.616 14.550 -23.967 1.00 0.00 C ATOM 0 H THR A 179 -20.146 14.497 -22.098 1.00 0.00 H new ATOM 0 HA THR A 179 -22.846 15.468 -21.472 1.00 0.00 H new ATOM 0 HB THR A 179 -23.532 13.316 -22.485 1.00 0.00 H new ATOM 0 HG1 THR A 179 -21.967 11.844 -22.620 1.00 0.00 H new ATOM 0 HG21 THR A 179 -22.896 13.899 -24.795 1.00 0.00 H new ATOM 0 HG22 THR A 179 -23.359 15.340 -23.859 1.00 0.00 H new ATOM 0 HG23 THR A 179 -21.641 14.994 -24.168 1.00 0.00 H new ATOM 433 N LEU A 180 -23.411 13.478 -19.736 1.00 0.00 N ATOM 434 CA LEU A 180 -23.557 12.710 -18.492 1.00 0.00 C ATOM 435 C LEU A 180 -22.835 11.364 -18.531 1.00 0.00 C ATOM 436 O LEU A 180 -22.205 10.978 -17.562 1.00 0.00 O ATOM 437 CB LEU A 180 -25.039 12.483 -18.175 1.00 0.00 C ATOM 438 CG LEU A 180 -25.685 13.539 -17.260 1.00 0.00 C ATOM 439 CD1 LEU A 180 -27.204 13.359 -17.244 1.00 0.00 C ATOM 440 CD2 LEU A 180 -25.148 13.446 -15.833 1.00 0.00 C ATOM 0 H LEU A 180 -24.291 13.742 -20.179 1.00 0.00 H new ATOM 0 HA LEU A 180 -23.091 13.307 -17.708 1.00 0.00 H new ATOM 0 HB2 LEU A 180 -25.593 12.451 -19.113 1.00 0.00 H new ATOM 0 HB3 LEU A 180 -25.148 11.505 -17.707 1.00 0.00 H new ATOM 0 HG LEU A 180 -25.433 14.522 -17.658 1.00 0.00 H new ATOM 0 HD11 LEU A 180 -27.653 14.110 -16.594 1.00 0.00 H new ATOM 0 HD12 LEU A 180 -27.595 13.474 -18.255 1.00 0.00 H new ATOM 0 HD13 LEU A 180 -27.449 12.364 -16.871 1.00 0.00 H new ATOM 0 HD21 LEU A 180 -25.625 14.206 -15.214 1.00 0.00 H new ATOM 0 HD22 LEU A 180 -25.365 12.458 -15.426 1.00 0.00 H new ATOM 0 HD23 LEU A 180 -24.070 13.608 -15.839 1.00 0.00 H new ATOM 452 N SER A 181 -22.917 10.664 -19.653 1.00 0.00 N ATOM 453 CA SER A 181 -22.275 9.357 -19.783 1.00 0.00 C ATOM 454 C SER A 181 -20.758 9.454 -19.646 1.00 0.00 C ATOM 455 O SER A 181 -20.116 8.574 -19.091 1.00 0.00 O ATOM 456 CB SER A 181 -22.622 8.765 -21.144 1.00 0.00 C ATOM 457 OG SER A 181 -22.716 9.796 -22.118 1.00 0.00 O ATOM 0 H SER A 181 -23.419 10.974 -20.485 1.00 0.00 H new ATOM 0 HA SER A 181 -22.643 8.717 -18.980 1.00 0.00 H new ATOM 0 HB2 SER A 181 -21.860 8.044 -21.440 1.00 0.00 H new ATOM 0 HB3 SER A 181 -23.567 8.225 -21.084 1.00 0.00 H new ATOM 0 HG SER A 181 -22.938 9.404 -22.989 1.00 0.00 H new ATOM 463 N GLN A 182 -20.193 10.539 -20.145 1.00 0.00 N ATOM 464 CA GLN A 182 -18.752 10.742 -20.087 1.00 0.00 C ATOM 465 C GLN A 182 -18.293 11.049 -18.670 1.00 0.00 C ATOM 466 O GLN A 182 -17.228 10.615 -18.248 1.00 0.00 O ATOM 467 CB GLN A 182 -18.368 11.879 -21.020 1.00 0.00 C ATOM 468 CG GLN A 182 -18.370 11.448 -22.488 1.00 0.00 C ATOM 469 CD GLN A 182 -17.879 12.528 -23.417 1.00 0.00 C ATOM 470 OE1 GLN A 182 -16.693 12.730 -23.570 1.00 0.00 O ATOM 471 NE2 GLN A 182 -18.791 13.224 -24.047 1.00 0.00 N ATOM 0 H GLN A 182 -20.708 11.295 -20.596 1.00 0.00 H new ATOM 0 HA GLN A 182 -18.259 9.823 -20.403 1.00 0.00 H new ATOM 0 HB2 GLN A 182 -19.063 12.708 -20.885 1.00 0.00 H new ATOM 0 HB3 GLN A 182 -17.378 12.247 -20.753 1.00 0.00 H new ATOM 0 HG2 GLN A 182 -17.742 10.564 -22.603 1.00 0.00 H new ATOM 0 HG3 GLN A 182 -19.381 11.160 -22.776 1.00 0.00 H new ATOM 0 HE21 GLN A 182 -19.780 13.026 -23.894 1.00 0.00 H new ATOM 0 HE22 GLN A 182 -18.513 13.964 -24.691 1.00 0.00 H new ATOM 480 N ILE A 183 -19.103 11.787 -17.930 1.00 0.00 N ATOM 481 CA ILE A 183 -18.789 12.113 -16.543 1.00 0.00 C ATOM 482 C ILE A 183 -18.802 10.822 -15.729 1.00 0.00 C ATOM 483 O ILE A 183 -17.970 10.638 -14.839 1.00 0.00 O ATOM 484 CB ILE A 183 -19.802 13.154 -15.990 1.00 0.00 C ATOM 485 CG1 ILE A 183 -19.645 14.464 -16.784 1.00 0.00 C ATOM 486 CG2 ILE A 183 -19.576 13.428 -14.479 1.00 0.00 C ATOM 487 CD1 ILE A 183 -20.885 15.300 -16.862 1.00 0.00 C ATOM 0 H ILE A 183 -19.986 12.174 -18.264 1.00 0.00 H new ATOM 0 HA ILE A 183 -17.799 12.565 -16.473 1.00 0.00 H new ATOM 0 HB ILE A 183 -20.809 12.754 -16.104 1.00 0.00 H new ATOM 0 HG12 ILE A 183 -18.852 15.056 -16.328 1.00 0.00 H new ATOM 0 HG13 ILE A 183 -19.321 14.223 -17.796 1.00 0.00 H new ATOM 0 HG21 ILE A 183 -20.303 14.161 -14.129 1.00 0.00 H new ATOM 0 HG22 ILE A 183 -19.697 12.501 -13.919 1.00 0.00 H new ATOM 0 HG23 ILE A 183 -18.569 13.815 -14.326 1.00 0.00 H new ATOM 0 HD11 ILE A 183 -20.680 16.202 -17.439 1.00 0.00 H new ATOM 0 HD12 ILE A 183 -21.678 14.731 -17.347 1.00 0.00 H new ATOM 0 HD13 ILE A 183 -21.201 15.577 -15.856 1.00 0.00 H new ATOM 499 N TYR A 184 -19.721 9.914 -16.045 1.00 0.00 N ATOM 500 CA TYR A 184 -19.768 8.634 -15.338 1.00 0.00 C ATOM 501 C TYR A 184 -18.458 7.875 -15.550 1.00 0.00 C ATOM 502 O TYR A 184 -17.818 7.448 -14.596 1.00 0.00 O ATOM 503 CB TYR A 184 -20.930 7.740 -15.807 1.00 0.00 C ATOM 504 CG TYR A 184 -22.323 8.352 -15.746 1.00 0.00 C ATOM 505 CD1 TYR A 184 -22.655 9.360 -14.816 1.00 0.00 C ATOM 506 CD2 TYR A 184 -23.328 7.904 -16.629 1.00 0.00 C ATOM 507 CE1 TYR A 184 -23.967 9.916 -14.779 1.00 0.00 C ATOM 508 CE2 TYR A 184 -24.633 8.461 -16.598 1.00 0.00 C ATOM 509 CZ TYR A 184 -24.937 9.461 -15.674 1.00 0.00 C ATOM 510 OH TYR A 184 -26.202 9.994 -15.661 1.00 0.00 O ATOM 0 H TYR A 184 -20.429 10.034 -16.769 1.00 0.00 H new ATOM 0 HA TYR A 184 -19.921 8.864 -14.284 1.00 0.00 H new ATOM 0 HB2 TYR A 184 -20.735 7.438 -16.836 1.00 0.00 H new ATOM 0 HB3 TYR A 184 -20.929 6.833 -15.202 1.00 0.00 H new ATOM 0 HD1 TYR A 184 -21.906 9.715 -14.124 1.00 0.00 H new ATOM 0 HD2 TYR A 184 -23.100 7.124 -17.341 1.00 0.00 H new ATOM 0 HE1 TYR A 184 -24.210 10.686 -14.062 1.00 0.00 H new ATOM 0 HE2 TYR A 184 -25.388 8.112 -17.287 1.00 0.00 H new ATOM 0 HH TYR A 184 -26.747 9.561 -16.351 1.00 0.00 H new ATOM 520 N GLU A 185 -18.056 7.721 -16.805 1.00 0.00 N ATOM 521 CA GLU A 185 -16.834 6.981 -17.134 1.00 0.00 C ATOM 522 C GLU A 185 -15.590 7.622 -16.534 1.00 0.00 C ATOM 523 O GLU A 185 -14.654 6.925 -16.139 1.00 0.00 O ATOM 524 CB GLU A 185 -16.667 6.890 -18.651 1.00 0.00 C ATOM 525 CG GLU A 185 -17.554 5.837 -19.296 1.00 0.00 C ATOM 526 CD GLU A 185 -17.267 4.441 -18.754 1.00 0.00 C ATOM 527 OE1 GLU A 185 -18.213 3.790 -18.268 1.00 0.00 O ATOM 528 OE2 GLU A 185 -16.089 3.999 -18.805 1.00 0.00 O ATOM 0 H GLU A 185 -18.553 8.096 -17.613 1.00 0.00 H new ATOM 0 HA GLU A 185 -16.941 5.985 -16.704 1.00 0.00 H new ATOM 0 HB2 GLU A 185 -16.890 7.861 -19.092 1.00 0.00 H new ATOM 0 HB3 GLU A 185 -15.625 6.667 -18.881 1.00 0.00 H new ATOM 0 HG2 GLU A 185 -18.600 6.087 -19.120 1.00 0.00 H new ATOM 0 HG3 GLU A 185 -17.402 5.846 -20.375 1.00 0.00 H new ATOM 535 N TRP A 186 -15.571 8.945 -16.449 1.00 0.00 N ATOM 536 CA TRP A 186 -14.431 9.635 -15.869 1.00 0.00 C ATOM 537 C TRP A 186 -14.298 9.235 -14.409 1.00 0.00 C ATOM 538 O TRP A 186 -13.202 8.967 -13.939 1.00 0.00 O ATOM 539 CB TRP A 186 -14.594 11.151 -15.986 1.00 0.00 C ATOM 540 CG TRP A 186 -13.432 11.904 -15.399 1.00 0.00 C ATOM 541 CD1 TRP A 186 -12.322 12.343 -16.042 1.00 0.00 C ATOM 542 CD2 TRP A 186 -13.265 12.322 -14.028 1.00 0.00 C ATOM 543 NE1 TRP A 186 -11.480 13.002 -15.196 1.00 0.00 N ATOM 544 CE2 TRP A 186 -12.019 13.006 -13.944 1.00 0.00 C ATOM 545 CE3 TRP A 186 -14.050 12.200 -12.869 1.00 0.00 C ATOM 546 CZ2 TRP A 186 -11.541 13.561 -12.741 1.00 0.00 C ATOM 547 CZ3 TRP A 186 -13.573 12.754 -11.649 1.00 0.00 C ATOM 548 CH2 TRP A 186 -12.320 13.431 -11.604 1.00 0.00 C ATOM 0 H TRP A 186 -16.323 9.555 -16.770 1.00 0.00 H new ATOM 0 HA TRP A 186 -13.530 9.351 -16.413 1.00 0.00 H new ATOM 0 HB2 TRP A 186 -14.704 11.421 -17.036 1.00 0.00 H new ATOM 0 HB3 TRP A 186 -15.511 11.454 -15.481 1.00 0.00 H new ATOM 0 HD1 TRP A 186 -12.129 12.190 -17.093 1.00 0.00 H new ATOM 0 HE1 TRP A 186 -10.589 13.424 -15.458 1.00 0.00 H new ATOM 0 HE3 TRP A 186 -15.003 11.692 -12.904 1.00 0.00 H new ATOM 0 HZ2 TRP A 186 -10.592 14.075 -12.706 1.00 0.00 H new ATOM 0 HZ3 TRP A 186 -14.165 12.661 -10.750 1.00 0.00 H new ATOM 0 HH2 TRP A 186 -11.973 13.848 -10.670 1.00 0.00 H new ATOM 559 N MET A 187 -15.407 9.179 -13.687 1.00 0.00 N ATOM 560 CA MET A 187 -15.355 8.815 -12.274 1.00 0.00 C ATOM 561 C MET A 187 -14.963 7.349 -12.101 1.00 0.00 C ATOM 562 O MET A 187 -14.211 7.024 -11.191 1.00 0.00 O ATOM 563 CB MET A 187 -16.691 9.087 -11.593 1.00 0.00 C ATOM 564 CG MET A 187 -17.004 10.554 -11.413 1.00 0.00 C ATOM 565 SD MET A 187 -18.500 10.771 -10.443 1.00 0.00 S ATOM 566 CE MET A 187 -18.806 12.494 -10.671 1.00 0.00 C ATOM 0 H MET A 187 -16.341 9.377 -14.046 1.00 0.00 H new ATOM 0 HA MET A 187 -14.593 9.434 -11.800 1.00 0.00 H new ATOM 0 HB2 MET A 187 -17.486 8.626 -12.179 1.00 0.00 H new ATOM 0 HB3 MET A 187 -16.694 8.603 -10.616 1.00 0.00 H new ATOM 0 HG2 MET A 187 -16.169 11.051 -10.919 1.00 0.00 H new ATOM 0 HG3 MET A 187 -17.125 11.027 -12.387 1.00 0.00 H new ATOM 0 HE1 MET A 187 -19.447 12.859 -9.868 1.00 0.00 H new ATOM 0 HE2 MET A 187 -17.861 13.037 -10.656 1.00 0.00 H new ATOM 0 HE3 MET A 187 -19.300 12.652 -11.630 1.00 0.00 H new ATOM 576 N VAL A 188 -15.448 6.470 -12.971 1.00 0.00 N ATOM 577 CA VAL A 188 -15.090 5.042 -12.905 1.00 0.00 C ATOM 578 C VAL A 188 -13.577 4.878 -13.092 1.00 0.00 C ATOM 579 O VAL A 188 -12.943 4.054 -12.432 1.00 0.00 O ATOM 580 CB VAL A 188 -15.852 4.214 -14.005 1.00 0.00 C ATOM 581 CG1 VAL A 188 -15.363 2.755 -14.062 1.00 0.00 C ATOM 582 CG2 VAL A 188 -17.358 4.209 -13.728 1.00 0.00 C ATOM 0 H VAL A 188 -16.087 6.711 -13.729 1.00 0.00 H new ATOM 0 HA VAL A 188 -15.383 4.662 -11.926 1.00 0.00 H new ATOM 0 HB VAL A 188 -15.646 4.696 -14.961 1.00 0.00 H new ATOM 0 HG11 VAL A 188 -15.913 2.217 -14.834 1.00 0.00 H new ATOM 0 HG12 VAL A 188 -14.299 2.737 -14.296 1.00 0.00 H new ATOM 0 HG13 VAL A 188 -15.530 2.277 -13.097 1.00 0.00 H new ATOM 0 HG21 VAL A 188 -17.868 3.632 -14.499 1.00 0.00 H new ATOM 0 HG22 VAL A 188 -17.547 3.759 -12.753 1.00 0.00 H new ATOM 0 HG23 VAL A 188 -17.732 5.233 -13.734 1.00 0.00 H new ATOM 592 N LYS A 189 -12.985 5.662 -13.983 1.00 0.00 N ATOM 593 CA LYS A 189 -11.541 5.574 -14.226 1.00 0.00 C ATOM 594 C LYS A 189 -10.688 6.310 -13.198 1.00 0.00 C ATOM 595 O LYS A 189 -9.615 5.842 -12.838 1.00 0.00 O ATOM 596 CB LYS A 189 -11.207 6.134 -15.613 1.00 0.00 C ATOM 597 CG LYS A 189 -10.631 5.099 -16.576 1.00 0.00 C ATOM 598 CD LYS A 189 -11.690 4.093 -17.026 1.00 0.00 C ATOM 599 CE LYS A 189 -11.103 3.079 -18.003 1.00 0.00 C ATOM 600 NZ LYS A 189 -12.183 2.158 -18.509 1.00 0.00 N ATOM 0 H LYS A 189 -13.470 6.360 -14.546 1.00 0.00 H new ATOM 0 HA LYS A 189 -11.299 4.514 -14.150 1.00 0.00 H new ATOM 0 HB2 LYS A 189 -12.111 6.559 -16.050 1.00 0.00 H new ATOM 0 HB3 LYS A 189 -10.493 6.950 -15.502 1.00 0.00 H new ATOM 0 HG2 LYS A 189 -10.216 5.605 -17.448 1.00 0.00 H new ATOM 0 HG3 LYS A 189 -9.809 4.570 -16.093 1.00 0.00 H new ATOM 0 HD2 LYS A 189 -12.095 3.574 -16.158 1.00 0.00 H new ATOM 0 HD3 LYS A 189 -12.519 4.620 -17.498 1.00 0.00 H new ATOM 0 HE2 LYS A 189 -10.636 3.598 -18.840 1.00 0.00 H new ATOM 0 HE3 LYS A 189 -10.322 2.499 -17.511 1.00 0.00 H new ATOM 0 HZ1 LYS A 189 -11.771 1.472 -19.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 189 -12.610 1.651 -17.708 1.00 0.00 H new ATOM 0 HZ3 LYS A 189 -12.914 2.715 -18.995 1.00 0.00 H new ATOM 614 N SER A 190 -11.145 7.471 -12.756 1.00 0.00 N ATOM 615 CA SER A 190 -10.359 8.325 -11.862 1.00 0.00 C ATOM 616 C SER A 190 -10.510 8.041 -10.373 1.00 0.00 C ATOM 617 O SER A 190 -9.608 8.356 -9.597 1.00 0.00 O ATOM 618 CB SER A 190 -10.735 9.790 -12.094 1.00 0.00 C ATOM 619 OG SER A 190 -9.879 10.651 -11.360 1.00 0.00 O ATOM 0 H SER A 190 -12.060 7.850 -13.000 1.00 0.00 H new ATOM 0 HA SER A 190 -9.322 8.104 -12.116 1.00 0.00 H new ATOM 0 HB2 SER A 190 -10.669 10.023 -13.157 1.00 0.00 H new ATOM 0 HB3 SER A 190 -11.770 9.957 -11.795 1.00 0.00 H new ATOM 0 HG SER A 190 -10.112 11.584 -11.550 1.00 0.00 H new ATOM 625 N VAL A 191 -11.636 7.481 -9.953 1.00 0.00 N ATOM 626 CA VAL A 191 -11.887 7.271 -8.525 1.00 0.00 C ATOM 627 C VAL A 191 -12.056 5.782 -8.223 1.00 0.00 C ATOM 628 O VAL A 191 -12.914 5.118 -8.804 1.00 0.00 O ATOM 629 CB VAL A 191 -13.161 8.043 -8.068 1.00 0.00 C ATOM 630 CG1 VAL A 191 -13.300 8.021 -6.542 1.00 0.00 C ATOM 631 CG2 VAL A 191 -13.098 9.493 -8.529 1.00 0.00 C ATOM 0 H VAL A 191 -12.385 7.165 -10.569 1.00 0.00 H new ATOM 0 HA VAL A 191 -11.027 7.652 -7.975 1.00 0.00 H new ATOM 0 HB VAL A 191 -14.022 7.547 -8.516 1.00 0.00 H new ATOM 0 HG11 VAL A 191 -14.197 8.567 -6.250 1.00 0.00 H new ATOM 0 HG12 VAL A 191 -13.375 6.989 -6.198 1.00 0.00 H new ATOM 0 HG13 VAL A 191 -12.426 8.491 -6.090 1.00 0.00 H new ATOM 0 HG21 VAL A 191 -13.995 10.018 -8.202 1.00 0.00 H new ATOM 0 HG22 VAL A 191 -12.219 9.974 -8.099 1.00 0.00 H new ATOM 0 HG23 VAL A 191 -13.034 9.527 -9.617 1.00 0.00 H new ATOM 641 N PRO A 192 -11.246 5.230 -7.297 1.00 0.00 N ATOM 642 CA PRO A 192 -11.398 3.790 -7.048 1.00 0.00 C ATOM 643 C PRO A 192 -12.739 3.435 -6.407 1.00 0.00 C ATOM 644 O PRO A 192 -13.226 2.325 -6.558 1.00 0.00 O ATOM 645 CB PRO A 192 -10.214 3.469 -6.130 1.00 0.00 C ATOM 646 CG PRO A 192 -9.937 4.744 -5.421 1.00 0.00 C ATOM 647 CD PRO A 192 -10.183 5.815 -6.455 1.00 0.00 C ATOM 0 HA PRO A 192 -11.397 3.206 -7.969 1.00 0.00 H new ATOM 0 HB2 PRO A 192 -10.460 2.671 -5.430 1.00 0.00 H new ATOM 0 HB3 PRO A 192 -9.348 3.136 -6.701 1.00 0.00 H new ATOM 0 HG2 PRO A 192 -10.591 4.868 -4.558 1.00 0.00 H new ATOM 0 HG3 PRO A 192 -8.912 4.778 -5.051 1.00 0.00 H new ATOM 0 HD2 PRO A 192 -10.501 6.752 -5.997 1.00 0.00 H new ATOM 0 HD3 PRO A 192 -9.284 6.031 -7.033 1.00 0.00 H new ATOM 655 N TYR A 193 -13.345 4.391 -5.712 1.00 0.00 N ATOM 656 CA TYR A 193 -14.670 4.189 -5.129 1.00 0.00 C ATOM 657 C TYR A 193 -15.673 3.887 -6.232 1.00 0.00 C ATOM 658 O TYR A 193 -16.459 2.965 -6.132 1.00 0.00 O ATOM 659 CB TYR A 193 -15.133 5.451 -4.394 1.00 0.00 C ATOM 660 CG TYR A 193 -16.537 5.336 -3.837 1.00 0.00 C ATOM 661 CD1 TYR A 193 -16.771 4.772 -2.566 1.00 0.00 C ATOM 662 CD2 TYR A 193 -17.647 5.789 -4.586 1.00 0.00 C ATOM 663 CE1 TYR A 193 -18.095 4.663 -2.050 1.00 0.00 C ATOM 664 CE2 TYR A 193 -18.966 5.671 -4.078 1.00 0.00 C ATOM 665 CZ TYR A 193 -19.176 5.113 -2.817 1.00 0.00 C ATOM 666 OH TYR A 193 -20.454 5.009 -2.328 1.00 0.00 O ATOM 0 H TYR A 193 -12.943 5.312 -5.538 1.00 0.00 H new ATOM 0 HA TYR A 193 -14.610 3.357 -4.427 1.00 0.00 H new ATOM 0 HB2 TYR A 193 -14.442 5.663 -3.578 1.00 0.00 H new ATOM 0 HB3 TYR A 193 -15.089 6.299 -5.078 1.00 0.00 H new ATOM 0 HD1 TYR A 193 -15.938 4.419 -1.977 1.00 0.00 H new ATOM 0 HD2 TYR A 193 -17.488 6.231 -5.559 1.00 0.00 H new ATOM 0 HE1 TYR A 193 -18.263 4.236 -1.073 1.00 0.00 H new ATOM 0 HE2 TYR A 193 -19.805 6.012 -4.666 1.00 0.00 H new ATOM 0 HH TYR A 193 -21.086 5.368 -2.985 1.00 0.00 H new ATOM 676 N PHE A 194 -15.651 4.683 -7.287 1.00 0.00 N ATOM 677 CA PHE A 194 -16.613 4.524 -8.365 1.00 0.00 C ATOM 678 C PHE A 194 -16.253 3.375 -9.287 1.00 0.00 C ATOM 679 O PHE A 194 -17.117 2.829 -9.959 1.00 0.00 O ATOM 680 CB PHE A 194 -16.744 5.829 -9.125 1.00 0.00 C ATOM 681 CG PHE A 194 -17.628 6.824 -8.427 1.00 0.00 C ATOM 682 CD1 PHE A 194 -19.002 6.551 -8.266 1.00 0.00 C ATOM 683 CD2 PHE A 194 -17.106 8.024 -7.918 1.00 0.00 C ATOM 684 CE1 PHE A 194 -19.853 7.468 -7.629 1.00 0.00 C ATOM 685 CE2 PHE A 194 -17.945 8.944 -7.253 1.00 0.00 C ATOM 686 CZ PHE A 194 -19.319 8.667 -7.114 1.00 0.00 C ATOM 0 H PHE A 194 -14.982 5.442 -7.421 1.00 0.00 H new ATOM 0 HA PHE A 194 -17.579 4.271 -7.928 1.00 0.00 H new ATOM 0 HB2 PHE A 194 -15.754 6.264 -9.264 1.00 0.00 H new ATOM 0 HB3 PHE A 194 -17.146 5.627 -10.118 1.00 0.00 H new ATOM 0 HD1 PHE A 194 -19.406 5.621 -8.639 1.00 0.00 H new ATOM 0 HD2 PHE A 194 -16.055 8.245 -8.036 1.00 0.00 H new ATOM 0 HE1 PHE A 194 -20.908 7.257 -7.534 1.00 0.00 H new ATOM 0 HE2 PHE A 194 -17.534 9.859 -6.852 1.00 0.00 H new ATOM 0 HZ PHE A 194 -19.964 9.373 -6.613 1.00 0.00 H new ATOM 696 N LYS A 195 -14.988 2.984 -9.291 1.00 0.00 N ATOM 697 CA LYS A 195 -14.569 1.792 -10.024 1.00 0.00 C ATOM 698 C LYS A 195 -15.232 0.582 -9.374 1.00 0.00 C ATOM 699 O LYS A 195 -15.748 -0.296 -10.053 1.00 0.00 O ATOM 700 CB LYS A 195 -13.045 1.651 -9.974 1.00 0.00 C ATOM 701 CG LYS A 195 -12.526 0.436 -10.710 1.00 0.00 C ATOM 702 CD LYS A 195 -11.012 0.348 -10.613 1.00 0.00 C ATOM 703 CE LYS A 195 -10.519 -1.015 -11.087 1.00 0.00 C ATOM 704 NZ LYS A 195 -10.912 -1.283 -12.511 1.00 0.00 N ATOM 0 H LYS A 195 -14.236 3.468 -8.800 1.00 0.00 H new ATOM 0 HA LYS A 195 -14.867 1.868 -11.070 1.00 0.00 H new ATOM 0 HB2 LYS A 195 -12.591 2.545 -10.401 1.00 0.00 H new ATOM 0 HB3 LYS A 195 -12.727 1.598 -8.933 1.00 0.00 H new ATOM 0 HG2 LYS A 195 -12.974 -0.466 -10.293 1.00 0.00 H new ATOM 0 HG3 LYS A 195 -12.825 0.485 -11.757 1.00 0.00 H new ATOM 0 HD2 LYS A 195 -10.558 1.134 -11.216 1.00 0.00 H new ATOM 0 HD3 LYS A 195 -10.698 0.515 -9.583 1.00 0.00 H new ATOM 0 HE2 LYS A 195 -9.434 -1.062 -10.994 1.00 0.00 H new ATOM 0 HE3 LYS A 195 -10.928 -1.794 -10.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 195 -10.475 -2.171 -12.831 1.00 0.00 H new ATOM 0 HZ2 LYS A 195 -11.947 -1.364 -12.576 1.00 0.00 H new ATOM 0 HZ3 LYS A 195 -10.587 -0.500 -13.114 1.00 0.00 H new ATOM 718 N ASP A 196 -15.217 0.558 -8.049 1.00 0.00 N ATOM 719 CA ASP A 196 -15.838 -0.518 -7.273 1.00 0.00 C ATOM 720 C ASP A 196 -17.360 -0.465 -7.384 1.00 0.00 C ATOM 721 O ASP A 196 -18.040 -1.479 -7.400 1.00 0.00 O ATOM 722 CB ASP A 196 -15.448 -0.357 -5.801 1.00 0.00 C ATOM 723 CG ASP A 196 -15.956 -1.487 -4.936 1.00 0.00 C ATOM 724 OD1 ASP A 196 -15.660 -2.655 -5.232 1.00 0.00 O ATOM 725 OD2 ASP A 196 -16.654 -1.190 -3.938 1.00 0.00 O ATOM 0 H ASP A 196 -14.777 1.280 -7.478 1.00 0.00 H new ATOM 0 HA ASP A 196 -15.490 -1.474 -7.665 1.00 0.00 H new ATOM 0 HB2 ASP A 196 -14.362 -0.303 -5.721 1.00 0.00 H new ATOM 0 HB3 ASP A 196 -15.842 0.588 -5.426 1.00 0.00 H new ATOM 730 N LYS A 197 -17.895 0.744 -7.467 1.00 0.00 N ATOM 731 CA LYS A 197 -19.346 0.950 -7.522 1.00 0.00 C ATOM 732 C LYS A 197 -19.867 0.982 -8.956 1.00 0.00 C ATOM 733 O LYS A 197 -20.899 1.573 -9.234 1.00 0.00 O ATOM 734 CB LYS A 197 -19.729 2.224 -6.740 1.00 0.00 C ATOM 735 CG LYS A 197 -20.069 1.952 -5.264 1.00 0.00 C ATOM 736 CD LYS A 197 -18.871 1.477 -4.435 1.00 0.00 C ATOM 737 CE LYS A 197 -19.295 1.054 -3.042 1.00 0.00 C ATOM 738 NZ LYS A 197 -18.121 0.484 -2.298 1.00 0.00 N ATOM 0 H LYS A 197 -17.348 1.605 -7.498 1.00 0.00 H new ATOM 0 HA LYS A 197 -19.829 0.097 -7.044 1.00 0.00 H new ATOM 0 HB2 LYS A 197 -18.904 2.935 -6.791 1.00 0.00 H new ATOM 0 HB3 LYS A 197 -20.586 2.695 -7.222 1.00 0.00 H new ATOM 0 HG2 LYS A 197 -20.470 2.862 -4.819 1.00 0.00 H new ATOM 0 HG3 LYS A 197 -20.856 1.199 -5.214 1.00 0.00 H new ATOM 0 HD2 LYS A 197 -18.386 0.641 -4.939 1.00 0.00 H new ATOM 0 HD3 LYS A 197 -18.134 2.277 -4.365 1.00 0.00 H new ATOM 0 HE2 LYS A 197 -19.699 1.909 -2.500 1.00 0.00 H new ATOM 0 HE3 LYS A 197 -20.091 0.312 -3.105 1.00 0.00 H new ATOM 0 HZ1 LYS A 197 -18.461 -0.086 -1.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 197 -17.563 -0.116 -2.938 1.00 0.00 H new ATOM 0 HZ3 LYS A 197 -17.525 1.259 -1.943 1.00 0.00 H new ATOM 752 N GLY A 198 -19.167 0.321 -9.865 1.00 0.00 N ATOM 753 CA GLY A 198 -19.606 0.245 -11.255 1.00 0.00 C ATOM 754 C GLY A 198 -20.661 -0.835 -11.468 1.00 0.00 C ATOM 755 O GLY A 198 -20.708 -1.482 -12.508 1.00 0.00 O ATOM 0 H GLY A 198 -18.295 -0.170 -9.669 1.00 0.00 H new ATOM 0 HA2 GLY A 198 -20.010 1.210 -11.560 1.00 0.00 H new ATOM 0 HA3 GLY A 198 -18.747 0.043 -11.895 1.00 0.00 H new ATOM 759 N ASP A 199 -21.501 -1.036 -10.463 1.00 0.00 N ATOM 760 CA ASP A 199 -22.536 -2.066 -10.479 1.00 0.00 C ATOM 761 C ASP A 199 -23.819 -1.559 -11.161 1.00 0.00 C ATOM 762 O ASP A 199 -24.140 -0.368 -11.122 1.00 0.00 O ATOM 763 CB ASP A 199 -22.824 -2.497 -9.034 1.00 0.00 C ATOM 764 CG ASP A 199 -24.229 -3.025 -8.850 1.00 0.00 C ATOM 765 OD1 ASP A 199 -24.590 -4.062 -9.444 1.00 0.00 O ATOM 766 OD2 ASP A 199 -24.993 -2.376 -8.115 1.00 0.00 O ATOM 0 H ASP A 199 -21.485 -0.485 -9.605 1.00 0.00 H new ATOM 0 HA ASP A 199 -22.182 -2.920 -11.056 1.00 0.00 H new ATOM 0 HB2 ASP A 199 -22.110 -3.266 -8.740 1.00 0.00 H new ATOM 0 HB3 ASP A 199 -22.670 -1.648 -8.369 1.00 0.00 H new ATOM 771 N SER A 200 -24.547 -2.479 -11.779 1.00 0.00 N ATOM 772 CA SER A 200 -25.777 -2.167 -12.503 1.00 0.00 C ATOM 773 C SER A 200 -26.836 -1.496 -11.622 1.00 0.00 C ATOM 774 O SER A 200 -27.473 -0.531 -12.044 1.00 0.00 O ATOM 775 CB SER A 200 -26.355 -3.458 -13.089 1.00 0.00 C ATOM 776 OG SER A 200 -27.494 -3.196 -13.888 1.00 0.00 O ATOM 0 H SER A 200 -24.302 -3.469 -11.794 1.00 0.00 H new ATOM 0 HA SER A 200 -25.518 -1.459 -13.290 1.00 0.00 H new ATOM 0 HB2 SER A 200 -25.595 -3.960 -13.688 1.00 0.00 H new ATOM 0 HB3 SER A 200 -26.624 -4.138 -12.281 1.00 0.00 H new ATOM 0 HG SER A 200 -27.840 -4.038 -14.250 1.00 0.00 H new ATOM 782 N ASN A 201 -27.030 -1.980 -10.401 1.00 0.00 N ATOM 783 CA ASN A 201 -28.038 -1.382 -9.519 1.00 0.00 C ATOM 784 C ASN A 201 -27.542 -0.030 -9.004 1.00 0.00 C ATOM 785 O ASN A 201 -28.309 0.926 -8.877 1.00 0.00 O ATOM 786 CB ASN A 201 -28.344 -2.306 -8.340 1.00 0.00 C ATOM 787 CG ASN A 201 -29.468 -1.789 -7.485 1.00 0.00 C ATOM 788 OD1 ASN A 201 -30.517 -1.416 -7.980 1.00 0.00 O ATOM 789 ND2 ASN A 201 -29.256 -1.761 -6.199 1.00 0.00 N ATOM 0 H ASN A 201 -26.518 -2.767 -10.001 1.00 0.00 H new ATOM 0 HA ASN A 201 -28.954 -1.237 -10.091 1.00 0.00 H new ATOM 0 HB2 ASN A 201 -28.602 -3.296 -8.715 1.00 0.00 H new ATOM 0 HB3 ASN A 201 -27.449 -2.420 -7.729 1.00 0.00 H new ATOM 0 HD21 ASN A 201 -29.982 -1.418 -5.570 1.00 0.00 H new ATOM 0 HD22 ASN A 201 -28.364 -2.082 -5.822 1.00 0.00 H new ATOM 796 N SER A 202 -26.249 0.049 -8.725 1.00 0.00 N ATOM 797 CA SER A 202 -25.614 1.283 -8.258 1.00 0.00 C ATOM 798 C SER A 202 -25.807 2.407 -9.270 1.00 0.00 C ATOM 799 O SER A 202 -25.832 3.583 -8.903 1.00 0.00 O ATOM 800 CB SER A 202 -24.119 1.057 -8.021 1.00 0.00 C ATOM 801 OG SER A 202 -23.530 2.179 -7.386 1.00 0.00 O ATOM 0 H SER A 202 -25.606 -0.738 -8.814 1.00 0.00 H new ATOM 0 HA SER A 202 -26.087 1.570 -7.319 1.00 0.00 H new ATOM 0 HB2 SER A 202 -23.975 0.169 -7.405 1.00 0.00 H new ATOM 0 HB3 SER A 202 -23.621 0.870 -8.972 1.00 0.00 H new ATOM 0 HG SER A 202 -22.620 1.953 -7.101 1.00 0.00 H new ATOM 807 N SER A 203 -25.974 2.050 -10.540 1.00 0.00 N ATOM 808 CA SER A 203 -26.192 3.035 -11.601 1.00 0.00 C ATOM 809 C SER A 203 -27.375 3.953 -11.279 1.00 0.00 C ATOM 810 O SER A 203 -27.373 5.131 -11.645 1.00 0.00 O ATOM 811 CB SER A 203 -26.444 2.336 -12.938 1.00 0.00 C ATOM 812 OG SER A 203 -26.494 3.273 -14.006 1.00 0.00 O ATOM 0 H SER A 203 -25.963 1.083 -10.863 1.00 0.00 H new ATOM 0 HA SER A 203 -25.290 3.642 -11.671 1.00 0.00 H new ATOM 0 HB2 SER A 203 -25.654 1.608 -13.126 1.00 0.00 H new ATOM 0 HB3 SER A 203 -27.382 1.783 -12.891 1.00 0.00 H new ATOM 0 HG SER A 203 -26.655 2.800 -14.849 1.00 0.00 H new ATOM 818 N ALA A 204 -28.380 3.436 -10.583 1.00 0.00 N ATOM 819 CA ALA A 204 -29.544 4.242 -10.218 1.00 0.00 C ATOM 820 C ALA A 204 -29.150 5.409 -9.293 1.00 0.00 C ATOM 821 O ALA A 204 -29.593 6.545 -9.490 1.00 0.00 O ATOM 822 CB ALA A 204 -30.597 3.354 -9.540 1.00 0.00 C ATOM 0 H ALA A 204 -28.415 2.469 -10.261 1.00 0.00 H new ATOM 0 HA ALA A 204 -29.964 4.669 -11.128 1.00 0.00 H new ATOM 0 HB1 ALA A 204 -31.463 3.958 -9.269 1.00 0.00 H new ATOM 0 HB2 ALA A 204 -30.905 2.566 -10.227 1.00 0.00 H new ATOM 0 HB3 ALA A 204 -30.172 2.907 -8.642 1.00 0.00 H new ATOM 828 N GLY A 205 -28.314 5.133 -8.301 1.00 0.00 N ATOM 829 CA GLY A 205 -27.887 6.169 -7.368 1.00 0.00 C ATOM 830 C GLY A 205 -26.845 7.071 -7.996 1.00 0.00 C ATOM 831 O GLY A 205 -26.782 8.266 -7.713 1.00 0.00 O ATOM 0 H GLY A 205 -27.921 4.209 -8.122 1.00 0.00 H new ATOM 0 HA2 GLY A 205 -28.748 6.762 -7.059 1.00 0.00 H new ATOM 0 HA3 GLY A 205 -27.479 5.707 -6.469 1.00 0.00 H new ATOM 835 N TRP A 206 -26.043 6.487 -8.872 1.00 0.00 N ATOM 836 CA TRP A 206 -25.000 7.194 -9.612 1.00 0.00 C ATOM 837 C TRP A 206 -25.580 8.372 -10.380 1.00 0.00 C ATOM 838 O TRP A 206 -25.163 9.524 -10.225 1.00 0.00 O ATOM 839 CB TRP A 206 -24.488 6.233 -10.676 1.00 0.00 C ATOM 840 CG TRP A 206 -23.181 5.650 -10.535 1.00 0.00 C ATOM 841 CD1 TRP A 206 -22.872 4.428 -10.043 1.00 0.00 C ATOM 842 CD2 TRP A 206 -21.949 6.205 -10.991 1.00 0.00 C ATOM 843 NE1 TRP A 206 -21.550 4.162 -10.169 1.00 0.00 N ATOM 844 CE2 TRP A 206 -20.944 5.222 -10.778 1.00 0.00 C ATOM 845 CE3 TRP A 206 -21.589 7.430 -11.580 1.00 0.00 C ATOM 846 CZ2 TRP A 206 -19.617 5.419 -11.169 1.00 0.00 C ATOM 847 CZ3 TRP A 206 -20.254 7.647 -11.935 1.00 0.00 C ATOM 848 CH2 TRP A 206 -19.283 6.634 -11.740 1.00 0.00 C ATOM 0 H TRP A 206 -26.096 5.493 -9.095 1.00 0.00 H new ATOM 0 HA TRP A 206 -24.238 7.536 -8.912 1.00 0.00 H new ATOM 0 HB2 TRP A 206 -25.204 5.415 -10.749 1.00 0.00 H new ATOM 0 HB3 TRP A 206 -24.509 6.761 -11.630 1.00 0.00 H new ATOM 0 HD1 TRP A 206 -23.589 3.750 -9.605 1.00 0.00 H new ATOM 0 HE1 TRP A 206 -21.084 3.309 -9.859 1.00 0.00 H new ATOM 0 HE3 TRP A 206 -22.333 8.193 -11.756 1.00 0.00 H new ATOM 0 HZ2 TRP A 206 -18.875 4.647 -11.030 1.00 0.00 H new ATOM 0 HZ3 TRP A 206 -19.961 8.595 -12.361 1.00 0.00 H new ATOM 0 HH2 TRP A 206 -18.262 6.814 -12.043 1.00 0.00 H new ATOM 859 N LYS A 207 -26.551 8.070 -11.234 1.00 0.00 N ATOM 860 CA LYS A 207 -27.125 9.082 -12.112 1.00 0.00 C ATOM 861 C LYS A 207 -27.926 10.093 -11.319 1.00 0.00 C ATOM 862 O LYS A 207 -27.979 11.255 -11.693 1.00 0.00 O ATOM 863 CB LYS A 207 -27.951 8.432 -13.241 1.00 0.00 C ATOM 864 CG LYS A 207 -29.247 7.720 -12.809 1.00 0.00 C ATOM 865 CD LYS A 207 -29.851 6.867 -13.948 1.00 0.00 C ATOM 866 CE LYS A 207 -29.084 5.545 -14.139 1.00 0.00 C ATOM 867 NZ LYS A 207 -29.628 4.654 -15.216 1.00 0.00 N ATOM 0 H LYS A 207 -26.955 7.139 -11.337 1.00 0.00 H new ATOM 0 HA LYS A 207 -26.311 9.626 -12.591 1.00 0.00 H new ATOM 0 HB2 LYS A 207 -28.209 9.204 -13.966 1.00 0.00 H new ATOM 0 HB3 LYS A 207 -27.318 7.710 -13.757 1.00 0.00 H new ATOM 0 HG2 LYS A 207 -29.040 7.082 -11.950 1.00 0.00 H new ATOM 0 HG3 LYS A 207 -29.977 8.462 -12.486 1.00 0.00 H new ATOM 0 HD2 LYS A 207 -30.896 6.652 -13.726 1.00 0.00 H new ATOM 0 HD3 LYS A 207 -29.832 7.436 -14.878 1.00 0.00 H new ATOM 0 HE2 LYS A 207 -28.043 5.774 -14.368 1.00 0.00 H new ATOM 0 HE3 LYS A 207 -29.090 4.998 -13.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 207 -29.053 3.790 -15.275 1.00 0.00 H new ATOM 0 HZ2 LYS A 207 -30.612 4.401 -14.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 207 -29.597 5.153 -16.128 1.00 0.00 H new ATOM 881 N ASN A 208 -28.538 9.666 -10.224 1.00 0.00 N ATOM 882 CA ASN A 208 -29.320 10.578 -9.394 1.00 0.00 C ATOM 883 C ASN A 208 -28.413 11.596 -8.705 1.00 0.00 C ATOM 884 O ASN A 208 -28.651 12.793 -8.788 1.00 0.00 O ATOM 885 CB ASN A 208 -30.113 9.781 -8.350 1.00 0.00 C ATOM 886 CG ASN A 208 -31.131 10.627 -7.613 1.00 0.00 C ATOM 887 OD1 ASN A 208 -30.814 11.651 -7.046 1.00 0.00 O ATOM 888 ND2 ASN A 208 -32.361 10.194 -7.629 1.00 0.00 N ATOM 0 H ASN A 208 -28.511 8.703 -9.889 1.00 0.00 H new ATOM 0 HA ASN A 208 -30.016 11.121 -10.034 1.00 0.00 H new ATOM 0 HB2 ASN A 208 -30.624 8.954 -8.843 1.00 0.00 H new ATOM 0 HB3 ASN A 208 -29.421 9.345 -7.630 1.00 0.00 H new ATOM 0 HD21 ASN A 208 -33.094 10.721 -7.154 1.00 0.00 H new ATOM 0 HD22 ASN A 208 -32.590 9.328 -8.116 1.00 0.00 H new ATOM 895 N SER A 209 -27.372 11.121 -8.035 1.00 0.00 N ATOM 896 CA SER A 209 -26.484 12.002 -7.275 1.00 0.00 C ATOM 897 C SER A 209 -25.777 13.036 -8.147 1.00 0.00 C ATOM 898 O SER A 209 -25.684 14.205 -7.785 1.00 0.00 O ATOM 899 CB SER A 209 -25.444 11.168 -6.536 1.00 0.00 C ATOM 900 OG SER A 209 -26.070 10.158 -5.761 1.00 0.00 O ATOM 0 H SER A 209 -27.119 10.134 -8.000 1.00 0.00 H new ATOM 0 HA SER A 209 -27.110 12.550 -6.571 1.00 0.00 H new ATOM 0 HB2 SER A 209 -24.760 10.712 -7.252 1.00 0.00 H new ATOM 0 HB3 SER A 209 -24.847 11.811 -5.890 1.00 0.00 H new ATOM 0 HG SER A 209 -26.324 9.411 -6.342 1.00 0.00 H new ATOM 906 N ILE A 210 -25.289 12.618 -9.307 1.00 0.00 N ATOM 907 CA ILE A 210 -24.622 13.553 -10.215 1.00 0.00 C ATOM 908 C ILE A 210 -25.652 14.576 -10.711 1.00 0.00 C ATOM 909 O ILE A 210 -25.368 15.772 -10.790 1.00 0.00 O ATOM 910 CB ILE A 210 -23.908 12.796 -11.384 1.00 0.00 C ATOM 911 CG1 ILE A 210 -22.719 11.999 -10.793 1.00 0.00 C ATOM 912 CG2 ILE A 210 -23.440 13.774 -12.489 1.00 0.00 C ATOM 913 CD1 ILE A 210 -22.073 10.983 -11.736 1.00 0.00 C ATOM 0 H ILE A 210 -25.338 11.656 -9.641 1.00 0.00 H new ATOM 0 HA ILE A 210 -23.834 14.088 -9.686 1.00 0.00 H new ATOM 0 HB ILE A 210 -24.610 12.109 -11.858 1.00 0.00 H new ATOM 0 HG12 ILE A 210 -21.955 12.706 -10.471 1.00 0.00 H new ATOM 0 HG13 ILE A 210 -23.063 11.474 -9.902 1.00 0.00 H new ATOM 0 HG21 ILE A 210 -22.948 13.215 -13.285 1.00 0.00 H new ATOM 0 HG22 ILE A 210 -24.302 14.303 -12.896 1.00 0.00 H new ATOM 0 HG23 ILE A 210 -22.740 14.494 -12.065 1.00 0.00 H new ATOM 0 HD11 ILE A 210 -21.252 10.481 -11.223 1.00 0.00 H new ATOM 0 HD12 ILE A 210 -22.816 10.246 -12.040 1.00 0.00 H new ATOM 0 HD13 ILE A 210 -21.690 11.497 -12.617 1.00 0.00 H new ATOM 925 N ARG A 211 -26.861 14.120 -11.021 1.00 0.00 N ATOM 926 CA ARG A 211 -27.917 15.031 -11.476 1.00 0.00 C ATOM 927 C ARG A 211 -28.319 16.025 -10.400 1.00 0.00 C ATOM 928 O ARG A 211 -28.675 17.149 -10.718 1.00 0.00 O ATOM 929 CB ARG A 211 -29.147 14.262 -11.920 1.00 0.00 C ATOM 930 CG ARG A 211 -29.046 13.813 -13.361 1.00 0.00 C ATOM 931 CD ARG A 211 -30.176 12.879 -13.699 1.00 0.00 C ATOM 932 NE ARG A 211 -31.495 13.527 -13.562 1.00 0.00 N ATOM 933 CZ ARG A 211 -32.139 14.186 -14.519 1.00 0.00 C ATOM 934 NH1 ARG A 211 -31.654 14.324 -15.729 1.00 0.00 N ATOM 935 NH2 ARG A 211 -33.297 14.722 -14.250 1.00 0.00 N ATOM 0 H ARG A 211 -27.137 13.139 -10.968 1.00 0.00 H new ATOM 0 HA ARG A 211 -27.503 15.582 -12.321 1.00 0.00 H new ATOM 0 HB2 ARG A 211 -29.282 13.392 -11.278 1.00 0.00 H new ATOM 0 HB3 ARG A 211 -30.030 14.889 -11.797 1.00 0.00 H new ATOM 0 HG2 ARG A 211 -29.072 14.680 -14.021 1.00 0.00 H new ATOM 0 HG3 ARG A 211 -28.091 13.314 -13.527 1.00 0.00 H new ATOM 0 HD2 ARG A 211 -30.054 12.519 -14.721 1.00 0.00 H new ATOM 0 HD3 ARG A 211 -30.132 12.007 -13.046 1.00 0.00 H new ATOM 0 HE ARG A 211 -31.952 13.463 -12.653 1.00 0.00 H new ATOM 0 HH11 ARG A 211 -30.749 13.917 -15.965 1.00 0.00 H new ATOM 0 HH12 ARG A 211 -32.182 14.838 -16.434 1.00 0.00 H new ATOM 0 HH21 ARG A 211 -33.696 14.632 -13.316 1.00 0.00 H new ATOM 0 HH22 ARG A 211 -33.804 15.231 -14.974 1.00 0.00 H new ATOM 949 N HIS A 212 -28.257 15.621 -9.141 1.00 0.00 N ATOM 950 CA HIS A 212 -28.626 16.500 -8.037 1.00 0.00 C ATOM 951 C HIS A 212 -27.763 17.760 -8.041 1.00 0.00 C ATOM 952 O HIS A 212 -28.282 18.866 -8.000 1.00 0.00 O ATOM 953 CB HIS A 212 -28.477 15.767 -6.699 1.00 0.00 C ATOM 954 CG HIS A 212 -29.042 16.519 -5.536 1.00 0.00 C ATOM 955 ND1 HIS A 212 -30.248 16.238 -4.945 1.00 0.00 N ATOM 956 CD2 HIS A 212 -28.539 17.570 -4.828 1.00 0.00 C ATOM 957 CE1 HIS A 212 -30.430 17.095 -3.944 1.00 0.00 C ATOM 958 NE2 HIS A 212 -29.418 17.931 -3.829 1.00 0.00 N ATOM 0 H HIS A 212 -27.955 14.690 -8.856 1.00 0.00 H new ATOM 0 HA HIS A 212 -29.668 16.791 -8.166 1.00 0.00 H new ATOM 0 HB2 HIS A 212 -28.971 14.798 -6.769 1.00 0.00 H new ATOM 0 HB3 HIS A 212 -27.420 15.573 -6.516 1.00 0.00 H new ATOM 0 HD2 HIS A 212 -27.591 18.050 -5.021 1.00 0.00 H new ATOM 0 HE1 HIS A 212 -31.300 17.104 -3.304 1.00 0.00 H new ATOM 0 HE2 HIS A 212 -29.309 18.683 -3.148 1.00 0.00 H new ATOM 966 N ASN A 213 -26.449 17.601 -8.106 1.00 0.00 N ATOM 967 CA ASN A 213 -25.562 18.767 -8.099 1.00 0.00 C ATOM 968 C ASN A 213 -25.708 19.607 -9.360 1.00 0.00 C ATOM 969 O ASN A 213 -25.587 20.826 -9.311 1.00 0.00 O ATOM 970 CB ASN A 213 -24.104 18.341 -7.955 1.00 0.00 C ATOM 971 CG ASN A 213 -23.788 17.826 -6.585 1.00 0.00 C ATOM 972 OD1 ASN A 213 -23.337 16.719 -6.427 1.00 0.00 O ATOM 973 ND2 ASN A 213 -24.012 18.634 -5.588 1.00 0.00 N ATOM 0 H ASN A 213 -25.976 16.699 -8.163 1.00 0.00 H new ATOM 0 HA ASN A 213 -25.857 19.374 -7.243 1.00 0.00 H new ATOM 0 HB2 ASN A 213 -23.881 17.568 -8.690 1.00 0.00 H new ATOM 0 HB3 ASN A 213 -23.457 19.190 -8.178 1.00 0.00 H new ATOM 0 HD21 ASN A 213 -23.805 18.337 -4.634 1.00 0.00 H new ATOM 0 HD22 ASN A 213 -24.395 19.564 -5.761 1.00 0.00 H new ATOM 980 N LEU A 214 -25.979 18.964 -10.487 1.00 0.00 N ATOM 981 CA LEU A 214 -26.170 19.696 -11.739 1.00 0.00 C ATOM 982 C LEU A 214 -27.442 20.539 -11.665 1.00 0.00 C ATOM 983 O LEU A 214 -27.505 21.619 -12.233 1.00 0.00 O ATOM 984 CB LEU A 214 -26.269 18.730 -12.925 1.00 0.00 C ATOM 985 CG LEU A 214 -24.981 17.984 -13.316 1.00 0.00 C ATOM 986 CD1 LEU A 214 -25.317 16.936 -14.369 1.00 0.00 C ATOM 987 CD2 LEU A 214 -23.911 18.931 -13.850 1.00 0.00 C ATOM 0 H LEU A 214 -26.071 17.951 -10.565 1.00 0.00 H new ATOM 0 HA LEU A 214 -25.308 20.347 -11.886 1.00 0.00 H new ATOM 0 HB2 LEU A 214 -27.036 17.989 -12.698 1.00 0.00 H new ATOM 0 HB3 LEU A 214 -26.615 19.291 -13.793 1.00 0.00 H new ATOM 0 HG LEU A 214 -24.577 17.510 -12.422 1.00 0.00 H new ATOM 0 HD11 LEU A 214 -24.410 16.402 -14.653 1.00 0.00 H new ATOM 0 HD12 LEU A 214 -26.042 16.231 -13.962 1.00 0.00 H new ATOM 0 HD13 LEU A 214 -25.740 17.425 -15.247 1.00 0.00 H new ATOM 0 HD21 LEU A 214 -23.020 18.361 -14.113 1.00 0.00 H new ATOM 0 HD22 LEU A 214 -24.288 19.444 -14.734 1.00 0.00 H new ATOM 0 HD23 LEU A 214 -23.659 19.665 -13.084 1.00 0.00 H new ATOM 999 N SER A 215 -28.445 20.040 -10.954 1.00 0.00 N ATOM 1000 CA SER A 215 -29.723 20.739 -10.812 1.00 0.00 C ATOM 1001 C SER A 215 -29.607 22.004 -9.970 1.00 0.00 C ATOM 1002 O SER A 215 -30.440 22.893 -10.080 1.00 0.00 O ATOM 1003 CB SER A 215 -30.760 19.816 -10.168 1.00 0.00 C ATOM 1004 OG SER A 215 -32.057 20.383 -10.248 1.00 0.00 O ATOM 0 H SER A 215 -28.400 19.148 -10.462 1.00 0.00 H new ATOM 0 HA SER A 215 -30.034 21.026 -11.816 1.00 0.00 H new ATOM 0 HB2 SER A 215 -30.750 18.847 -10.667 1.00 0.00 H new ATOM 0 HB3 SER A 215 -30.499 19.640 -9.124 1.00 0.00 H new ATOM 0 HG SER A 215 -32.705 19.777 -9.832 1.00 0.00 H new ATOM 1010 N LEU A 216 -28.573 22.091 -9.140 1.00 0.00 N ATOM 1011 CA LEU A 216 -28.358 23.282 -8.312 1.00 0.00 C ATOM 1012 C LEU A 216 -27.826 24.426 -9.169 1.00 0.00 C ATOM 1013 O LEU A 216 -27.920 25.580 -8.783 1.00 0.00 O ATOM 1014 CB LEU A 216 -27.356 22.991 -7.188 1.00 0.00 C ATOM 1015 CG LEU A 216 -27.733 21.881 -6.193 1.00 0.00 C ATOM 1016 CD1 LEU A 216 -26.562 21.635 -5.242 1.00 0.00 C ATOM 1017 CD2 LEU A 216 -28.986 22.229 -5.391 1.00 0.00 C ATOM 0 H LEU A 216 -27.873 21.359 -9.020 1.00 0.00 H new ATOM 0 HA LEU A 216 -29.315 23.564 -7.872 1.00 0.00 H new ATOM 0 HB2 LEU A 216 -26.401 22.729 -7.644 1.00 0.00 H new ATOM 0 HB3 LEU A 216 -27.199 23.912 -6.626 1.00 0.00 H new ATOM 0 HG LEU A 216 -27.952 20.979 -6.765 1.00 0.00 H new ATOM 0 HD11 LEU A 216 -26.826 20.848 -4.535 1.00 0.00 H new ATOM 0 HD12 LEU A 216 -25.686 21.329 -5.815 1.00 0.00 H new ATOM 0 HD13 LEU A 216 -26.337 22.552 -4.697 1.00 0.00 H new ATOM 0 HD21 LEU A 216 -29.214 21.416 -4.701 1.00 0.00 H new ATOM 0 HD22 LEU A 216 -28.814 23.146 -4.827 1.00 0.00 H new ATOM 0 HD23 LEU A 216 -29.825 22.374 -6.072 1.00 0.00 H new ATOM 1029 N HIS A 217 -27.264 24.060 -10.321 1.00 0.00 N ATOM 1030 CA HIS A 217 -26.704 24.976 -11.337 1.00 0.00 C ATOM 1031 C HIS A 217 -25.910 26.215 -10.861 1.00 0.00 C ATOM 1032 O HIS A 217 -25.801 27.204 -11.581 1.00 0.00 O ATOM 1033 CB HIS A 217 -27.817 25.393 -12.317 1.00 0.00 C ATOM 1034 CG HIS A 217 -28.904 26.219 -11.696 1.00 0.00 C ATOM 1035 ND1 HIS A 217 -28.782 27.548 -11.384 1.00 0.00 N ATOM 1036 CD2 HIS A 217 -30.171 25.884 -11.323 1.00 0.00 C ATOM 1037 CE1 HIS A 217 -29.933 27.961 -10.860 1.00 0.00 C ATOM 1038 NE2 HIS A 217 -30.820 26.987 -10.805 1.00 0.00 N ATOM 0 H HIS A 217 -27.179 23.080 -10.591 1.00 0.00 H new ATOM 0 HA HIS A 217 -25.926 24.378 -11.812 1.00 0.00 H new ATOM 0 HB2 HIS A 217 -27.372 25.956 -13.137 1.00 0.00 H new ATOM 0 HB3 HIS A 217 -28.260 24.496 -12.750 1.00 0.00 H new ATOM 0 HD1 HIS A 217 -27.951 28.122 -11.529 1.00 0.00 H new ATOM 0 HD2 HIS A 217 -30.604 24.899 -11.419 1.00 0.00 H new ATOM 0 HE1 HIS A 217 -30.118 28.970 -10.521 1.00 0.00 H new ATOM 1046 N SER A 218 -25.344 26.164 -9.663 1.00 0.00 N ATOM 1047 CA SER A 218 -24.579 27.290 -9.133 1.00 0.00 C ATOM 1048 C SER A 218 -23.318 27.534 -9.956 1.00 0.00 C ATOM 1049 O SER A 218 -23.016 28.662 -10.328 1.00 0.00 O ATOM 1050 CB SER A 218 -24.211 27.011 -7.678 1.00 0.00 C ATOM 1051 OG SER A 218 -23.667 25.705 -7.544 1.00 0.00 O ATOM 0 H SER A 218 -25.398 25.359 -9.039 1.00 0.00 H new ATOM 0 HA SER A 218 -25.194 28.188 -9.190 1.00 0.00 H new ATOM 0 HB2 SER A 218 -23.488 27.750 -7.331 1.00 0.00 H new ATOM 0 HB3 SER A 218 -25.095 27.110 -7.048 1.00 0.00 H new ATOM 0 HG SER A 218 -23.435 25.542 -6.606 1.00 0.00 H new ATOM 1057 N LYS A 219 -22.575 26.469 -10.234 1.00 0.00 N ATOM 1058 CA LYS A 219 -21.383 26.564 -11.084 1.00 0.00 C ATOM 1059 C LYS A 219 -21.489 25.778 -12.381 1.00 0.00 C ATOM 1060 O LYS A 219 -20.654 25.945 -13.267 1.00 0.00 O ATOM 1061 CB LYS A 219 -20.128 26.140 -10.316 1.00 0.00 C ATOM 1062 CG LYS A 219 -19.268 27.331 -9.832 1.00 0.00 C ATOM 1063 CD LYS A 219 -18.662 28.174 -10.992 1.00 0.00 C ATOM 1064 CE LYS A 219 -17.542 27.446 -11.744 1.00 0.00 C ATOM 1065 NZ LYS A 219 -16.253 27.494 -10.971 1.00 0.00 N ATOM 0 H LYS A 219 -22.772 25.530 -9.887 1.00 0.00 H new ATOM 0 HA LYS A 219 -21.306 27.615 -11.363 1.00 0.00 H new ATOM 0 HB2 LYS A 219 -20.424 25.542 -9.454 1.00 0.00 H new ATOM 0 HB3 LYS A 219 -19.520 25.499 -10.955 1.00 0.00 H new ATOM 0 HG2 LYS A 219 -19.880 27.979 -9.204 1.00 0.00 H new ATOM 0 HG3 LYS A 219 -18.459 26.954 -9.207 1.00 0.00 H new ATOM 0 HD2 LYS A 219 -19.453 28.435 -11.695 1.00 0.00 H new ATOM 0 HD3 LYS A 219 -18.273 29.109 -10.589 1.00 0.00 H new ATOM 0 HE2 LYS A 219 -17.829 26.408 -11.915 1.00 0.00 H new ATOM 0 HE3 LYS A 219 -17.400 27.903 -12.723 1.00 0.00 H new ATOM 0 HZ1 LYS A 219 -15.511 26.994 -11.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 219 -15.970 28.485 -10.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 219 -16.385 27.036 -10.047 1.00 0.00 H new ATOM 1079 N PHE A 220 -22.493 24.923 -12.487 1.00 0.00 N ATOM 1080 CA PHE A 220 -22.669 24.089 -13.675 1.00 0.00 C ATOM 1081 C PHE A 220 -23.702 24.721 -14.588 1.00 0.00 C ATOM 1082 O PHE A 220 -24.728 25.195 -14.122 1.00 0.00 O ATOM 1083 CB PHE A 220 -23.151 22.688 -13.289 1.00 0.00 C ATOM 1084 CG PHE A 220 -22.225 21.964 -12.352 1.00 0.00 C ATOM 1085 CD1 PHE A 220 -22.647 21.635 -11.050 1.00 0.00 C ATOM 1086 CD2 PHE A 220 -20.926 21.592 -12.761 1.00 0.00 C ATOM 1087 CE1 PHE A 220 -21.786 20.956 -10.160 1.00 0.00 C ATOM 1088 CE2 PHE A 220 -20.061 20.912 -11.878 1.00 0.00 C ATOM 1089 CZ PHE A 220 -20.493 20.599 -10.575 1.00 0.00 C ATOM 0 H PHE A 220 -23.202 24.785 -11.766 1.00 0.00 H new ATOM 0 HA PHE A 220 -21.708 24.010 -14.183 1.00 0.00 H new ATOM 0 HB2 PHE A 220 -24.134 22.767 -12.824 1.00 0.00 H new ATOM 0 HB3 PHE A 220 -23.274 22.094 -14.195 1.00 0.00 H new ATOM 0 HD1 PHE A 220 -23.642 21.905 -10.728 1.00 0.00 H new ATOM 0 HD2 PHE A 220 -20.591 21.830 -13.760 1.00 0.00 H new ATOM 0 HE1 PHE A 220 -22.121 20.712 -9.163 1.00 0.00 H new ATOM 0 HE2 PHE A 220 -19.069 20.632 -12.201 1.00 0.00 H new ATOM 0 HZ PHE A 220 -19.830 20.085 -9.895 1.00 0.00 H new ATOM 1099 N ILE A 221 -23.432 24.710 -15.884 1.00 0.00 N ATOM 1100 CA ILE A 221 -24.362 25.243 -16.875 1.00 0.00 C ATOM 1101 C ILE A 221 -24.621 24.136 -17.895 1.00 0.00 C ATOM 1102 O ILE A 221 -23.856 23.164 -17.980 1.00 0.00 O ATOM 1103 CB ILE A 221 -23.816 26.554 -17.550 1.00 0.00 C ATOM 1104 CG1 ILE A 221 -22.630 26.254 -18.480 1.00 0.00 C ATOM 1105 CG2 ILE A 221 -23.386 27.570 -16.475 1.00 0.00 C ATOM 1106 CD1 ILE A 221 -22.202 27.442 -19.360 1.00 0.00 C ATOM 0 H ILE A 221 -22.570 24.335 -16.279 1.00 0.00 H new ATOM 0 HA ILE A 221 -25.296 25.537 -16.396 1.00 0.00 H new ATOM 0 HB ILE A 221 -24.623 26.977 -18.148 1.00 0.00 H new ATOM 0 HG12 ILE A 221 -21.779 25.939 -17.876 1.00 0.00 H new ATOM 0 HG13 ILE A 221 -22.891 25.415 -19.124 1.00 0.00 H new ATOM 0 HG21 ILE A 221 -23.010 28.473 -16.957 1.00 0.00 H new ATOM 0 HG22 ILE A 221 -24.242 27.822 -15.850 1.00 0.00 H new ATOM 0 HG23 ILE A 221 -22.601 27.135 -15.857 1.00 0.00 H new ATOM 0 HD11 ILE A 221 -21.360 27.146 -19.986 1.00 0.00 H new ATOM 0 HD12 ILE A 221 -23.036 27.745 -19.993 1.00 0.00 H new ATOM 0 HD13 ILE A 221 -21.907 28.277 -18.725 1.00 0.00 H new ATOM 1118 N ARG A 222 -25.698 24.272 -18.658 1.00 0.00 N ATOM 1119 CA ARG A 222 -26.101 23.251 -19.627 1.00 0.00 C ATOM 1120 C ARG A 222 -26.065 23.799 -21.043 1.00 0.00 C ATOM 1121 O ARG A 222 -26.808 24.717 -21.372 1.00 0.00 O ATOM 1122 CB ARG A 222 -27.520 22.773 -19.308 1.00 0.00 C ATOM 1123 CG ARG A 222 -27.973 21.592 -20.161 1.00 0.00 C ATOM 1124 CD ARG A 222 -29.465 21.310 -19.980 1.00 0.00 C ATOM 1125 NE ARG A 222 -30.301 22.390 -20.543 1.00 0.00 N ATOM 1126 CZ ARG A 222 -30.743 22.456 -21.795 1.00 0.00 C ATOM 1127 NH1 ARG A 222 -30.486 21.532 -22.689 1.00 0.00 N ATOM 1128 NH2 ARG A 222 -31.469 23.479 -22.155 1.00 0.00 N ATOM 0 H ARG A 222 -26.314 25.084 -18.627 1.00 0.00 H new ATOM 0 HA ARG A 222 -25.400 22.419 -19.558 1.00 0.00 H new ATOM 0 HB2 ARG A 222 -27.572 22.492 -18.256 1.00 0.00 H new ATOM 0 HB3 ARG A 222 -28.214 23.601 -19.451 1.00 0.00 H new ATOM 0 HG2 ARG A 222 -27.766 21.799 -21.211 1.00 0.00 H new ATOM 0 HG3 ARG A 222 -27.399 20.706 -19.892 1.00 0.00 H new ATOM 0 HD2 ARG A 222 -29.717 20.366 -20.463 1.00 0.00 H new ATOM 0 HD3 ARG A 222 -29.687 21.195 -18.919 1.00 0.00 H new ATOM 0 HE ARG A 222 -30.562 23.151 -19.916 1.00 0.00 H new ATOM 0 HH11 ARG A 222 -29.925 20.719 -22.435 1.00 0.00 H new ATOM 0 HH12 ARG A 222 -30.847 21.626 -23.638 1.00 0.00 H new ATOM 0 HH21 ARG A 222 -31.689 24.211 -21.480 1.00 0.00 H new ATOM 0 HH22 ARG A 222 -31.817 23.546 -23.112 1.00 0.00 H new ATOM 1142 N VAL A 223 -25.217 23.228 -21.882 1.00 0.00 N ATOM 1143 CA VAL A 223 -25.131 23.651 -23.279 1.00 0.00 C ATOM 1144 C VAL A 223 -26.038 22.773 -24.106 1.00 0.00 C ATOM 1145 O VAL A 223 -26.145 21.556 -23.881 1.00 0.00 O ATOM 1146 CB VAL A 223 -23.712 23.525 -23.904 1.00 0.00 C ATOM 1147 CG1 VAL A 223 -23.518 24.553 -25.010 1.00 0.00 C ATOM 1148 CG2 VAL A 223 -22.629 23.664 -22.855 1.00 0.00 C ATOM 0 H VAL A 223 -24.579 22.474 -21.627 1.00 0.00 H new ATOM 0 HA VAL A 223 -25.410 24.705 -23.285 1.00 0.00 H new ATOM 0 HB VAL A 223 -23.630 22.528 -24.337 1.00 0.00 H new ATOM 0 HG11 VAL A 223 -22.519 24.448 -25.434 1.00 0.00 H new ATOM 0 HG12 VAL A 223 -24.262 24.393 -25.790 1.00 0.00 H new ATOM 0 HG13 VAL A 223 -23.634 25.556 -24.599 1.00 0.00 H new ATOM 0 HG21 VAL A 223 -21.651 23.571 -23.327 1.00 0.00 H new ATOM 0 HG22 VAL A 223 -22.709 24.640 -22.376 1.00 0.00 H new ATOM 0 HG23 VAL A 223 -22.746 22.881 -22.105 1.00 0.00 H new ATOM 1158 N GLN A 224 -26.682 23.389 -25.075 1.00 0.00 N ATOM 1159 CA GLN A 224 -27.489 22.662 -26.031 1.00 0.00 C ATOM 1160 C GLN A 224 -26.497 21.933 -26.946 1.00 0.00 C ATOM 1161 O GLN A 224 -25.315 22.258 -26.972 1.00 0.00 O ATOM 1162 CB GLN A 224 -28.377 23.635 -26.811 1.00 0.00 C ATOM 1163 CG GLN A 224 -29.338 24.417 -25.903 1.00 0.00 C ATOM 1164 CD GLN A 224 -30.290 25.300 -26.679 1.00 0.00 C ATOM 1165 OE1 GLN A 224 -31.039 24.829 -27.509 1.00 0.00 O ATOM 1166 NE2 GLN A 224 -30.269 26.578 -26.402 1.00 0.00 N ATOM 0 H GLN A 224 -26.661 24.398 -25.221 1.00 0.00 H new ATOM 0 HA GLN A 224 -28.160 21.949 -25.552 1.00 0.00 H new ATOM 0 HB2 GLN A 224 -27.747 24.337 -27.357 1.00 0.00 H new ATOM 0 HB3 GLN A 224 -28.953 23.081 -27.552 1.00 0.00 H new ATOM 0 HG2 GLN A 224 -29.912 23.715 -25.299 1.00 0.00 H new ATOM 0 HG3 GLN A 224 -28.760 25.032 -25.214 1.00 0.00 H new ATOM 0 HE21 GLN A 224 -29.625 26.937 -25.697 1.00 0.00 H new ATOM 0 HE22 GLN A 224 -30.897 27.216 -26.891 1.00 0.00 H new ATOM 1265 N SER A 232 -27.536 16.503 -23.423 1.00 0.00 N ATOM 1266 CA SER A 232 -27.047 17.868 -23.269 1.00 0.00 C ATOM 1267 C SER A 232 -25.620 17.835 -22.748 1.00 0.00 C ATOM 1268 O SER A 232 -25.195 16.844 -22.136 1.00 0.00 O ATOM 1269 CB SER A 232 -27.919 18.635 -22.284 1.00 0.00 C ATOM 1270 OG SER A 232 -29.254 18.725 -22.759 1.00 0.00 O ATOM 0 HA SER A 232 -27.081 18.366 -24.238 1.00 0.00 H new ATOM 0 HB2 SER A 232 -27.906 18.137 -21.315 1.00 0.00 H new ATOM 0 HB3 SER A 232 -27.513 19.635 -22.134 1.00 0.00 H new ATOM 0 HG SER A 232 -29.436 17.977 -23.366 1.00 0.00 H new ATOM 1276 N TRP A 233 -24.892 18.914 -22.974 1.00 0.00 N ATOM 1277 CA TRP A 233 -23.542 19.049 -22.455 1.00 0.00 C ATOM 1278 C TRP A 233 -23.649 19.709 -21.107 1.00 0.00 C ATOM 1279 O TRP A 233 -24.525 20.546 -20.890 1.00 0.00 O ATOM 1280 CB TRP A 233 -22.717 19.980 -23.321 1.00 0.00 C ATOM 1281 CG TRP A 233 -22.438 19.475 -24.684 1.00 0.00 C ATOM 1282 CD1 TRP A 233 -22.996 19.900 -25.844 1.00 0.00 C ATOM 1283 CD2 TRP A 233 -21.498 18.452 -25.062 1.00 0.00 C ATOM 1284 NE1 TRP A 233 -22.494 19.231 -26.916 1.00 0.00 N ATOM 1285 CE2 TRP A 233 -21.574 18.318 -26.480 1.00 0.00 C ATOM 1286 CE3 TRP A 233 -20.587 17.645 -24.352 1.00 0.00 C ATOM 1287 CZ2 TRP A 233 -20.790 17.388 -27.195 1.00 0.00 C ATOM 1288 CZ3 TRP A 233 -19.784 16.719 -25.065 1.00 0.00 C ATOM 1289 CH2 TRP A 233 -19.905 16.594 -26.483 1.00 0.00 C ATOM 0 H TRP A 233 -25.216 19.714 -23.517 1.00 0.00 H new ATOM 0 HA TRP A 233 -23.074 18.065 -22.421 1.00 0.00 H new ATOM 0 HB2 TRP A 233 -23.237 20.935 -23.402 1.00 0.00 H new ATOM 0 HB3 TRP A 233 -21.769 20.175 -22.820 1.00 0.00 H new ATOM 0 HD1 TRP A 233 -23.746 20.674 -25.909 1.00 0.00 H new ATOM 0 HE1 TRP A 233 -22.761 19.385 -27.888 1.00 0.00 H new ATOM 0 HE3 TRP A 233 -20.501 17.731 -23.279 1.00 0.00 H new ATOM 0 HZ2 TRP A 233 -20.877 17.297 -28.268 1.00 0.00 H new ATOM 0 HZ3 TRP A 233 -19.075 16.103 -24.532 1.00 0.00 H new ATOM 0 HH2 TRP A 233 -19.298 15.871 -27.007 1.00 0.00 H new ATOM 1300 N TRP A 234 -22.748 19.358 -20.216 1.00 0.00 N ATOM 1301 CA TRP A 234 -22.677 19.966 -18.910 1.00 0.00 C ATOM 1302 C TRP A 234 -21.269 20.501 -18.794 1.00 0.00 C ATOM 1303 O TRP A 234 -20.301 19.789 -19.087 1.00 0.00 O ATOM 1304 CB TRP A 234 -22.997 18.928 -17.841 1.00 0.00 C ATOM 1305 CG TRP A 234 -24.347 18.316 -18.082 1.00 0.00 C ATOM 1306 CD1 TRP A 234 -24.627 17.193 -18.791 1.00 0.00 C ATOM 1307 CD2 TRP A 234 -25.624 18.820 -17.645 1.00 0.00 C ATOM 1308 NE1 TRP A 234 -25.966 16.944 -18.832 1.00 0.00 N ATOM 1309 CE2 TRP A 234 -26.619 17.921 -18.135 1.00 0.00 C ATOM 1310 CE3 TRP A 234 -26.031 19.938 -16.891 1.00 0.00 C ATOM 1311 CZ2 TRP A 234 -27.995 18.107 -17.884 1.00 0.00 C ATOM 1312 CZ3 TRP A 234 -27.413 20.125 -16.627 1.00 0.00 C ATOM 1313 CH2 TRP A 234 -28.379 19.202 -17.127 1.00 0.00 C ATOM 0 H TRP A 234 -22.042 18.640 -20.380 1.00 0.00 H new ATOM 0 HA TRP A 234 -23.400 20.770 -18.773 1.00 0.00 H new ATOM 0 HB2 TRP A 234 -22.234 18.150 -17.843 1.00 0.00 H new ATOM 0 HB3 TRP A 234 -22.974 19.394 -16.856 1.00 0.00 H new ATOM 0 HD1 TRP A 234 -23.880 16.573 -19.265 1.00 0.00 H new ATOM 0 HE1 TRP A 234 -26.409 16.157 -19.306 1.00 0.00 H new ATOM 0 HE3 TRP A 234 -25.302 20.643 -16.519 1.00 0.00 H new ATOM 0 HZ2 TRP A 234 -28.728 17.415 -18.271 1.00 0.00 H new ATOM 0 HZ3 TRP A 234 -27.736 20.974 -16.042 1.00 0.00 H new ATOM 0 HH2 TRP A 234 -29.426 19.359 -16.912 1.00 0.00 H new ATOM 1324 N MET A 235 -21.152 21.755 -18.399 1.00 0.00 N ATOM 1325 CA MET A 235 -19.854 22.399 -18.266 1.00 0.00 C ATOM 1326 C MET A 235 -19.880 23.412 -17.145 1.00 0.00 C ATOM 1327 O MET A 235 -20.911 23.623 -16.520 1.00 0.00 O ATOM 1328 CB MET A 235 -19.441 23.066 -19.575 1.00 0.00 C ATOM 1329 CG MET A 235 -20.294 24.223 -20.003 1.00 0.00 C ATOM 1330 SD MET A 235 -19.646 24.998 -21.497 1.00 0.00 S ATOM 1331 CE MET A 235 -18.260 25.942 -20.829 1.00 0.00 C ATOM 0 H MET A 235 -21.944 22.353 -18.163 1.00 0.00 H new ATOM 0 HA MET A 235 -19.117 21.632 -18.027 1.00 0.00 H new ATOM 0 HB2 MET A 235 -18.412 23.411 -19.479 1.00 0.00 H new ATOM 0 HB3 MET A 235 -19.453 22.315 -20.365 1.00 0.00 H new ATOM 0 HG2 MET A 235 -21.313 23.880 -20.182 1.00 0.00 H new ATOM 0 HG3 MET A 235 -20.342 24.959 -19.200 1.00 0.00 H new ATOM 0 HE1 MET A 235 -17.771 26.490 -21.634 1.00 0.00 H new ATOM 0 HE2 MET A 235 -18.626 26.646 -20.081 1.00 0.00 H new ATOM 0 HE3 MET A 235 -17.545 25.261 -20.367 1.00 0.00 H new ATOM 1341 N LEU A 236 -18.741 24.027 -16.886 1.00 0.00 N ATOM 1342 CA LEU A 236 -18.616 25.006 -15.818 1.00 0.00 C ATOM 1343 C LEU A 236 -18.964 26.376 -16.384 1.00 0.00 C ATOM 1344 O LEU A 236 -18.745 26.624 -17.564 1.00 0.00 O ATOM 1345 CB LEU A 236 -17.173 25.006 -15.286 1.00 0.00 C ATOM 1346 CG LEU A 236 -16.608 23.618 -14.926 1.00 0.00 C ATOM 1347 CD1 LEU A 236 -15.127 23.705 -14.555 1.00 0.00 C ATOM 1348 CD2 LEU A 236 -17.392 22.951 -13.794 1.00 0.00 C ATOM 0 H LEU A 236 -17.879 23.864 -17.406 1.00 0.00 H new ATOM 0 HA LEU A 236 -19.290 24.761 -14.997 1.00 0.00 H new ATOM 0 HB2 LEU A 236 -16.526 25.461 -16.036 1.00 0.00 H new ATOM 0 HB3 LEU A 236 -17.129 25.640 -14.400 1.00 0.00 H new ATOM 0 HG LEU A 236 -16.714 22.998 -15.816 1.00 0.00 H new ATOM 0 HD11 LEU A 236 -14.755 22.711 -14.306 1.00 0.00 H new ATOM 0 HD12 LEU A 236 -14.563 24.102 -15.399 1.00 0.00 H new ATOM 0 HD13 LEU A 236 -15.005 24.364 -13.695 1.00 0.00 H new ATOM 0 HD21 LEU A 236 -16.957 21.976 -13.576 1.00 0.00 H new ATOM 0 HD22 LEU A 236 -17.347 23.576 -12.902 1.00 0.00 H new ATOM 0 HD23 LEU A 236 -18.432 22.825 -14.096 1.00 0.00 H new ATOM 1360 N ASN A 237 -19.491 27.264 -15.556 1.00 0.00 N ATOM 1361 CA ASN A 237 -19.783 28.628 -16.000 1.00 0.00 C ATOM 1362 C ASN A 237 -18.438 29.306 -16.350 1.00 0.00 C ATOM 1363 O ASN A 237 -17.527 29.315 -15.521 1.00 0.00 O ATOM 1364 CB ASN A 237 -20.523 29.400 -14.893 1.00 0.00 C ATOM 1365 CG ASN A 237 -20.898 30.804 -15.317 1.00 0.00 C ATOM 1366 OD1 ASN A 237 -20.072 31.537 -15.815 1.00 0.00 O ATOM 1367 ND2 ASN A 237 -22.130 31.172 -15.127 1.00 0.00 N ATOM 0 H ASN A 237 -19.725 27.073 -14.582 1.00 0.00 H new ATOM 0 HA ASN A 237 -20.431 28.619 -16.877 1.00 0.00 H new ATOM 0 HB2 ASN A 237 -21.425 28.855 -14.615 1.00 0.00 H new ATOM 0 HB3 ASN A 237 -19.893 29.448 -14.005 1.00 0.00 H new ATOM 0 HD21 ASN A 237 -22.431 32.107 -15.401 1.00 0.00 H new ATOM 0 HD22 ASN A 237 -22.796 30.525 -14.704 1.00 0.00 H new ATOM 1374 N PRO A 238 -18.297 29.866 -17.576 1.00 0.00 N ATOM 1375 CA PRO A 238 -17.021 30.474 -17.996 1.00 0.00 C ATOM 1376 C PRO A 238 -16.622 31.766 -17.288 1.00 0.00 C ATOM 1377 O PRO A 238 -15.442 32.062 -17.115 1.00 0.00 O ATOM 1378 CB PRO A 238 -17.259 30.775 -19.470 1.00 0.00 C ATOM 1379 CG PRO A 238 -18.723 30.941 -19.598 1.00 0.00 C ATOM 1380 CD PRO A 238 -19.308 29.950 -18.650 1.00 0.00 C ATOM 0 HA PRO A 238 -16.203 29.794 -17.760 1.00 0.00 H new ATOM 0 HB2 PRO A 238 -16.731 31.678 -19.778 1.00 0.00 H new ATOM 0 HB3 PRO A 238 -16.898 29.963 -20.101 1.00 0.00 H new ATOM 0 HG2 PRO A 238 -19.029 31.956 -19.346 1.00 0.00 H new ATOM 0 HG3 PRO A 238 -19.054 30.753 -20.619 1.00 0.00 H new ATOM 0 HD2 PRO A 238 -20.274 30.281 -18.268 1.00 0.00 H new ATOM 0 HD3 PRO A 238 -19.468 28.983 -19.127 1.00 0.00 H new