USER MOD reduce.3.24.130724 H: found=0, std=0, add=749, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 750 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 215 THR OG1 : rot 26:sc= 1.07 USER MOD Set 1.2: A 218 THR OG1 : rot -48:sc= 1.93 USER MOD Set 2.1: A 191 HIS :FLIP no HE2:sc= -10.3! C(o=-20!,f=-17!) USER MOD Set 2.2: A 201 HIS : no HD1:sc= -6.53! C(o=-17!,f=-18!) USER MOD Set 3.1: A 157 MET CE :methyl -120:sc= -1.6 (180deg=0) USER MOD Set 3.2: A 183 THR OG1 : rot 180:sc= 0 USER MOD Set 3.3: A 186 HIS : no HD1:sc= -2.55 K(o=-4.2,f=-6.7) USER MOD Set 4.1: A 178 LYS NZ :NH3+ 140:sc= 0.969 (180deg=0) USER MOD Set 4.2: A 181 GLN : amide:sc= 0.0537 K(o=1,f=-7.4!) USER MOD Single : A 141 HIS :FLIP no HD1:sc= -1.95 F(o=-3.7!,f=-1.9) USER MOD Single : A 146 ASN : amide:sc= -0.192 X(o=-0.19,f=0) USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 ASN : amide:sc= -0.101 K(o=-0.1,f=-0.69) USER MOD Single : A 156 MET CE :methyl -163:sc=-0.00803 (180deg=-0.183) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 163 GLN : amide:sc= -0.393 K(o=-0.39,f=-1.3) USER MOD Single : A 170 ASN : amide:sc= -0.0944 K(o=-0.094,f=-1.4!) USER MOD Single : A 172 ASN : amide:sc= -0.057 K(o=-0.057,f=-1.5!) USER MOD Single : A 173 ASN : amide:sc= 0.325 K(o=0.32,f=-4!) USER MOD Single : A 174 ASN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 175 GLN : amide:sc= 0 K(o=0,f=-0.93) USER MOD Single : A 177 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 182 MET CE :methyl -124:sc= 0 (180deg=-1.21) USER MOD Single : A 184 SER OG : rot 180:sc= -0.185 USER MOD Single : A 185 TYR OH : rot 180:sc= 0 USER MOD Single : A 188 MET CE :methyl 161:sc= -0.105 (180deg=-0.392) USER MOD Single : A 196 TYR OH : rot 180:sc= 0 USER MOD Single : A 199 MET CE :methyl -177:sc= -2.8! (180deg=-2.91!) USER MOD Single : A 202 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 205 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 206 THR OG1 : rot -65:sc= 0.693 USER MOD Single : A 208 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 213 ASN : amide:sc= -0.219 K(o=-0.22,f=-4.1!) USER MOD Single : A 214 LYS NZ :NH3+ 177:sc= 1.36 (180deg=1.22) USER MOD Single : A 216 SER OG : rot 180:sc= -0.0565 USER MOD Single : A 217 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 223 GLN : amide:sc= 0 K(o=0,f=-0.53) USER MOD Single : A 226 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 143 N ASP A 139 10.226 -3.835 11.707 1.00 0.00 N ATOM 144 CA ASP A 139 10.926 -3.993 10.437 1.00 0.00 C ATOM 145 C ASP A 139 9.938 -4.092 9.280 1.00 0.00 C ATOM 146 O ASP A 139 9.197 -5.070 9.164 1.00 0.00 O ATOM 147 CB ASP A 139 11.816 -5.237 10.473 1.00 0.00 C ATOM 148 CG ASP A 139 12.971 -5.095 11.443 1.00 0.00 C ATOM 149 OD1 ASP A 139 13.580 -4.006 11.485 1.00 0.00 O ATOM 150 OD2 ASP A 139 13.268 -6.074 12.160 1.00 0.00 O ATOM 0 HA ASP A 139 11.550 -3.113 10.282 1.00 0.00 H new ATOM 0 HB2 ASP A 139 11.215 -6.102 10.753 1.00 0.00 H new ATOM 0 HB3 ASP A 139 12.206 -5.430 9.474 1.00 0.00 H new ATOM 155 N LEU A 140 9.930 -3.074 8.427 1.00 0.00 N ATOM 156 CA LEU A 140 9.031 -3.045 7.278 1.00 0.00 C ATOM 157 C LEU A 140 9.578 -3.898 6.137 1.00 0.00 C ATOM 158 O LEU A 140 8.958 -4.881 5.730 1.00 0.00 O ATOM 159 CB LEU A 140 8.826 -1.606 6.802 1.00 0.00 C ATOM 160 CG LEU A 140 8.246 -0.635 7.830 1.00 0.00 C ATOM 161 CD1 LEU A 140 8.540 0.803 7.432 1.00 0.00 C ATOM 162 CD2 LEU A 140 6.747 -0.852 7.982 1.00 0.00 C ATOM 0 H LEU A 140 10.536 -2.257 8.509 1.00 0.00 H new ATOM 0 HA LEU A 140 8.071 -3.458 7.588 1.00 0.00 H new ATOM 0 HB2 LEU A 140 9.786 -1.216 6.465 1.00 0.00 H new ATOM 0 HB3 LEU A 140 8.166 -1.622 5.935 1.00 0.00 H new ATOM 0 HG LEU A 140 8.721 -0.828 8.792 1.00 0.00 H new ATOM 0 HD11 LEU A 140 8.119 1.480 8.176 1.00 0.00 H new ATOM 0 HD12 LEU A 140 9.618 0.952 7.375 1.00 0.00 H new ATOM 0 HD13 LEU A 140 8.093 1.010 6.459 1.00 0.00 H new ATOM 0 HD21 LEU A 140 6.351 -0.152 8.718 1.00 0.00 H new ATOM 0 HD22 LEU A 140 6.256 -0.687 7.023 1.00 0.00 H new ATOM 0 HD23 LEU A 140 6.559 -1.873 8.314 1.00 0.00 H new ATOM 174 N HIS A 141 10.744 -3.516 5.626 1.00 0.00 N ATOM 175 CA HIS A 141 11.377 -4.247 4.534 1.00 0.00 C ATOM 176 C HIS A 141 11.251 -5.753 4.744 1.00 0.00 C ATOM 177 O HIS A 141 10.639 -6.452 3.937 1.00 0.00 O ATOM 178 CB HIS A 141 12.850 -3.857 4.417 1.00 0.00 C ATOM 179 CG HIS A 141 13.642 -4.768 3.531 1.00 0.00 C ATOM 180 ND1 HIS A 141 13.827 -6.108 3.578 1.00 0.00 N flip ATOM 181 CD2 HIS A 141 14.362 -4.321 2.443 1.00 0.00 C flip ATOM 182 CE1 HIS A 141 14.646 -6.443 2.527 1.00 0.00 C flip ATOM 183 NE2 HIS A 141 14.953 -5.347 1.857 1.00 0.00 N flip ATOM 0 H HIS A 141 11.270 -2.704 5.951 1.00 0.00 H new ATOM 0 HA HIS A 141 10.866 -3.983 3.608 1.00 0.00 H new ATOM 0 HB2 HIS A 141 12.918 -2.839 4.032 1.00 0.00 H new ATOM 0 HB3 HIS A 141 13.296 -3.852 5.411 1.00 0.00 H new ATOM 0 HD2 HIS A 141 14.432 -3.293 2.120 1.00 0.00 H new ATOM 0 HE1 HIS A 141 14.984 -7.440 2.288 1.00 0.00 H new ATOM 0 HE2 HIS A 141 15.546 -5.301 1.028 1.00 0.00 H new ATOM 192 N GLU A 142 11.836 -6.244 5.832 1.00 0.00 N ATOM 193 CA GLU A 142 11.791 -7.668 6.146 1.00 0.00 C ATOM 194 C GLU A 142 10.429 -8.259 5.793 1.00 0.00 C ATOM 195 O GLU A 142 10.340 -9.262 5.084 1.00 0.00 O ATOM 196 CB GLU A 142 12.089 -7.895 7.629 1.00 0.00 C ATOM 197 CG GLU A 142 13.573 -7.983 7.945 1.00 0.00 C ATOM 198 CD GLU A 142 14.128 -9.381 7.755 1.00 0.00 C ATOM 199 OE1 GLU A 142 14.340 -9.782 6.592 1.00 0.00 O ATOM 200 OE2 GLU A 142 14.350 -10.074 8.770 1.00 0.00 O ATOM 0 H GLU A 142 12.346 -5.678 6.510 1.00 0.00 H new ATOM 0 HA GLU A 142 12.552 -8.171 5.549 1.00 0.00 H new ATOM 0 HB2 GLU A 142 11.650 -7.082 8.208 1.00 0.00 H new ATOM 0 HB3 GLU A 142 11.602 -8.815 7.952 1.00 0.00 H new ATOM 0 HG2 GLU A 142 14.119 -7.289 7.305 1.00 0.00 H new ATOM 0 HG3 GLU A 142 13.741 -7.666 8.974 1.00 0.00 H new ATOM 207 N PHE A 143 9.370 -7.631 6.293 1.00 0.00 N ATOM 208 CA PHE A 143 8.012 -8.096 6.033 1.00 0.00 C ATOM 209 C PHE A 143 7.714 -8.093 4.537 1.00 0.00 C ATOM 210 O PHE A 143 7.508 -9.146 3.931 1.00 0.00 O ATOM 211 CB PHE A 143 7.000 -7.215 6.768 1.00 0.00 C ATOM 212 CG PHE A 143 5.573 -7.626 6.542 1.00 0.00 C ATOM 213 CD1 PHE A 143 4.985 -8.598 7.335 1.00 0.00 C ATOM 214 CD2 PHE A 143 4.819 -7.039 5.538 1.00 0.00 C ATOM 215 CE1 PHE A 143 3.672 -8.979 7.129 1.00 0.00 C ATOM 216 CE2 PHE A 143 3.506 -7.415 5.328 1.00 0.00 C ATOM 217 CZ PHE A 143 2.931 -8.386 6.125 1.00 0.00 C ATOM 0 H PHE A 143 9.426 -6.799 6.880 1.00 0.00 H new ATOM 0 HA PHE A 143 7.928 -9.119 6.400 1.00 0.00 H new ATOM 0 HB2 PHE A 143 7.213 -7.244 7.837 1.00 0.00 H new ATOM 0 HB3 PHE A 143 7.128 -6.182 6.445 1.00 0.00 H new ATOM 0 HD1 PHE A 143 5.559 -9.063 8.123 1.00 0.00 H new ATOM 0 HD2 PHE A 143 5.263 -6.279 4.912 1.00 0.00 H new ATOM 0 HE1 PHE A 143 3.226 -9.740 7.753 1.00 0.00 H new ATOM 0 HE2 PHE A 143 2.930 -6.950 4.542 1.00 0.00 H new ATOM 0 HZ PHE A 143 1.905 -8.681 5.964 1.00 0.00 H new ATOM 227 N LEU A 144 7.693 -6.904 3.946 1.00 0.00 N ATOM 228 CA LEU A 144 7.419 -6.762 2.520 1.00 0.00 C ATOM 229 C LEU A 144 7.991 -7.940 1.736 1.00 0.00 C ATOM 230 O LEU A 144 7.278 -8.603 0.983 1.00 0.00 O ATOM 231 CB LEU A 144 8.008 -5.452 1.995 1.00 0.00 C ATOM 232 CG LEU A 144 7.368 -4.168 2.526 1.00 0.00 C ATOM 233 CD1 LEU A 144 8.150 -2.950 2.060 1.00 0.00 C ATOM 234 CD2 LEU A 144 5.915 -4.074 2.083 1.00 0.00 C ATOM 0 H LEU A 144 7.862 -6.023 4.432 1.00 0.00 H new ATOM 0 HA LEU A 144 6.338 -6.748 2.383 1.00 0.00 H new ATOM 0 HB2 LEU A 144 9.071 -5.432 2.237 1.00 0.00 H new ATOM 0 HB3 LEU A 144 7.929 -5.451 0.908 1.00 0.00 H new ATOM 0 HG LEU A 144 7.393 -4.195 3.615 1.00 0.00 H new ATOM 0 HD11 LEU A 144 7.680 -2.046 2.447 1.00 0.00 H new ATOM 0 HD12 LEU A 144 9.174 -3.013 2.428 1.00 0.00 H new ATOM 0 HD13 LEU A 144 8.157 -2.917 0.971 1.00 0.00 H new ATOM 0 HD21 LEU A 144 5.475 -3.155 2.470 1.00 0.00 H new ATOM 0 HD22 LEU A 144 5.866 -4.070 0.994 1.00 0.00 H new ATOM 0 HD23 LEU A 144 5.361 -4.931 2.468 1.00 0.00 H new ATOM 246 N VAL A 145 9.283 -8.195 1.921 1.00 0.00 N ATOM 247 CA VAL A 145 9.950 -9.294 1.234 1.00 0.00 C ATOM 248 C VAL A 145 9.382 -10.640 1.670 1.00 0.00 C ATOM 249 O VAL A 145 9.141 -11.520 0.844 1.00 0.00 O ATOM 250 CB VAL A 145 11.468 -9.281 1.497 1.00 0.00 C ATOM 251 CG1 VAL A 145 12.115 -10.547 0.955 1.00 0.00 C ATOM 252 CG2 VAL A 145 12.104 -8.043 0.883 1.00 0.00 C ATOM 0 H VAL A 145 9.888 -7.656 2.541 1.00 0.00 H new ATOM 0 HA VAL A 145 9.772 -9.156 0.168 1.00 0.00 H new ATOM 0 HB VAL A 145 11.632 -9.250 2.574 1.00 0.00 H new ATOM 0 HG11 VAL A 145 13.187 -10.520 1.150 1.00 0.00 H new ATOM 0 HG12 VAL A 145 11.679 -11.417 1.446 1.00 0.00 H new ATOM 0 HG13 VAL A 145 11.943 -10.612 -0.119 1.00 0.00 H new ATOM 0 HG21 VAL A 145 13.176 -8.050 1.078 1.00 0.00 H new ATOM 0 HG22 VAL A 145 11.931 -8.041 -0.193 1.00 0.00 H new ATOM 0 HG23 VAL A 145 11.661 -7.150 1.323 1.00 0.00 H new ATOM 262 N ASN A 146 9.169 -10.793 2.973 1.00 0.00 N ATOM 263 CA ASN A 146 8.628 -12.033 3.519 1.00 0.00 C ATOM 264 C ASN A 146 7.382 -12.467 2.753 1.00 0.00 C ATOM 265 O ASN A 146 7.238 -13.635 2.390 1.00 0.00 O ATOM 266 CB ASN A 146 8.294 -11.858 5.001 1.00 0.00 C ATOM 267 CG ASN A 146 8.099 -13.184 5.710 1.00 0.00 C ATOM 268 OD1 ASN A 146 9.061 -13.900 5.989 1.00 0.00 O ATOM 269 ND2 ASN A 146 6.848 -13.519 6.005 1.00 0.00 N ATOM 0 H ASN A 146 9.363 -10.074 3.670 1.00 0.00 H new ATOM 0 HA ASN A 146 9.386 -12.809 3.413 1.00 0.00 H new ATOM 0 HB2 ASN A 146 9.096 -11.303 5.488 1.00 0.00 H new ATOM 0 HB3 ASN A 146 7.388 -11.260 5.098 1.00 0.00 H new ATOM 0 HD21 ASN A 146 6.655 -14.400 6.481 1.00 0.00 H new ATOM 0 HD22 ASN A 146 6.081 -12.895 5.755 1.00 0.00 H new ATOM 276 N THR A 147 6.484 -11.517 2.508 1.00 0.00 N ATOM 277 CA THR A 147 5.250 -11.801 1.786 1.00 0.00 C ATOM 278 C THR A 147 5.522 -12.039 0.305 1.00 0.00 C ATOM 279 O THR A 147 4.969 -12.959 -0.298 1.00 0.00 O ATOM 280 CB THR A 147 4.237 -10.649 1.931 1.00 0.00 C ATOM 281 OG1 THR A 147 3.925 -10.443 3.314 1.00 0.00 O ATOM 282 CG2 THR A 147 2.963 -10.949 1.157 1.00 0.00 C ATOM 0 H THR A 147 6.589 -10.545 2.799 1.00 0.00 H new ATOM 0 HA THR A 147 4.828 -12.705 2.225 1.00 0.00 H new ATOM 0 HB THR A 147 4.687 -9.744 1.522 1.00 0.00 H new ATOM 0 HG1 THR A 147 3.282 -9.708 3.398 1.00 0.00 H new ATOM 0 HG21 THR A 147 2.263 -10.122 1.274 1.00 0.00 H new ATOM 0 HG22 THR A 147 3.200 -11.077 0.101 1.00 0.00 H new ATOM 0 HG23 THR A 147 2.511 -11.864 1.540 1.00 0.00 H new ATOM 290 N LEU A 148 6.378 -11.206 -0.276 1.00 0.00 N ATOM 291 CA LEU A 148 6.725 -11.326 -1.688 1.00 0.00 C ATOM 292 C LEU A 148 7.072 -12.769 -2.042 1.00 0.00 C ATOM 293 O LEU A 148 6.684 -13.272 -3.096 1.00 0.00 O ATOM 294 CB LEU A 148 7.901 -10.409 -2.025 1.00 0.00 C ATOM 295 CG LEU A 148 7.570 -8.925 -2.190 1.00 0.00 C ATOM 296 CD1 LEU A 148 8.844 -8.105 -2.319 1.00 0.00 C ATOM 297 CD2 LEU A 148 6.671 -8.711 -3.398 1.00 0.00 C ATOM 0 H LEU A 148 6.845 -10.440 0.209 1.00 0.00 H new ATOM 0 HA LEU A 148 5.858 -11.025 -2.277 1.00 0.00 H new ATOM 0 HB2 LEU A 148 8.650 -10.508 -1.239 1.00 0.00 H new ATOM 0 HB3 LEU A 148 8.359 -10.763 -2.948 1.00 0.00 H new ATOM 0 HG LEU A 148 7.036 -8.590 -1.301 1.00 0.00 H new ATOM 0 HD11 LEU A 148 8.589 -7.052 -2.436 1.00 0.00 H new ATOM 0 HD12 LEU A 148 9.452 -8.234 -1.424 1.00 0.00 H new ATOM 0 HD13 LEU A 148 9.406 -8.441 -3.191 1.00 0.00 H new ATOM 0 HD21 LEU A 148 6.446 -7.649 -3.500 1.00 0.00 H new ATOM 0 HD22 LEU A 148 7.179 -9.062 -4.296 1.00 0.00 H new ATOM 0 HD23 LEU A 148 5.743 -9.268 -3.264 1.00 0.00 H new ATOM 309 N LYS A 149 7.804 -13.431 -1.152 1.00 0.00 N ATOM 310 CA LYS A 149 8.202 -14.817 -1.368 1.00 0.00 C ATOM 311 C LYS A 149 7.158 -15.776 -0.806 1.00 0.00 C ATOM 312 O LYS A 149 6.651 -16.645 -1.516 1.00 0.00 O ATOM 313 CB LYS A 149 9.560 -15.086 -0.716 1.00 0.00 C ATOM 314 CG LYS A 149 10.674 -14.197 -1.242 1.00 0.00 C ATOM 315 CD LYS A 149 11.857 -14.163 -0.289 1.00 0.00 C ATOM 316 CE LYS A 149 13.092 -13.574 -0.954 1.00 0.00 C ATOM 317 NZ LYS A 149 14.273 -13.596 -0.048 1.00 0.00 N ATOM 0 H LYS A 149 8.134 -13.030 -0.274 1.00 0.00 H new ATOM 0 HA LYS A 149 8.282 -14.983 -2.442 1.00 0.00 H new ATOM 0 HB2 LYS A 149 9.471 -14.944 0.361 1.00 0.00 H new ATOM 0 HB3 LYS A 149 9.831 -16.129 -0.879 1.00 0.00 H new ATOM 0 HG2 LYS A 149 11.001 -14.560 -2.216 1.00 0.00 H new ATOM 0 HG3 LYS A 149 10.295 -13.186 -1.389 1.00 0.00 H new ATOM 0 HD2 LYS A 149 11.600 -13.573 0.591 1.00 0.00 H new ATOM 0 HD3 LYS A 149 12.076 -15.173 0.057 1.00 0.00 H new ATOM 0 HE2 LYS A 149 13.319 -14.135 -1.860 1.00 0.00 H new ATOM 0 HE3 LYS A 149 12.886 -12.548 -1.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 15.094 -13.186 -0.538 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 14.066 -13.039 0.806 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 14.485 -14.578 0.222 1.00 0.00 H new ATOM 331 N LYS A 150 6.839 -15.613 0.474 1.00 0.00 N ATOM 332 CA LYS A 150 5.852 -16.462 1.132 1.00 0.00 C ATOM 333 C LYS A 150 4.587 -16.580 0.288 1.00 0.00 C ATOM 334 O LYS A 150 4.146 -17.682 -0.035 1.00 0.00 O ATOM 335 CB LYS A 150 5.506 -15.901 2.513 1.00 0.00 C ATOM 336 CG LYS A 150 6.558 -16.193 3.569 1.00 0.00 C ATOM 337 CD LYS A 150 6.438 -17.612 4.098 1.00 0.00 C ATOM 338 CE LYS A 150 5.295 -17.741 5.094 1.00 0.00 C ATOM 339 NZ LYS A 150 5.383 -19.003 5.879 1.00 0.00 N ATOM 0 H LYS A 150 7.250 -14.900 1.077 1.00 0.00 H new ATOM 0 HA LYS A 150 6.284 -17.456 1.248 1.00 0.00 H new ATOM 0 HB2 LYS A 150 5.372 -14.822 2.434 1.00 0.00 H new ATOM 0 HB3 LYS A 150 4.552 -16.318 2.837 1.00 0.00 H new ATOM 0 HG2 LYS A 150 7.551 -16.044 3.145 1.00 0.00 H new ATOM 0 HG3 LYS A 150 6.454 -15.487 4.393 1.00 0.00 H new ATOM 0 HD2 LYS A 150 6.277 -18.299 3.267 1.00 0.00 H new ATOM 0 HD3 LYS A 150 7.373 -17.904 4.576 1.00 0.00 H new ATOM 0 HE2 LYS A 150 5.308 -16.889 5.774 1.00 0.00 H new ATOM 0 HE3 LYS A 150 4.344 -17.710 4.562 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 4.587 -19.053 6.546 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 5.345 -19.817 5.233 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 6.279 -19.022 6.407 1.00 0.00 H new ATOM 353 N ASN A 151 4.009 -15.437 -0.068 1.00 0.00 N ATOM 354 CA ASN A 151 2.795 -15.413 -0.875 1.00 0.00 C ATOM 355 C ASN A 151 2.988 -14.555 -2.122 1.00 0.00 C ATOM 356 O ASN A 151 2.692 -13.360 -2.135 1.00 0.00 O ATOM 357 CB ASN A 151 1.621 -14.880 -0.052 1.00 0.00 C ATOM 358 CG ASN A 151 0.939 -15.968 0.755 1.00 0.00 C ATOM 359 OD1 ASN A 151 0.720 -17.076 0.265 1.00 0.00 O ATOM 360 ND2 ASN A 151 0.600 -15.656 2.000 1.00 0.00 N ATOM 0 H ASN A 151 4.362 -14.515 0.190 1.00 0.00 H new ATOM 0 HA ASN A 151 2.576 -16.434 -1.188 1.00 0.00 H new ATOM 0 HB2 ASN A 151 1.977 -14.101 0.622 1.00 0.00 H new ATOM 0 HB3 ASN A 151 0.894 -14.416 -0.719 1.00 0.00 H new ATOM 0 HD21 ASN A 151 0.139 -16.347 2.591 1.00 0.00 H new ATOM 0 HD22 ASN A 151 0.801 -14.725 2.365 1.00 0.00 H new ATOM 367 N PRO A 152 3.495 -15.179 -3.196 1.00 0.00 N ATOM 368 CA PRO A 152 3.737 -14.492 -4.469 1.00 0.00 C ATOM 369 C PRO A 152 2.442 -14.112 -5.178 1.00 0.00 C ATOM 370 O PRO A 152 2.381 -13.103 -5.881 1.00 0.00 O ATOM 371 CB PRO A 152 4.513 -15.526 -5.288 1.00 0.00 C ATOM 372 CG PRO A 152 4.109 -16.842 -4.717 1.00 0.00 C ATOM 373 CD PRO A 152 3.870 -16.601 -3.252 1.00 0.00 C ATOM 0 HA PRO A 152 4.270 -13.552 -4.330 1.00 0.00 H new ATOM 0 HB2 PRO A 152 4.263 -15.461 -6.347 1.00 0.00 H new ATOM 0 HB3 PRO A 152 5.589 -15.371 -5.204 1.00 0.00 H new ATOM 0 HG2 PRO A 152 3.209 -17.218 -5.203 1.00 0.00 H new ATOM 0 HG3 PRO A 152 4.889 -17.589 -4.868 1.00 0.00 H new ATOM 0 HD2 PRO A 152 3.078 -17.241 -2.864 1.00 0.00 H new ATOM 0 HD3 PRO A 152 4.763 -16.805 -2.661 1.00 0.00 H new ATOM 381 N ARG A 153 1.409 -14.926 -4.990 1.00 0.00 N ATOM 382 CA ARG A 153 0.115 -14.675 -5.613 1.00 0.00 C ATOM 383 C ARG A 153 -0.311 -13.223 -5.416 1.00 0.00 C ATOM 384 O ARG A 153 -1.078 -12.678 -6.209 1.00 0.00 O ATOM 385 CB ARG A 153 -0.945 -15.613 -5.032 1.00 0.00 C ATOM 386 CG ARG A 153 -1.137 -15.460 -3.532 1.00 0.00 C ATOM 387 CD ARG A 153 -2.181 -16.431 -3.002 1.00 0.00 C ATOM 388 NE ARG A 153 -2.199 -16.472 -1.542 1.00 0.00 N ATOM 389 CZ ARG A 153 -3.171 -17.037 -0.835 1.00 0.00 C ATOM 390 NH1 ARG A 153 -4.198 -17.606 -1.450 1.00 0.00 N ATOM 391 NH2 ARG A 153 -3.116 -17.034 0.491 1.00 0.00 N ATOM 0 H ARG A 153 1.443 -15.765 -4.411 1.00 0.00 H new ATOM 0 HA ARG A 153 0.211 -14.865 -6.682 1.00 0.00 H new ATOM 0 HB2 ARG A 153 -1.896 -15.428 -5.532 1.00 0.00 H new ATOM 0 HB3 ARG A 153 -0.665 -16.644 -5.251 1.00 0.00 H new ATOM 0 HG2 ARG A 153 -0.188 -15.631 -3.023 1.00 0.00 H new ATOM 0 HG3 ARG A 153 -1.441 -14.438 -3.305 1.00 0.00 H new ATOM 0 HD2 ARG A 153 -3.166 -16.140 -3.369 1.00 0.00 H new ATOM 0 HD3 ARG A 153 -1.978 -17.429 -3.390 1.00 0.00 H new ATOM 0 HE ARG A 153 -1.423 -16.043 -1.038 1.00 0.00 H new ATOM 0 HH11 ARG A 153 -4.243 -17.611 -2.469 1.00 0.00 H new ATOM 0 HH12 ARG A 153 -4.943 -18.039 -0.904 1.00 0.00 H new ATOM 0 HH21 ARG A 153 -2.327 -16.598 0.968 1.00 0.00 H new ATOM 0 HH22 ARG A 153 -3.863 -17.468 1.033 1.00 0.00 H new ATOM 405 N ASP A 154 0.191 -12.604 -4.353 1.00 0.00 N ATOM 406 CA ASP A 154 -0.137 -11.216 -4.051 1.00 0.00 C ATOM 407 C ASP A 154 0.912 -10.272 -4.630 1.00 0.00 C ATOM 408 O ASP A 154 0.648 -9.088 -4.840 1.00 0.00 O ATOM 409 CB ASP A 154 -0.246 -11.012 -2.539 1.00 0.00 C ATOM 410 CG ASP A 154 -1.648 -11.264 -2.021 1.00 0.00 C ATOM 411 OD1 ASP A 154 -2.464 -10.319 -2.035 1.00 0.00 O ATOM 412 OD2 ASP A 154 -1.930 -12.406 -1.600 1.00 0.00 O ATOM 0 H ASP A 154 0.827 -13.042 -3.686 1.00 0.00 H new ATOM 0 HA ASP A 154 -1.099 -10.988 -4.510 1.00 0.00 H new ATOM 0 HB2 ASP A 154 0.451 -11.681 -2.034 1.00 0.00 H new ATOM 0 HB3 ASP A 154 0.053 -9.994 -2.290 1.00 0.00 H new ATOM 417 N ARG A 155 2.103 -10.803 -4.885 1.00 0.00 N ATOM 418 CA ARG A 155 3.193 -10.008 -5.437 1.00 0.00 C ATOM 419 C ARG A 155 2.710 -9.168 -6.616 1.00 0.00 C ATOM 420 O ARG A 155 2.954 -7.964 -6.675 1.00 0.00 O ATOM 421 CB ARG A 155 4.342 -10.915 -5.880 1.00 0.00 C ATOM 422 CG ARG A 155 5.433 -10.186 -6.647 1.00 0.00 C ATOM 423 CD ARG A 155 6.389 -11.161 -7.317 1.00 0.00 C ATOM 424 NE ARG A 155 6.991 -10.596 -8.522 1.00 0.00 N ATOM 425 CZ ARG A 155 6.313 -10.361 -9.640 1.00 0.00 C ATOM 426 NH1 ARG A 155 5.019 -10.639 -9.706 1.00 0.00 N ATOM 427 NH2 ARG A 155 6.931 -9.846 -10.696 1.00 0.00 N ATOM 0 H ARG A 155 2.338 -11.781 -4.718 1.00 0.00 H new ATOM 0 HA ARG A 155 3.550 -9.336 -4.656 1.00 0.00 H new ATOM 0 HB2 ARG A 155 4.781 -11.387 -5.001 1.00 0.00 H new ATOM 0 HB3 ARG A 155 3.943 -11.714 -6.504 1.00 0.00 H new ATOM 0 HG2 ARG A 155 4.981 -9.542 -7.401 1.00 0.00 H new ATOM 0 HG3 ARG A 155 5.988 -9.540 -5.967 1.00 0.00 H new ATOM 0 HD2 ARG A 155 7.175 -11.438 -6.615 1.00 0.00 H new ATOM 0 HD3 ARG A 155 5.854 -12.075 -7.574 1.00 0.00 H new ATOM 0 HE ARG A 155 7.985 -10.370 -8.504 1.00 0.00 H new ATOM 0 HH11 ARG A 155 4.540 -11.035 -8.897 1.00 0.00 H new ATOM 0 HH12 ARG A 155 4.502 -10.457 -10.566 1.00 0.00 H new ATOM 0 HH21 ARG A 155 7.927 -9.631 -10.649 1.00 0.00 H new ATOM 0 HH22 ARG A 155 6.410 -9.666 -11.554 1.00 0.00 H new ATOM 441 N MET A 156 2.023 -9.814 -7.554 1.00 0.00 N ATOM 442 CA MET A 156 1.506 -9.127 -8.731 1.00 0.00 C ATOM 443 C MET A 156 0.728 -7.876 -8.332 1.00 0.00 C ATOM 444 O MET A 156 1.023 -6.776 -8.798 1.00 0.00 O ATOM 445 CB MET A 156 0.607 -10.063 -9.541 1.00 0.00 C ATOM 446 CG MET A 156 1.373 -10.965 -10.495 1.00 0.00 C ATOM 447 SD MET A 156 0.532 -12.531 -10.797 1.00 0.00 S ATOM 448 CE MET A 156 0.831 -13.380 -9.248 1.00 0.00 C ATOM 0 H MET A 156 1.812 -10.811 -7.521 1.00 0.00 H new ATOM 0 HA MET A 156 2.354 -8.826 -9.347 1.00 0.00 H new ATOM 0 HB2 MET A 156 0.028 -10.681 -8.855 1.00 0.00 H new ATOM 0 HB3 MET A 156 -0.105 -9.466 -10.111 1.00 0.00 H new ATOM 0 HG2 MET A 156 1.517 -10.446 -11.443 1.00 0.00 H new ATOM 0 HG3 MET A 156 2.364 -11.162 -10.086 1.00 0.00 H new ATOM 0 HE1 MET A 156 0.648 -14.447 -9.376 1.00 0.00 H new ATOM 0 HE2 MET A 156 1.865 -13.224 -8.941 1.00 0.00 H new ATOM 0 HE3 MET A 156 0.162 -12.986 -8.482 1.00 0.00 H new ATOM 458 N MET A 157 -0.266 -8.053 -7.469 1.00 0.00 N ATOM 459 CA MET A 157 -1.085 -6.938 -7.008 1.00 0.00 C ATOM 460 C MET A 157 -0.224 -5.872 -6.338 1.00 0.00 C ATOM 461 O MET A 157 -0.267 -4.700 -6.713 1.00 0.00 O ATOM 462 CB MET A 157 -2.156 -7.433 -6.033 1.00 0.00 C ATOM 463 CG MET A 157 -3.215 -6.391 -5.714 1.00 0.00 C ATOM 464 SD MET A 157 -4.407 -6.964 -4.489 1.00 0.00 S ATOM 465 CE MET A 157 -5.003 -5.405 -3.839 1.00 0.00 C ATOM 0 H MET A 157 -0.524 -8.958 -7.075 1.00 0.00 H new ATOM 0 HA MET A 157 -1.572 -6.494 -7.876 1.00 0.00 H new ATOM 0 HB2 MET A 157 -2.640 -8.314 -6.454 1.00 0.00 H new ATOM 0 HB3 MET A 157 -1.675 -7.746 -5.106 1.00 0.00 H new ATOM 0 HG2 MET A 157 -2.730 -5.486 -5.348 1.00 0.00 H new ATOM 0 HG3 MET A 157 -3.742 -6.122 -6.630 1.00 0.00 H new ATOM 0 HE1 MET A 157 -4.796 -5.354 -2.770 1.00 0.00 H new ATOM 0 HE2 MET A 157 -4.498 -4.583 -4.346 1.00 0.00 H new ATOM 0 HE3 MET A 157 -6.078 -5.329 -4.005 1.00 0.00 H new ATOM 475 N LEU A 158 0.556 -6.286 -5.345 1.00 0.00 N ATOM 476 CA LEU A 158 1.427 -5.366 -4.623 1.00 0.00 C ATOM 477 C LEU A 158 2.186 -4.462 -5.589 1.00 0.00 C ATOM 478 O LEU A 158 2.238 -3.245 -5.408 1.00 0.00 O ATOM 479 CB LEU A 158 2.415 -6.145 -3.752 1.00 0.00 C ATOM 480 CG LEU A 158 1.836 -6.788 -2.492 1.00 0.00 C ATOM 481 CD1 LEU A 158 2.809 -7.804 -1.916 1.00 0.00 C ATOM 482 CD2 LEU A 158 1.498 -5.724 -1.457 1.00 0.00 C ATOM 0 H LEU A 158 0.603 -7.252 -5.022 1.00 0.00 H new ATOM 0 HA LEU A 158 0.803 -4.741 -3.984 1.00 0.00 H new ATOM 0 HB2 LEU A 158 2.866 -6.928 -4.361 1.00 0.00 H new ATOM 0 HB3 LEU A 158 3.218 -5.470 -3.455 1.00 0.00 H new ATOM 0 HG LEU A 158 0.917 -7.308 -2.762 1.00 0.00 H new ATOM 0 HD11 LEU A 158 2.380 -8.251 -1.020 1.00 0.00 H new ATOM 0 HD12 LEU A 158 3.001 -8.583 -2.654 1.00 0.00 H new ATOM 0 HD13 LEU A 158 3.745 -7.307 -1.661 1.00 0.00 H new ATOM 0 HD21 LEU A 158 1.087 -6.200 -0.567 1.00 0.00 H new ATOM 0 HD22 LEU A 158 2.401 -5.175 -1.191 1.00 0.00 H new ATOM 0 HD23 LEU A 158 0.763 -5.034 -1.871 1.00 0.00 H new ATOM 494 N LEU A 159 2.773 -5.065 -6.617 1.00 0.00 N ATOM 495 CA LEU A 159 3.528 -4.315 -7.615 1.00 0.00 C ATOM 496 C LEU A 159 2.647 -3.270 -8.292 1.00 0.00 C ATOM 497 O LEU A 159 3.054 -2.122 -8.474 1.00 0.00 O ATOM 498 CB LEU A 159 4.109 -5.265 -8.664 1.00 0.00 C ATOM 499 CG LEU A 159 5.206 -6.213 -8.176 1.00 0.00 C ATOM 500 CD1 LEU A 159 5.539 -7.239 -9.247 1.00 0.00 C ATOM 501 CD2 LEU A 159 6.449 -5.431 -7.778 1.00 0.00 C ATOM 0 H LEU A 159 2.741 -6.071 -6.781 1.00 0.00 H new ATOM 0 HA LEU A 159 4.344 -3.802 -7.107 1.00 0.00 H new ATOM 0 HB2 LEU A 159 3.295 -5.863 -9.074 1.00 0.00 H new ATOM 0 HB3 LEU A 159 4.510 -4.668 -9.483 1.00 0.00 H new ATOM 0 HG LEU A 159 4.838 -6.742 -7.297 1.00 0.00 H new ATOM 0 HD11 LEU A 159 6.321 -7.905 -8.882 1.00 0.00 H new ATOM 0 HD12 LEU A 159 4.648 -7.821 -9.483 1.00 0.00 H new ATOM 0 HD13 LEU A 159 5.887 -6.728 -10.145 1.00 0.00 H new ATOM 0 HD21 LEU A 159 7.219 -6.122 -7.433 1.00 0.00 H new ATOM 0 HD22 LEU A 159 6.820 -4.874 -8.639 1.00 0.00 H new ATOM 0 HD23 LEU A 159 6.200 -4.736 -6.976 1.00 0.00 H new ATOM 513 N LYS A 160 1.437 -3.674 -8.662 1.00 0.00 N ATOM 514 CA LYS A 160 0.495 -2.773 -9.316 1.00 0.00 C ATOM 515 C LYS A 160 0.319 -1.491 -8.508 1.00 0.00 C ATOM 516 O LYS A 160 0.490 -0.388 -9.030 1.00 0.00 O ATOM 517 CB LYS A 160 -0.858 -3.462 -9.501 1.00 0.00 C ATOM 518 CG LYS A 160 -1.948 -2.536 -10.011 1.00 0.00 C ATOM 519 CD LYS A 160 -3.333 -3.087 -9.715 1.00 0.00 C ATOM 520 CE LYS A 160 -3.756 -2.791 -8.284 1.00 0.00 C ATOM 521 NZ LYS A 160 -5.229 -2.918 -8.104 1.00 0.00 N ATOM 0 H LYS A 160 1.085 -4.621 -8.520 1.00 0.00 H new ATOM 0 HA LYS A 160 0.899 -2.513 -10.294 1.00 0.00 H new ATOM 0 HB2 LYS A 160 -0.741 -4.291 -10.199 1.00 0.00 H new ATOM 0 HB3 LYS A 160 -1.172 -3.889 -8.548 1.00 0.00 H new ATOM 0 HG2 LYS A 160 -1.839 -1.555 -9.548 1.00 0.00 H new ATOM 0 HG3 LYS A 160 -1.834 -2.396 -11.086 1.00 0.00 H new ATOM 0 HD2 LYS A 160 -4.054 -2.652 -10.406 1.00 0.00 H new ATOM 0 HD3 LYS A 160 -3.341 -4.164 -9.883 1.00 0.00 H new ATOM 0 HE2 LYS A 160 -3.247 -3.476 -7.606 1.00 0.00 H new ATOM 0 HE3 LYS A 160 -3.443 -1.783 -8.014 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -5.477 -2.709 -7.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 -5.715 -2.247 -8.733 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -5.525 -3.887 -8.337 1.00 0.00 H new ATOM 535 N LEU A 161 -0.023 -1.643 -7.234 1.00 0.00 N ATOM 536 CA LEU A 161 -0.221 -0.497 -6.353 1.00 0.00 C ATOM 537 C LEU A 161 1.035 0.367 -6.292 1.00 0.00 C ATOM 538 O LEU A 161 0.969 1.585 -6.449 1.00 0.00 O ATOM 539 CB LEU A 161 -0.598 -0.968 -4.948 1.00 0.00 C ATOM 540 CG LEU A 161 -2.058 -1.377 -4.746 1.00 0.00 C ATOM 541 CD1 LEU A 161 -2.220 -2.157 -3.450 1.00 0.00 C ATOM 542 CD2 LEU A 161 -2.960 -0.152 -4.749 1.00 0.00 C ATOM 0 H LEU A 161 -0.169 -2.548 -6.787 1.00 0.00 H new ATOM 0 HA LEU A 161 -1.034 0.105 -6.758 1.00 0.00 H new ATOM 0 HB2 LEU A 161 0.035 -1.816 -4.689 1.00 0.00 H new ATOM 0 HB3 LEU A 161 -0.365 -0.169 -4.244 1.00 0.00 H new ATOM 0 HG LEU A 161 -2.352 -2.022 -5.574 1.00 0.00 H new ATOM 0 HD11 LEU A 161 -3.265 -2.439 -3.323 1.00 0.00 H new ATOM 0 HD12 LEU A 161 -1.603 -3.055 -3.486 1.00 0.00 H new ATOM 0 HD13 LEU A 161 -1.908 -1.536 -2.610 1.00 0.00 H new ATOM 0 HD21 LEU A 161 -3.995 -0.462 -4.604 1.00 0.00 H new ATOM 0 HD22 LEU A 161 -2.666 0.519 -3.942 1.00 0.00 H new ATOM 0 HD23 LEU A 161 -2.867 0.366 -5.703 1.00 0.00 H new ATOM 554 N GLU A 162 2.177 -0.274 -6.065 1.00 0.00 N ATOM 555 CA GLU A 162 3.448 0.436 -5.986 1.00 0.00 C ATOM 556 C GLU A 162 3.676 1.285 -7.233 1.00 0.00 C ATOM 557 O GLU A 162 4.028 2.461 -7.140 1.00 0.00 O ATOM 558 CB GLU A 162 4.602 -0.554 -5.812 1.00 0.00 C ATOM 559 CG GLU A 162 5.934 0.110 -5.508 1.00 0.00 C ATOM 560 CD GLU A 162 7.117 -0.781 -5.829 1.00 0.00 C ATOM 561 OE1 GLU A 162 6.972 -1.673 -6.692 1.00 0.00 O ATOM 562 OE2 GLU A 162 8.189 -0.587 -5.218 1.00 0.00 O ATOM 0 H GLU A 162 2.248 -1.283 -5.933 1.00 0.00 H new ATOM 0 HA GLU A 162 3.412 1.096 -5.119 1.00 0.00 H new ATOM 0 HB2 GLU A 162 4.358 -1.245 -5.005 1.00 0.00 H new ATOM 0 HB3 GLU A 162 4.701 -1.147 -6.721 1.00 0.00 H new ATOM 0 HG2 GLU A 162 6.014 1.034 -6.081 1.00 0.00 H new ATOM 0 HG3 GLU A 162 5.966 0.385 -4.454 1.00 0.00 H new ATOM 569 N GLN A 163 3.474 0.680 -8.399 1.00 0.00 N ATOM 570 CA GLN A 163 3.659 1.379 -9.665 1.00 0.00 C ATOM 571 C GLN A 163 2.830 2.659 -9.705 1.00 0.00 C ATOM 572 O GLN A 163 3.324 3.717 -10.094 1.00 0.00 O ATOM 573 CB GLN A 163 3.274 0.472 -10.834 1.00 0.00 C ATOM 574 CG GLN A 163 3.295 1.174 -12.182 1.00 0.00 C ATOM 575 CD GLN A 163 4.568 1.967 -12.407 1.00 0.00 C ATOM 576 OE1 GLN A 163 5.639 1.592 -11.930 1.00 0.00 O ATOM 577 NE2 GLN A 163 4.457 3.069 -13.139 1.00 0.00 N ATOM 0 H GLN A 163 3.182 -0.293 -8.493 1.00 0.00 H new ATOM 0 HA GLN A 163 4.712 1.646 -9.754 1.00 0.00 H new ATOM 0 HB2 GLN A 163 3.958 -0.376 -10.865 1.00 0.00 H new ATOM 0 HB3 GLN A 163 2.276 0.071 -10.658 1.00 0.00 H new ATOM 0 HG2 GLN A 163 3.188 0.434 -12.975 1.00 0.00 H new ATOM 0 HG3 GLN A 163 2.437 1.843 -12.252 1.00 0.00 H new ATOM 0 HE21 GLN A 163 3.549 3.342 -13.515 1.00 0.00 H new ATOM 0 HE22 GLN A 163 5.280 3.642 -13.326 1.00 0.00 H new ATOM 586 N GLU A 164 1.568 2.554 -9.301 1.00 0.00 N ATOM 587 CA GLU A 164 0.671 3.704 -9.293 1.00 0.00 C ATOM 588 C GLU A 164 1.145 4.757 -8.295 1.00 0.00 C ATOM 589 O GLU A 164 1.124 5.954 -8.583 1.00 0.00 O ATOM 590 CB GLU A 164 -0.754 3.265 -8.950 1.00 0.00 C ATOM 591 CG GLU A 164 -1.520 2.704 -10.136 1.00 0.00 C ATOM 592 CD GLU A 164 -1.912 3.774 -11.136 1.00 0.00 C ATOM 593 OE1 GLU A 164 -2.473 4.806 -10.713 1.00 0.00 O ATOM 594 OE2 GLU A 164 -1.657 3.578 -12.343 1.00 0.00 O ATOM 0 H GLU A 164 1.144 1.685 -8.975 1.00 0.00 H new ATOM 0 HA GLU A 164 0.678 4.144 -10.290 1.00 0.00 H new ATOM 0 HB2 GLU A 164 -0.714 2.510 -8.165 1.00 0.00 H new ATOM 0 HB3 GLU A 164 -1.300 4.117 -8.546 1.00 0.00 H new ATOM 0 HG2 GLU A 164 -0.909 1.952 -10.635 1.00 0.00 H new ATOM 0 HG3 GLU A 164 -2.418 2.200 -9.778 1.00 0.00 H new ATOM 601 N ILE A 165 1.571 4.302 -7.122 1.00 0.00 N ATOM 602 CA ILE A 165 2.051 5.203 -6.082 1.00 0.00 C ATOM 603 C ILE A 165 3.258 6.002 -6.560 1.00 0.00 C ATOM 604 O ILE A 165 3.353 7.207 -6.322 1.00 0.00 O ATOM 605 CB ILE A 165 2.432 4.435 -4.803 1.00 0.00 C ATOM 606 CG1 ILE A 165 1.178 3.886 -4.119 1.00 0.00 C ATOM 607 CG2 ILE A 165 3.207 5.337 -3.854 1.00 0.00 C ATOM 608 CD1 ILE A 165 1.462 3.185 -2.808 1.00 0.00 C ATOM 0 H ILE A 165 1.594 3.314 -6.868 1.00 0.00 H new ATOM 0 HA ILE A 165 1.233 5.886 -5.855 1.00 0.00 H new ATOM 0 HB ILE A 165 3.071 3.596 -5.078 1.00 0.00 H new ATOM 0 HG12 ILE A 165 0.483 4.706 -3.940 1.00 0.00 H new ATOM 0 HG13 ILE A 165 0.681 3.189 -4.794 1.00 0.00 H new ATOM 0 HG21 ILE A 165 3.469 4.780 -2.955 1.00 0.00 H new ATOM 0 HG22 ILE A 165 4.117 5.684 -4.344 1.00 0.00 H new ATOM 0 HG23 ILE A 165 2.591 6.194 -3.583 1.00 0.00 H new ATOM 0 HD11 ILE A 165 0.528 2.822 -2.380 1.00 0.00 H new ATOM 0 HD12 ILE A 165 2.132 2.343 -2.983 1.00 0.00 H new ATOM 0 HD13 ILE A 165 1.931 3.884 -2.116 1.00 0.00 H new ATOM 620 N LEU A 166 4.178 5.324 -7.238 1.00 0.00 N ATOM 621 CA LEU A 166 5.380 5.971 -7.753 1.00 0.00 C ATOM 622 C LEU A 166 5.023 7.084 -8.732 1.00 0.00 C ATOM 623 O LEU A 166 5.410 8.237 -8.543 1.00 0.00 O ATOM 624 CB LEU A 166 6.282 4.943 -8.439 1.00 0.00 C ATOM 625 CG LEU A 166 7.041 3.992 -7.514 1.00 0.00 C ATOM 626 CD1 LEU A 166 7.584 2.806 -8.296 1.00 0.00 C ATOM 627 CD2 LEU A 166 8.169 4.726 -6.804 1.00 0.00 C ATOM 0 H LEU A 166 4.115 4.327 -7.444 1.00 0.00 H new ATOM 0 HA LEU A 166 5.915 6.411 -6.911 1.00 0.00 H new ATOM 0 HB2 LEU A 166 5.670 4.347 -9.116 1.00 0.00 H new ATOM 0 HB3 LEU A 166 7.008 5.478 -9.052 1.00 0.00 H new ATOM 0 HG LEU A 166 6.347 3.618 -6.761 1.00 0.00 H new ATOM 0 HD11 LEU A 166 8.121 2.140 -7.621 1.00 0.00 H new ATOM 0 HD12 LEU A 166 6.758 2.265 -8.757 1.00 0.00 H new ATOM 0 HD13 LEU A 166 8.263 3.161 -9.071 1.00 0.00 H new ATOM 0 HD21 LEU A 166 8.699 4.034 -6.150 1.00 0.00 H new ATOM 0 HD22 LEU A 166 8.862 5.129 -7.542 1.00 0.00 H new ATOM 0 HD23 LEU A 166 7.756 5.542 -6.211 1.00 0.00 H new ATOM 639 N GLU A 167 4.279 6.732 -9.776 1.00 0.00 N ATOM 640 CA GLU A 167 3.868 7.703 -10.783 1.00 0.00 C ATOM 641 C GLU A 167 3.133 8.875 -10.141 1.00 0.00 C ATOM 642 O GLU A 167 3.170 9.998 -10.645 1.00 0.00 O ATOM 643 CB GLU A 167 2.973 7.037 -11.830 1.00 0.00 C ATOM 644 CG GLU A 167 1.564 6.754 -11.335 1.00 0.00 C ATOM 645 CD GLU A 167 0.579 6.546 -12.469 1.00 0.00 C ATOM 646 OE1 GLU A 167 0.339 7.508 -13.229 1.00 0.00 O ATOM 647 OE2 GLU A 167 0.047 5.424 -12.595 1.00 0.00 O ATOM 0 H GLU A 167 3.949 5.782 -9.946 1.00 0.00 H new ATOM 0 HA GLU A 167 4.765 8.083 -11.271 1.00 0.00 H new ATOM 0 HB2 GLU A 167 2.918 7.678 -12.710 1.00 0.00 H new ATOM 0 HB3 GLU A 167 3.433 6.101 -12.146 1.00 0.00 H new ATOM 0 HG2 GLU A 167 1.576 5.867 -10.702 1.00 0.00 H new ATOM 0 HG3 GLU A 167 1.227 7.584 -10.714 1.00 0.00 H new ATOM 654 N PHE A 168 2.464 8.606 -9.024 1.00 0.00 N ATOM 655 CA PHE A 168 1.717 9.637 -8.313 1.00 0.00 C ATOM 656 C PHE A 168 2.664 10.608 -7.613 1.00 0.00 C ATOM 657 O PHE A 168 2.616 11.816 -7.848 1.00 0.00 O ATOM 658 CB PHE A 168 0.774 9.000 -7.290 1.00 0.00 C ATOM 659 CG PHE A 168 0.315 9.953 -6.224 1.00 0.00 C ATOM 660 CD1 PHE A 168 -0.653 10.906 -6.499 1.00 0.00 C ATOM 661 CD2 PHE A 168 0.850 9.896 -4.947 1.00 0.00 C ATOM 662 CE1 PHE A 168 -1.079 11.784 -5.520 1.00 0.00 C ATOM 663 CE2 PHE A 168 0.428 10.771 -3.964 1.00 0.00 C ATOM 664 CZ PHE A 168 -0.537 11.717 -4.251 1.00 0.00 C ATOM 0 H PHE A 168 2.424 7.683 -8.592 1.00 0.00 H new ATOM 0 HA PHE A 168 1.128 10.193 -9.043 1.00 0.00 H new ATOM 0 HB2 PHE A 168 -0.097 8.601 -7.810 1.00 0.00 H new ATOM 0 HB3 PHE A 168 1.278 8.156 -6.819 1.00 0.00 H new ATOM 0 HD1 PHE A 168 -1.079 10.963 -7.490 1.00 0.00 H new ATOM 0 HD2 PHE A 168 1.606 9.159 -4.717 1.00 0.00 H new ATOM 0 HE1 PHE A 168 -1.835 12.521 -5.747 1.00 0.00 H new ATOM 0 HE2 PHE A 168 0.852 10.715 -2.972 1.00 0.00 H new ATOM 0 HZ PHE A 168 -0.867 12.403 -3.485 1.00 0.00 H new ATOM 674 N ILE A 169 3.523 10.072 -6.753 1.00 0.00 N ATOM 675 CA ILE A 169 4.480 10.890 -6.019 1.00 0.00 C ATOM 676 C ILE A 169 5.191 11.869 -6.947 1.00 0.00 C ATOM 677 O ILE A 169 5.240 13.069 -6.679 1.00 0.00 O ATOM 678 CB ILE A 169 5.533 10.021 -5.306 1.00 0.00 C ATOM 679 CG1 ILE A 169 4.857 9.082 -4.304 1.00 0.00 C ATOM 680 CG2 ILE A 169 6.560 10.899 -4.607 1.00 0.00 C ATOM 681 CD1 ILE A 169 5.757 7.967 -3.818 1.00 0.00 C ATOM 0 H ILE A 169 3.576 9.074 -6.547 1.00 0.00 H new ATOM 0 HA ILE A 169 3.913 11.446 -5.272 1.00 0.00 H new ATOM 0 HB ILE A 169 6.049 9.416 -6.052 1.00 0.00 H new ATOM 0 HG12 ILE A 169 4.517 9.663 -3.447 1.00 0.00 H new ATOM 0 HG13 ILE A 169 3.971 8.647 -4.767 1.00 0.00 H new ATOM 0 HG21 ILE A 169 7.297 10.270 -4.108 1.00 0.00 H new ATOM 0 HG22 ILE A 169 7.060 11.530 -5.342 1.00 0.00 H new ATOM 0 HG23 ILE A 169 6.060 11.527 -3.870 1.00 0.00 H new ATOM 0 HD11 ILE A 169 5.212 7.341 -3.111 1.00 0.00 H new ATOM 0 HD12 ILE A 169 6.077 7.362 -4.666 1.00 0.00 H new ATOM 0 HD13 ILE A 169 6.631 8.393 -3.326 1.00 0.00 H new ATOM 693 N ASN A 170 5.738 11.349 -8.041 1.00 0.00 N ATOM 694 CA ASN A 170 6.444 12.179 -9.010 1.00 0.00 C ATOM 695 C ASN A 170 5.510 13.219 -9.620 1.00 0.00 C ATOM 696 O ASN A 170 5.828 14.408 -9.658 1.00 0.00 O ATOM 697 CB ASN A 170 7.046 11.308 -10.115 1.00 0.00 C ATOM 698 CG ASN A 170 8.174 12.005 -10.851 1.00 0.00 C ATOM 699 OD1 ASN A 170 8.107 13.205 -11.118 1.00 0.00 O ATOM 700 ND2 ASN A 170 9.217 11.254 -11.184 1.00 0.00 N ATOM 0 H ASN A 170 5.706 10.358 -8.278 1.00 0.00 H new ATOM 0 HA ASN A 170 7.247 12.700 -8.488 1.00 0.00 H new ATOM 0 HB2 ASN A 170 7.418 10.380 -9.680 1.00 0.00 H new ATOM 0 HB3 ASN A 170 6.265 11.036 -10.826 1.00 0.00 H new ATOM 0 HD21 ASN A 170 10.005 11.668 -11.681 1.00 0.00 H new ATOM 0 HD22 ASN A 170 9.230 10.263 -10.942 1.00 0.00 H new ATOM 707 N ASP A 171 4.356 12.764 -10.096 1.00 0.00 N ATOM 708 CA ASP A 171 3.374 13.655 -10.703 1.00 0.00 C ATOM 709 C ASP A 171 2.983 14.770 -9.738 1.00 0.00 C ATOM 710 O ASP A 171 2.198 14.558 -8.814 1.00 0.00 O ATOM 711 CB ASP A 171 2.132 12.868 -11.123 1.00 0.00 C ATOM 712 CG ASP A 171 1.190 13.689 -11.982 1.00 0.00 C ATOM 713 OD1 ASP A 171 1.678 14.395 -12.888 1.00 0.00 O ATOM 714 OD2 ASP A 171 -0.035 13.626 -11.747 1.00 0.00 O ATOM 0 H ASP A 171 4.078 11.783 -10.073 1.00 0.00 H new ATOM 0 HA ASP A 171 3.825 14.106 -11.587 1.00 0.00 H new ATOM 0 HB2 ASP A 171 2.438 11.978 -11.673 1.00 0.00 H new ATOM 0 HB3 ASP A 171 1.603 12.527 -10.233 1.00 0.00 H new ATOM 719 N ASN A 172 3.537 15.957 -9.958 1.00 0.00 N ATOM 720 CA ASN A 172 3.247 17.106 -9.107 1.00 0.00 C ATOM 721 C ASN A 172 1.797 17.551 -9.269 1.00 0.00 C ATOM 722 O ASN A 172 1.140 17.926 -8.299 1.00 0.00 O ATOM 723 CB ASN A 172 4.188 18.265 -9.441 1.00 0.00 C ATOM 724 CG ASN A 172 5.591 18.041 -8.912 1.00 0.00 C ATOM 725 OD1 ASN A 172 5.792 17.308 -7.944 1.00 0.00 O ATOM 726 ND2 ASN A 172 6.571 18.674 -9.547 1.00 0.00 N ATOM 0 H ASN A 172 4.189 16.149 -10.718 1.00 0.00 H new ATOM 0 HA ASN A 172 3.403 16.807 -8.070 1.00 0.00 H new ATOM 0 HB2 ASN A 172 4.227 18.398 -10.522 1.00 0.00 H new ATOM 0 HB3 ASN A 172 3.787 19.188 -9.021 1.00 0.00 H new ATOM 0 HD21 ASN A 172 7.536 18.562 -9.236 1.00 0.00 H new ATOM 0 HD22 ASN A 172 6.359 19.272 -10.345 1.00 0.00 H new ATOM 733 N ASN A 173 1.304 17.505 -10.503 1.00 0.00 N ATOM 734 CA ASN A 173 -0.069 17.903 -10.792 1.00 0.00 C ATOM 735 C ASN A 173 -1.034 17.312 -9.769 1.00 0.00 C ATOM 736 O ASN A 173 -1.952 17.987 -9.305 1.00 0.00 O ATOM 737 CB ASN A 173 -0.465 17.457 -12.201 1.00 0.00 C ATOM 738 CG ASN A 173 0.453 18.024 -13.267 1.00 0.00 C ATOM 739 OD1 ASN A 173 1.670 17.847 -13.211 1.00 0.00 O ATOM 740 ND2 ASN A 173 -0.128 18.710 -14.244 1.00 0.00 N ATOM 0 H ASN A 173 1.834 17.196 -11.318 1.00 0.00 H new ATOM 0 HA ASN A 173 -0.126 18.990 -10.732 1.00 0.00 H new ATOM 0 HB2 ASN A 173 -0.448 16.368 -12.253 1.00 0.00 H new ATOM 0 HB3 ASN A 173 -1.489 17.770 -12.404 1.00 0.00 H new ATOM 0 HD21 ASN A 173 0.438 19.116 -14.989 1.00 0.00 H new ATOM 0 HD22 ASN A 173 -1.141 18.831 -14.250 1.00 0.00 H new ATOM 747 N ASN A 174 -0.819 16.047 -9.423 1.00 0.00 N ATOM 748 CA ASN A 174 -1.670 15.365 -8.455 1.00 0.00 C ATOM 749 C ASN A 174 -1.166 15.591 -7.033 1.00 0.00 C ATOM 750 O ASN A 174 0.032 15.494 -6.766 1.00 0.00 O ATOM 751 CB ASN A 174 -1.721 13.866 -8.757 1.00 0.00 C ATOM 752 CG ASN A 174 -2.763 13.522 -9.803 1.00 0.00 C ATOM 753 OD1 ASN A 174 -2.797 14.117 -10.880 1.00 0.00 O ATOM 754 ND2 ASN A 174 -3.620 12.557 -9.490 1.00 0.00 N ATOM 0 H ASN A 174 -0.063 15.474 -9.798 1.00 0.00 H new ATOM 0 HA ASN A 174 -2.675 15.780 -8.536 1.00 0.00 H new ATOM 0 HB2 ASN A 174 -0.741 13.534 -9.101 1.00 0.00 H new ATOM 0 HB3 ASN A 174 -1.938 13.320 -7.839 1.00 0.00 H new ATOM 0 HD21 ASN A 174 -4.343 12.282 -10.154 1.00 0.00 H new ATOM 0 HD22 ASN A 174 -3.555 12.091 -8.585 1.00 0.00 H new ATOM 761 N GLN A 175 -2.089 15.893 -6.125 1.00 0.00 N ATOM 762 CA GLN A 175 -1.737 16.134 -4.730 1.00 0.00 C ATOM 763 C GLN A 175 -2.459 15.154 -3.811 1.00 0.00 C ATOM 764 O GLN A 175 -1.913 14.724 -2.794 1.00 0.00 O ATOM 765 CB GLN A 175 -2.083 17.571 -4.336 1.00 0.00 C ATOM 766 CG GLN A 175 -3.557 17.907 -4.494 1.00 0.00 C ATOM 767 CD GLN A 175 -3.879 19.329 -4.079 1.00 0.00 C ATOM 768 OE1 GLN A 175 -3.051 20.015 -3.477 1.00 0.00 O ATOM 769 NE2 GLN A 175 -5.086 19.780 -4.398 1.00 0.00 N ATOM 0 H GLN A 175 -3.085 15.977 -6.330 1.00 0.00 H new ATOM 0 HA GLN A 175 -0.663 15.984 -4.620 1.00 0.00 H new ATOM 0 HB2 GLN A 175 -1.791 17.735 -3.299 1.00 0.00 H new ATOM 0 HB3 GLN A 175 -1.495 18.258 -4.945 1.00 0.00 H new ATOM 0 HG2 GLN A 175 -3.850 17.761 -5.534 1.00 0.00 H new ATOM 0 HG3 GLN A 175 -4.150 17.215 -3.896 1.00 0.00 H new ATOM 0 HE21 GLN A 175 -5.740 19.177 -4.897 1.00 0.00 H new ATOM 0 HE22 GLN A 175 -5.359 20.729 -4.144 1.00 0.00 H new ATOM 778 N PHE A 176 -3.688 14.804 -4.174 1.00 0.00 N ATOM 779 CA PHE A 176 -4.485 13.876 -3.381 1.00 0.00 C ATOM 780 C PHE A 176 -4.859 12.643 -4.199 1.00 0.00 C ATOM 781 O PHE A 176 -5.081 12.730 -5.407 1.00 0.00 O ATOM 782 CB PHE A 176 -5.751 14.566 -2.869 1.00 0.00 C ATOM 783 CG PHE A 176 -5.564 15.261 -1.551 1.00 0.00 C ATOM 784 CD1 PHE A 176 -5.469 14.533 -0.376 1.00 0.00 C ATOM 785 CD2 PHE A 176 -5.482 16.643 -1.487 1.00 0.00 C ATOM 786 CE1 PHE A 176 -5.296 15.170 0.839 1.00 0.00 C ATOM 787 CE2 PHE A 176 -5.309 17.285 -0.276 1.00 0.00 C ATOM 788 CZ PHE A 176 -5.217 16.548 0.889 1.00 0.00 C ATOM 0 H PHE A 176 -4.154 15.149 -5.013 1.00 0.00 H new ATOM 0 HA PHE A 176 -3.884 13.556 -2.529 1.00 0.00 H new ATOM 0 HB2 PHE A 176 -6.084 15.293 -3.610 1.00 0.00 H new ATOM 0 HB3 PHE A 176 -6.544 13.825 -2.771 1.00 0.00 H new ATOM 0 HD1 PHE A 176 -5.531 13.455 -0.409 1.00 0.00 H new ATOM 0 HD2 PHE A 176 -5.554 17.225 -2.394 1.00 0.00 H new ATOM 0 HE1 PHE A 176 -5.223 14.591 1.748 1.00 0.00 H new ATOM 0 HE2 PHE A 176 -5.246 18.363 -0.240 1.00 0.00 H new ATOM 0 HZ PHE A 176 -5.084 17.048 1.837 1.00 0.00 H new ATOM 798 N LYS A 177 -4.926 11.496 -3.532 1.00 0.00 N ATOM 799 CA LYS A 177 -5.274 10.245 -4.195 1.00 0.00 C ATOM 800 C LYS A 177 -6.143 9.374 -3.293 1.00 0.00 C ATOM 801 O LYS A 177 -5.743 9.017 -2.185 1.00 0.00 O ATOM 802 CB LYS A 177 -4.006 9.483 -4.589 1.00 0.00 C ATOM 803 CG LYS A 177 -4.273 8.265 -5.457 1.00 0.00 C ATOM 804 CD LYS A 177 -3.220 7.190 -5.248 1.00 0.00 C ATOM 805 CE LYS A 177 -2.049 7.364 -6.203 1.00 0.00 C ATOM 806 NZ LYS A 177 -2.357 6.836 -7.561 1.00 0.00 N ATOM 0 H LYS A 177 -4.744 11.407 -2.532 1.00 0.00 H new ATOM 0 HA LYS A 177 -5.841 10.485 -5.094 1.00 0.00 H new ATOM 0 HB2 LYS A 177 -3.337 10.159 -5.122 1.00 0.00 H new ATOM 0 HB3 LYS A 177 -3.486 9.167 -3.684 1.00 0.00 H new ATOM 0 HG2 LYS A 177 -5.258 7.861 -5.225 1.00 0.00 H new ATOM 0 HG3 LYS A 177 -4.289 8.561 -6.506 1.00 0.00 H new ATOM 0 HD2 LYS A 177 -2.861 7.226 -4.220 1.00 0.00 H new ATOM 0 HD3 LYS A 177 -3.668 6.207 -5.395 1.00 0.00 H new ATOM 0 HE2 LYS A 177 -1.792 8.421 -6.274 1.00 0.00 H new ATOM 0 HE3 LYS A 177 -1.175 6.850 -5.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 177 -1.534 6.973 -8.182 1.00 0.00 H new ATOM 0 HZ2 LYS A 177 -2.577 5.822 -7.497 1.00 0.00 H new ATOM 0 HZ3 LYS A 177 -3.175 7.344 -7.954 1.00 0.00 H new ATOM 820 N LYS A 178 -7.334 9.035 -3.776 1.00 0.00 N ATOM 821 CA LYS A 178 -8.259 8.204 -3.015 1.00 0.00 C ATOM 822 C LYS A 178 -8.410 6.829 -3.657 1.00 0.00 C ATOM 823 O LYS A 178 -9.097 6.677 -4.668 1.00 0.00 O ATOM 824 CB LYS A 178 -9.626 8.886 -2.917 1.00 0.00 C ATOM 825 CG LYS A 178 -10.613 8.145 -2.031 1.00 0.00 C ATOM 826 CD LYS A 178 -11.411 7.121 -2.820 1.00 0.00 C ATOM 827 CE LYS A 178 -12.454 6.437 -1.949 1.00 0.00 C ATOM 828 NZ LYS A 178 -13.418 5.642 -2.760 1.00 0.00 N ATOM 0 H LYS A 178 -7.681 9.323 -4.691 1.00 0.00 H new ATOM 0 HA LYS A 178 -7.851 8.074 -2.013 1.00 0.00 H new ATOM 0 HB2 LYS A 178 -9.492 9.897 -2.531 1.00 0.00 H new ATOM 0 HB3 LYS A 178 -10.048 8.980 -3.917 1.00 0.00 H new ATOM 0 HG2 LYS A 178 -10.076 7.646 -1.225 1.00 0.00 H new ATOM 0 HG3 LYS A 178 -11.294 8.859 -1.567 1.00 0.00 H new ATOM 0 HD2 LYS A 178 -11.902 7.610 -3.661 1.00 0.00 H new ATOM 0 HD3 LYS A 178 -10.736 6.373 -3.236 1.00 0.00 H new ATOM 0 HE2 LYS A 178 -11.957 5.784 -1.232 1.00 0.00 H new ATOM 0 HE3 LYS A 178 -12.996 7.188 -1.374 1.00 0.00 H new ATOM 0 HZ1 LYS A 178 -13.629 4.749 -2.271 1.00 0.00 H new ATOM 0 HZ2 LYS A 178 -14.297 6.184 -2.885 1.00 0.00 H new ATOM 0 HZ3 LYS A 178 -13.002 5.437 -3.691 1.00 0.00 H new ATOM 842 N PHE A 179 -7.765 5.830 -3.064 1.00 0.00 N ATOM 843 CA PHE A 179 -7.828 4.467 -3.579 1.00 0.00 C ATOM 844 C PHE A 179 -9.234 3.894 -3.430 1.00 0.00 C ATOM 845 O PHE A 179 -10.002 4.288 -2.552 1.00 0.00 O ATOM 846 CB PHE A 179 -6.821 3.576 -2.848 1.00 0.00 C ATOM 847 CG PHE A 179 -5.402 3.788 -3.290 1.00 0.00 C ATOM 848 CD1 PHE A 179 -4.874 3.058 -4.343 1.00 0.00 C ATOM 849 CD2 PHE A 179 -4.595 4.717 -2.653 1.00 0.00 C ATOM 850 CE1 PHE A 179 -3.568 3.250 -4.751 1.00 0.00 C ATOM 851 CE2 PHE A 179 -3.288 4.914 -3.057 1.00 0.00 C ATOM 852 CZ PHE A 179 -2.774 4.180 -4.109 1.00 0.00 C ATOM 0 H PHE A 179 -7.193 5.938 -2.227 1.00 0.00 H new ATOM 0 HA PHE A 179 -7.576 4.493 -4.639 1.00 0.00 H new ATOM 0 HB2 PHE A 179 -6.892 3.765 -1.777 1.00 0.00 H new ATOM 0 HB3 PHE A 179 -7.090 2.532 -3.006 1.00 0.00 H new ATOM 0 HD1 PHE A 179 -5.490 2.331 -4.850 1.00 0.00 H new ATOM 0 HD2 PHE A 179 -4.992 5.294 -1.831 1.00 0.00 H new ATOM 0 HE1 PHE A 179 -3.168 2.673 -5.572 1.00 0.00 H new ATOM 0 HE2 PHE A 179 -2.669 5.641 -2.551 1.00 0.00 H new ATOM 0 HZ PHE A 179 -1.754 4.333 -4.428 1.00 0.00 H new ATOM 862 N PRO A 180 -9.580 2.941 -4.308 1.00 0.00 N ATOM 863 CA PRO A 180 -10.895 2.292 -4.295 1.00 0.00 C ATOM 864 C PRO A 180 -11.081 1.383 -3.085 1.00 0.00 C ATOM 865 O PRO A 180 -10.111 1.001 -2.430 1.00 0.00 O ATOM 866 CB PRO A 180 -10.898 1.471 -5.587 1.00 0.00 C ATOM 867 CG PRO A 180 -9.459 1.214 -5.875 1.00 0.00 C ATOM 868 CD PRO A 180 -8.715 2.422 -5.380 1.00 0.00 C ATOM 0 HA PRO A 180 -11.707 3.017 -4.233 1.00 0.00 H new ATOM 0 HB2 PRO A 180 -11.450 0.539 -5.463 1.00 0.00 H new ATOM 0 HB3 PRO A 180 -11.374 2.017 -6.402 1.00 0.00 H new ATOM 0 HG2 PRO A 180 -9.116 0.311 -5.371 1.00 0.00 H new ATOM 0 HG3 PRO A 180 -9.295 1.065 -6.942 1.00 0.00 H new ATOM 0 HD2 PRO A 180 -7.726 2.159 -5.006 1.00 0.00 H new ATOM 0 HD3 PRO A 180 -8.571 3.157 -6.172 1.00 0.00 H new ATOM 876 N GLN A 181 -12.332 1.039 -2.795 1.00 0.00 N ATOM 877 CA GLN A 181 -12.643 0.174 -1.664 1.00 0.00 C ATOM 878 C GLN A 181 -12.077 -1.225 -1.877 1.00 0.00 C ATOM 879 O GLN A 181 -12.461 -1.925 -2.813 1.00 0.00 O ATOM 880 CB GLN A 181 -14.157 0.099 -1.454 1.00 0.00 C ATOM 881 CG GLN A 181 -14.789 1.434 -1.096 1.00 0.00 C ATOM 882 CD GLN A 181 -15.204 2.230 -2.318 1.00 0.00 C ATOM 883 OE1 GLN A 181 -14.687 3.319 -2.568 1.00 0.00 O ATOM 884 NE2 GLN A 181 -16.141 1.688 -3.087 1.00 0.00 N ATOM 0 H GLN A 181 -13.146 1.346 -3.328 1.00 0.00 H new ATOM 0 HA GLN A 181 -12.181 0.601 -0.774 1.00 0.00 H new ATOM 0 HB2 GLN A 181 -14.623 -0.282 -2.363 1.00 0.00 H new ATOM 0 HB3 GLN A 181 -14.370 -0.618 -0.662 1.00 0.00 H new ATOM 0 HG2 GLN A 181 -15.662 1.261 -0.466 1.00 0.00 H new ATOM 0 HG3 GLN A 181 -14.083 2.020 -0.508 1.00 0.00 H new ATOM 0 HE21 GLN A 181 -16.542 0.783 -2.841 1.00 0.00 H new ATOM 0 HE22 GLN A 181 -16.460 2.177 -3.924 1.00 0.00 H new ATOM 893 N MET A 182 -11.161 -1.627 -1.001 1.00 0.00 N ATOM 894 CA MET A 182 -10.542 -2.944 -1.093 1.00 0.00 C ATOM 895 C MET A 182 -10.859 -3.782 0.141 1.00 0.00 C ATOM 896 O MET A 182 -11.508 -3.309 1.075 1.00 0.00 O ATOM 897 CB MET A 182 -9.027 -2.809 -1.257 1.00 0.00 C ATOM 898 CG MET A 182 -8.374 -1.952 -0.184 1.00 0.00 C ATOM 899 SD MET A 182 -8.309 -0.207 -0.634 1.00 0.00 S ATOM 900 CE MET A 182 -6.924 -0.201 -1.769 1.00 0.00 C ATOM 0 H MET A 182 -10.832 -1.060 -0.220 1.00 0.00 H new ATOM 0 HA MET A 182 -10.951 -3.449 -1.968 1.00 0.00 H new ATOM 0 HB2 MET A 182 -8.578 -3.802 -1.241 1.00 0.00 H new ATOM 0 HB3 MET A 182 -8.812 -2.378 -2.235 1.00 0.00 H new ATOM 0 HG2 MET A 182 -8.926 -2.062 0.749 1.00 0.00 H new ATOM 0 HG3 MET A 182 -7.362 -2.314 -0.001 1.00 0.00 H new ATOM 0 HE1 MET A 182 -6.176 0.514 -1.426 1.00 0.00 H new ATOM 0 HE2 MET A 182 -6.483 -1.197 -1.810 1.00 0.00 H new ATOM 0 HE3 MET A 182 -7.269 0.084 -2.763 1.00 0.00 H new ATOM 910 N THR A 183 -10.399 -5.029 0.140 1.00 0.00 N ATOM 911 CA THR A 183 -10.635 -5.932 1.259 1.00 0.00 C ATOM 912 C THR A 183 -9.668 -5.653 2.404 1.00 0.00 C ATOM 913 O THR A 183 -8.694 -4.920 2.242 1.00 0.00 O ATOM 914 CB THR A 183 -10.495 -7.405 0.831 1.00 0.00 C ATOM 915 OG1 THR A 183 -9.131 -7.692 0.500 1.00 0.00 O ATOM 916 CG2 THR A 183 -11.386 -7.709 -0.364 1.00 0.00 C ATOM 0 H THR A 183 -9.860 -5.437 -0.624 1.00 0.00 H new ATOM 0 HA THR A 183 -11.656 -5.755 1.598 1.00 0.00 H new ATOM 0 HB THR A 183 -10.806 -8.033 1.666 1.00 0.00 H new ATOM 0 HG1 THR A 183 -9.050 -8.631 0.230 1.00 0.00 H new ATOM 0 HG21 THR A 183 -11.270 -8.755 -0.648 1.00 0.00 H new ATOM 0 HG22 THR A 183 -12.426 -7.518 -0.100 1.00 0.00 H new ATOM 0 HG23 THR A 183 -11.101 -7.072 -1.201 1.00 0.00 H new ATOM 924 N SER A 184 -9.945 -6.244 3.563 1.00 0.00 N ATOM 925 CA SER A 184 -9.101 -6.056 4.737 1.00 0.00 C ATOM 926 C SER A 184 -7.635 -6.315 4.399 1.00 0.00 C ATOM 927 O SER A 184 -6.787 -5.435 4.550 1.00 0.00 O ATOM 928 CB SER A 184 -9.548 -6.986 5.866 1.00 0.00 C ATOM 929 OG SER A 184 -9.470 -8.344 5.470 1.00 0.00 O ATOM 0 H SER A 184 -10.747 -6.856 3.713 1.00 0.00 H new ATOM 0 HA SER A 184 -9.203 -5.022 5.066 1.00 0.00 H new ATOM 0 HB2 SER A 184 -8.923 -6.824 6.744 1.00 0.00 H new ATOM 0 HB3 SER A 184 -10.571 -6.747 6.155 1.00 0.00 H new ATOM 0 HG SER A 184 -9.759 -8.918 6.210 1.00 0.00 H new ATOM 935 N TYR A 185 -7.346 -7.528 3.942 1.00 0.00 N ATOM 936 CA TYR A 185 -5.983 -7.905 3.586 1.00 0.00 C ATOM 937 C TYR A 185 -5.283 -6.774 2.839 1.00 0.00 C ATOM 938 O TYR A 185 -4.248 -6.271 3.278 1.00 0.00 O ATOM 939 CB TYR A 185 -5.990 -9.171 2.727 1.00 0.00 C ATOM 940 CG TYR A 185 -4.719 -9.982 2.834 1.00 0.00 C ATOM 941 CD1 TYR A 185 -4.234 -10.389 4.071 1.00 0.00 C ATOM 942 CD2 TYR A 185 -4.002 -10.342 1.699 1.00 0.00 C ATOM 943 CE1 TYR A 185 -3.073 -11.131 4.175 1.00 0.00 C ATOM 944 CE2 TYR A 185 -2.841 -11.084 1.793 1.00 0.00 C ATOM 945 CZ TYR A 185 -2.380 -11.476 3.033 1.00 0.00 C ATOM 946 OH TYR A 185 -1.223 -12.214 3.131 1.00 0.00 O ATOM 0 H TYR A 185 -8.037 -8.267 3.809 1.00 0.00 H new ATOM 0 HA TYR A 185 -5.435 -8.102 4.507 1.00 0.00 H new ATOM 0 HB2 TYR A 185 -6.835 -9.794 3.020 1.00 0.00 H new ATOM 0 HB3 TYR A 185 -6.146 -8.892 1.685 1.00 0.00 H new ATOM 0 HD1 TYR A 185 -4.774 -10.121 4.967 1.00 0.00 H new ATOM 0 HD2 TYR A 185 -4.359 -10.036 0.727 1.00 0.00 H new ATOM 0 HE1 TYR A 185 -2.710 -11.439 5.144 1.00 0.00 H new ATOM 0 HE2 TYR A 185 -2.297 -11.356 0.901 1.00 0.00 H new ATOM 0 HH TYR A 185 -0.859 -12.372 2.235 1.00 0.00 H new ATOM 956 N HIS A 186 -5.855 -6.378 1.706 1.00 0.00 N ATOM 957 CA HIS A 186 -5.287 -5.305 0.897 1.00 0.00 C ATOM 958 C HIS A 186 -5.027 -4.064 1.746 1.00 0.00 C ATOM 959 O HIS A 186 -3.918 -3.530 1.757 1.00 0.00 O ATOM 960 CB HIS A 186 -6.226 -4.958 -0.259 1.00 0.00 C ATOM 961 CG HIS A 186 -6.619 -6.143 -1.087 1.00 0.00 C ATOM 962 ND1 HIS A 186 -7.507 -6.064 -2.139 1.00 0.00 N ATOM 963 CD2 HIS A 186 -6.237 -7.439 -1.016 1.00 0.00 C ATOM 964 CE1 HIS A 186 -7.657 -7.262 -2.676 1.00 0.00 C ATOM 965 NE2 HIS A 186 -6.896 -8.114 -2.013 1.00 0.00 N ATOM 0 H HIS A 186 -6.711 -6.784 1.328 1.00 0.00 H new ATOM 0 HA HIS A 186 -4.337 -5.653 0.492 1.00 0.00 H new ATOM 0 HB2 HIS A 186 -7.125 -4.491 0.142 1.00 0.00 H new ATOM 0 HB3 HIS A 186 -5.743 -4.221 -0.900 1.00 0.00 H new ATOM 0 HD2 HIS A 186 -5.542 -7.864 -0.306 1.00 0.00 H new ATOM 0 HE1 HIS A 186 -8.294 -7.503 -3.514 1.00 0.00 H new ATOM 0 HE2 HIS A 186 -6.812 -9.111 -2.210 1.00 0.00 H new ATOM 974 N ARG A 187 -6.055 -3.612 2.455 1.00 0.00 N ATOM 975 CA ARG A 187 -5.938 -2.433 3.305 1.00 0.00 C ATOM 976 C ARG A 187 -4.616 -2.443 4.069 1.00 0.00 C ATOM 977 O ARG A 187 -3.902 -1.442 4.104 1.00 0.00 O ATOM 978 CB ARG A 187 -7.107 -2.369 4.289 1.00 0.00 C ATOM 979 CG ARG A 187 -7.226 -1.035 5.008 1.00 0.00 C ATOM 980 CD ARG A 187 -8.518 -0.944 5.804 1.00 0.00 C ATOM 981 NE ARG A 187 -8.463 -1.736 7.030 1.00 0.00 N ATOM 982 CZ ARG A 187 -9.413 -1.721 7.958 1.00 0.00 C ATOM 983 NH1 ARG A 187 -10.487 -0.959 7.800 1.00 0.00 N ATOM 984 NH2 ARG A 187 -9.291 -2.471 9.046 1.00 0.00 N ATOM 0 H ARG A 187 -6.979 -4.044 2.458 1.00 0.00 H new ATOM 0 HA ARG A 187 -5.962 -1.551 2.665 1.00 0.00 H new ATOM 0 HB2 ARG A 187 -8.034 -2.566 3.751 1.00 0.00 H new ATOM 0 HB3 ARG A 187 -6.992 -3.162 5.028 1.00 0.00 H new ATOM 0 HG2 ARG A 187 -6.375 -0.904 5.677 1.00 0.00 H new ATOM 0 HG3 ARG A 187 -7.188 -0.224 4.281 1.00 0.00 H new ATOM 0 HD2 ARG A 187 -8.717 0.098 6.054 1.00 0.00 H new ATOM 0 HD3 ARG A 187 -9.349 -1.288 5.187 1.00 0.00 H new ATOM 0 HE ARG A 187 -7.650 -2.333 7.182 1.00 0.00 H new ATOM 0 HH11 ARG A 187 -10.585 -0.383 6.964 1.00 0.00 H new ATOM 0 HH12 ARG A 187 -11.215 -0.949 8.514 1.00 0.00 H new ATOM 0 HH21 ARG A 187 -8.467 -3.060 9.170 1.00 0.00 H new ATOM 0 HH22 ARG A 187 -10.021 -2.459 9.758 1.00 0.00 H new ATOM 998 N MET A 188 -4.300 -3.581 4.678 1.00 0.00 N ATOM 999 CA MET A 188 -3.064 -3.720 5.440 1.00 0.00 C ATOM 1000 C MET A 188 -1.846 -3.570 4.534 1.00 0.00 C ATOM 1001 O MET A 188 -0.978 -2.732 4.779 1.00 0.00 O ATOM 1002 CB MET A 188 -3.025 -5.078 6.145 1.00 0.00 C ATOM 1003 CG MET A 188 -1.762 -5.304 6.959 1.00 0.00 C ATOM 1004 SD MET A 188 -1.325 -7.048 7.092 1.00 0.00 S ATOM 1005 CE MET A 188 -0.760 -7.384 5.426 1.00 0.00 C ATOM 0 H MET A 188 -4.881 -4.419 4.659 1.00 0.00 H new ATOM 0 HA MET A 188 -3.037 -2.928 6.189 1.00 0.00 H new ATOM 0 HB2 MET A 188 -3.891 -5.162 6.802 1.00 0.00 H new ATOM 0 HB3 MET A 188 -3.113 -5.868 5.399 1.00 0.00 H new ATOM 0 HG2 MET A 188 -0.936 -4.760 6.500 1.00 0.00 H new ATOM 0 HG3 MET A 188 -1.899 -4.891 7.958 1.00 0.00 H new ATOM 0 HE1 MET A 188 -0.153 -8.289 5.423 1.00 0.00 H new ATOM 0 HE2 MET A 188 -1.620 -7.522 4.771 1.00 0.00 H new ATOM 0 HE3 MET A 188 -0.162 -6.546 5.069 1.00 0.00 H new ATOM 1015 N LEU A 189 -1.789 -4.386 3.487 1.00 0.00 N ATOM 1016 CA LEU A 189 -0.677 -4.343 2.544 1.00 0.00 C ATOM 1017 C LEU A 189 -0.315 -2.903 2.194 1.00 0.00 C ATOM 1018 O LEU A 189 0.821 -2.470 2.396 1.00 0.00 O ATOM 1019 CB LEU A 189 -1.031 -5.116 1.273 1.00 0.00 C ATOM 1020 CG LEU A 189 -1.384 -6.592 1.460 1.00 0.00 C ATOM 1021 CD1 LEU A 189 -1.975 -7.166 0.182 1.00 0.00 C ATOM 1022 CD2 LEU A 189 -0.156 -7.384 1.885 1.00 0.00 C ATOM 0 H LEU A 189 -2.499 -5.085 3.270 1.00 0.00 H new ATOM 0 HA LEU A 189 0.187 -4.810 3.017 1.00 0.00 H new ATOM 0 HB2 LEU A 189 -1.874 -4.620 0.793 1.00 0.00 H new ATOM 0 HB3 LEU A 189 -0.188 -5.049 0.585 1.00 0.00 H new ATOM 0 HG LEU A 189 -2.133 -6.670 2.248 1.00 0.00 H new ATOM 0 HD11 LEU A 189 -2.220 -8.217 0.334 1.00 0.00 H new ATOM 0 HD12 LEU A 189 -2.880 -6.617 -0.079 1.00 0.00 H new ATOM 0 HD13 LEU A 189 -1.250 -7.076 -0.627 1.00 0.00 H new ATOM 0 HD21 LEU A 189 -0.426 -8.432 2.013 1.00 0.00 H new ATOM 0 HD22 LEU A 189 0.615 -7.299 1.119 1.00 0.00 H new ATOM 0 HD23 LEU A 189 0.224 -6.989 2.827 1.00 0.00 H new ATOM 1034 N LEU A 190 -1.287 -2.165 1.670 1.00 0.00 N ATOM 1035 CA LEU A 190 -1.072 -0.772 1.293 1.00 0.00 C ATOM 1036 C LEU A 190 -0.480 0.021 2.454 1.00 0.00 C ATOM 1037 O LEU A 190 0.597 0.605 2.335 1.00 0.00 O ATOM 1038 CB LEU A 190 -2.389 -0.136 0.844 1.00 0.00 C ATOM 1039 CG LEU A 190 -2.332 1.354 0.503 1.00 0.00 C ATOM 1040 CD1 LEU A 190 -1.652 1.568 -0.840 1.00 0.00 C ATOM 1041 CD2 LEU A 190 -3.731 1.953 0.497 1.00 0.00 C ATOM 0 H LEU A 190 -2.232 -2.508 1.496 1.00 0.00 H new ATOM 0 HA LEU A 190 -0.364 -0.750 0.464 1.00 0.00 H new ATOM 0 HB2 LEU A 190 -2.750 -0.675 -0.032 1.00 0.00 H new ATOM 0 HB3 LEU A 190 -3.127 -0.280 1.633 1.00 0.00 H new ATOM 0 HG LEU A 190 -1.745 1.861 1.269 1.00 0.00 H new ATOM 0 HD11 LEU A 190 -1.620 2.634 -1.066 1.00 0.00 H new ATOM 0 HD12 LEU A 190 -0.636 1.175 -0.800 1.00 0.00 H new ATOM 0 HD13 LEU A 190 -2.211 1.048 -1.618 1.00 0.00 H new ATOM 0 HD21 LEU A 190 -3.672 3.014 0.253 1.00 0.00 H new ATOM 0 HD22 LEU A 190 -4.342 1.443 -0.247 1.00 0.00 H new ATOM 0 HD23 LEU A 190 -4.183 1.832 1.482 1.00 0.00 H new ATOM 1053 N HIS A 191 -1.191 0.035 3.577 1.00 0.00 N ATOM 1054 CA HIS A 191 -0.735 0.754 4.761 1.00 0.00 C ATOM 1055 C HIS A 191 0.770 0.589 4.951 1.00 0.00 C ATOM 1056 O HIS A 191 1.464 1.531 5.333 1.00 0.00 O ATOM 1057 CB HIS A 191 -1.475 0.256 6.003 1.00 0.00 C ATOM 1058 CG HIS A 191 -2.901 0.708 6.073 1.00 0.00 C ATOM 1059 ND1 HIS A 191 -4.018 0.055 6.471 1.00 0.00 N flip ATOM 1060 CD2 HIS A 191 -3.308 1.972 5.702 1.00 0.00 C flip ATOM 1061 CE1 HIS A 191 -5.069 0.929 6.337 1.00 0.00 C flip ATOM 1062 NE2 HIS A 191 -4.614 2.078 5.871 1.00 0.00 N flip ATOM 0 H HIS A 191 -2.085 -0.443 3.692 1.00 0.00 H new ATOM 0 HA HIS A 191 -0.952 1.813 4.618 1.00 0.00 H new ATOM 0 HB2 HIS A 191 -1.447 -0.834 6.020 1.00 0.00 H new ATOM 0 HB3 HIS A 191 -0.949 0.602 6.892 1.00 0.00 H new ATOM 0 HD1 HIS A 191 -4.070 -0.907 6.808 1.00 0.00 H new ATOM 0 HD2 HIS A 191 -2.661 2.753 5.331 1.00 0.00 H new ATOM 0 HE1 HIS A 191 -6.100 0.712 6.574 1.00 0.00 H new ATOM 1071 N ARG A 192 1.267 -0.614 4.682 1.00 0.00 N ATOM 1072 CA ARG A 192 2.689 -0.902 4.825 1.00 0.00 C ATOM 1073 C ARG A 192 3.493 -0.239 3.710 1.00 0.00 C ATOM 1074 O ARG A 192 4.554 0.337 3.953 1.00 0.00 O ATOM 1075 CB ARG A 192 2.928 -2.413 4.811 1.00 0.00 C ATOM 1076 CG ARG A 192 4.143 -2.845 5.618 1.00 0.00 C ATOM 1077 CD ARG A 192 3.801 -3.017 7.089 1.00 0.00 C ATOM 1078 NE ARG A 192 3.309 -4.360 7.384 1.00 0.00 N ATOM 1079 CZ ARG A 192 2.885 -4.740 8.584 1.00 0.00 C ATOM 1080 NH1 ARG A 192 2.892 -3.883 9.596 1.00 0.00 N ATOM 1081 NH2 ARG A 192 2.451 -5.980 8.773 1.00 0.00 N ATOM 0 H ARG A 192 0.706 -1.404 4.364 1.00 0.00 H new ATOM 0 HA ARG A 192 3.022 -0.496 5.780 1.00 0.00 H new ATOM 0 HB2 ARG A 192 2.044 -2.916 5.203 1.00 0.00 H new ATOM 0 HB3 ARG A 192 3.051 -2.743 3.780 1.00 0.00 H new ATOM 0 HG2 ARG A 192 4.530 -3.783 5.221 1.00 0.00 H new ATOM 0 HG3 ARG A 192 4.935 -2.103 5.512 1.00 0.00 H new ATOM 0 HD2 ARG A 192 4.686 -2.814 7.693 1.00 0.00 H new ATOM 0 HD3 ARG A 192 3.046 -2.284 7.374 1.00 0.00 H new ATOM 0 HE ARG A 192 3.290 -5.044 6.627 1.00 0.00 H new ATOM 0 HH11 ARG A 192 3.224 -2.929 9.454 1.00 0.00 H new ATOM 0 HH12 ARG A 192 2.566 -4.178 10.516 1.00 0.00 H new ATOM 0 HH21 ARG A 192 2.443 -6.641 7.997 1.00 0.00 H new ATOM 0 HH22 ARG A 192 2.125 -6.271 9.695 1.00 0.00 H new ATOM 1095 N VAL A 193 2.981 -0.325 2.486 1.00 0.00 N ATOM 1096 CA VAL A 193 3.650 0.266 1.334 1.00 0.00 C ATOM 1097 C VAL A 193 3.877 1.760 1.537 1.00 0.00 C ATOM 1098 O VAL A 193 4.981 2.264 1.335 1.00 0.00 O ATOM 1099 CB VAL A 193 2.839 0.052 0.043 1.00 0.00 C ATOM 1100 CG1 VAL A 193 3.509 0.751 -1.131 1.00 0.00 C ATOM 1101 CG2 VAL A 193 2.666 -1.433 -0.238 1.00 0.00 C ATOM 0 H VAL A 193 2.105 -0.799 2.267 1.00 0.00 H new ATOM 0 HA VAL A 193 4.613 -0.235 1.236 1.00 0.00 H new ATOM 0 HB VAL A 193 1.850 0.490 0.179 1.00 0.00 H new ATOM 0 HG11 VAL A 193 2.921 0.589 -2.035 1.00 0.00 H new ATOM 0 HG12 VAL A 193 3.575 1.820 -0.928 1.00 0.00 H new ATOM 0 HG13 VAL A 193 4.511 0.346 -1.272 1.00 0.00 H new ATOM 0 HG21 VAL A 193 2.090 -1.565 -1.154 1.00 0.00 H new ATOM 0 HG22 VAL A 193 3.645 -1.898 -0.354 1.00 0.00 H new ATOM 0 HG23 VAL A 193 2.138 -1.901 0.593 1.00 0.00 H new ATOM 1111 N ALA A 194 2.823 2.463 1.940 1.00 0.00 N ATOM 1112 CA ALA A 194 2.908 3.900 2.174 1.00 0.00 C ATOM 1113 C ALA A 194 3.880 4.216 3.305 1.00 0.00 C ATOM 1114 O ALA A 194 4.802 5.014 3.139 1.00 0.00 O ATOM 1115 CB ALA A 194 1.530 4.465 2.486 1.00 0.00 C ATOM 0 H ALA A 194 1.901 2.061 2.111 1.00 0.00 H new ATOM 0 HA ALA A 194 3.285 4.370 1.265 1.00 0.00 H new ATOM 0 HB1 ALA A 194 1.607 5.538 2.659 1.00 0.00 H new ATOM 0 HB2 ALA A 194 0.862 4.280 1.645 1.00 0.00 H new ATOM 0 HB3 ALA A 194 1.132 3.982 3.378 1.00 0.00 H new ATOM 1121 N ALA A 195 3.668 3.585 4.455 1.00 0.00 N ATOM 1122 CA ALA A 195 4.527 3.798 5.613 1.00 0.00 C ATOM 1123 C ALA A 195 5.998 3.651 5.240 1.00 0.00 C ATOM 1124 O ALA A 195 6.864 4.309 5.818 1.00 0.00 O ATOM 1125 CB ALA A 195 4.163 2.826 6.726 1.00 0.00 C ATOM 0 H ALA A 195 2.908 2.922 4.610 1.00 0.00 H new ATOM 0 HA ALA A 195 4.370 4.816 5.969 1.00 0.00 H new ATOM 0 HB1 ALA A 195 4.812 2.996 7.585 1.00 0.00 H new ATOM 0 HB2 ALA A 195 3.125 2.981 7.020 1.00 0.00 H new ATOM 0 HB3 ALA A 195 4.291 1.803 6.372 1.00 0.00 H new ATOM 1131 N TYR A 196 6.274 2.785 4.272 1.00 0.00 N ATOM 1132 CA TYR A 196 7.642 2.549 3.824 1.00 0.00 C ATOM 1133 C TYR A 196 8.153 3.723 2.994 1.00 0.00 C ATOM 1134 O TYR A 196 9.254 4.225 3.219 1.00 0.00 O ATOM 1135 CB TYR A 196 7.718 1.259 3.005 1.00 0.00 C ATOM 1136 CG TYR A 196 9.124 0.729 2.840 1.00 0.00 C ATOM 1137 CD1 TYR A 196 9.722 -0.032 3.838 1.00 0.00 C ATOM 1138 CD2 TYR A 196 9.855 0.989 1.688 1.00 0.00 C ATOM 1139 CE1 TYR A 196 11.006 -0.519 3.692 1.00 0.00 C ATOM 1140 CE2 TYR A 196 11.140 0.506 1.533 1.00 0.00 C ATOM 1141 CZ TYR A 196 11.711 -0.247 2.538 1.00 0.00 C ATOM 1142 OH TYR A 196 12.991 -0.730 2.388 1.00 0.00 O ATOM 0 H TYR A 196 5.569 2.234 3.782 1.00 0.00 H new ATOM 0 HA TYR A 196 8.274 2.448 4.706 1.00 0.00 H new ATOM 0 HB2 TYR A 196 7.105 0.497 3.486 1.00 0.00 H new ATOM 0 HB3 TYR A 196 7.288 1.438 2.019 1.00 0.00 H new ATOM 0 HD1 TYR A 196 9.173 -0.246 4.743 1.00 0.00 H new ATOM 0 HD2 TYR A 196 9.411 1.579 0.900 1.00 0.00 H new ATOM 0 HE1 TYR A 196 11.456 -1.109 4.477 1.00 0.00 H new ATOM 0 HE2 TYR A 196 11.694 0.717 0.630 1.00 0.00 H new ATOM 0 HH TYR A 196 13.347 -0.450 1.519 1.00 0.00 H new ATOM 1152 N PHE A 197 7.343 4.156 2.033 1.00 0.00 N ATOM 1153 CA PHE A 197 7.712 5.270 1.168 1.00 0.00 C ATOM 1154 C PHE A 197 7.759 6.577 1.954 1.00 0.00 C ATOM 1155 O PHE A 197 8.418 7.534 1.550 1.00 0.00 O ATOM 1156 CB PHE A 197 6.719 5.394 0.010 1.00 0.00 C ATOM 1157 CG PHE A 197 7.108 4.595 -1.201 1.00 0.00 C ATOM 1158 CD1 PHE A 197 6.827 3.240 -1.273 1.00 0.00 C ATOM 1159 CD2 PHE A 197 7.754 5.199 -2.268 1.00 0.00 C ATOM 1160 CE1 PHE A 197 7.184 2.503 -2.386 1.00 0.00 C ATOM 1161 CE2 PHE A 197 8.114 4.466 -3.384 1.00 0.00 C ATOM 1162 CZ PHE A 197 7.827 3.117 -3.443 1.00 0.00 C ATOM 0 H PHE A 197 6.428 3.752 1.834 1.00 0.00 H new ATOM 0 HA PHE A 197 8.706 5.072 0.767 1.00 0.00 H new ATOM 0 HB2 PHE A 197 5.735 5.069 0.349 1.00 0.00 H new ATOM 0 HB3 PHE A 197 6.629 6.443 -0.270 1.00 0.00 H new ATOM 0 HD1 PHE A 197 6.323 2.755 -0.450 1.00 0.00 H new ATOM 0 HD2 PHE A 197 7.979 6.255 -2.227 1.00 0.00 H new ATOM 0 HE1 PHE A 197 6.960 1.447 -2.429 1.00 0.00 H new ATOM 0 HE2 PHE A 197 8.619 4.948 -4.208 1.00 0.00 H new ATOM 0 HZ PHE A 197 8.105 2.543 -4.314 1.00 0.00 H new ATOM 1172 N GLY A 198 7.054 6.609 3.081 1.00 0.00 N ATOM 1173 CA GLY A 198 7.028 7.802 3.907 1.00 0.00 C ATOM 1174 C GLY A 198 5.808 8.662 3.643 1.00 0.00 C ATOM 1175 O GLY A 198 5.884 9.890 3.695 1.00 0.00 O ATOM 0 H GLY A 198 6.500 5.830 3.437 1.00 0.00 H new ATOM 0 HA2 GLY A 198 7.045 7.513 4.958 1.00 0.00 H new ATOM 0 HA3 GLY A 198 7.929 8.388 3.723 1.00 0.00 H new ATOM 1179 N MET A 199 4.682 8.018 3.358 1.00 0.00 N ATOM 1180 CA MET A 199 3.441 8.733 3.085 1.00 0.00 C ATOM 1181 C MET A 199 2.371 8.378 4.113 1.00 0.00 C ATOM 1182 O MET A 199 2.311 7.246 4.594 1.00 0.00 O ATOM 1183 CB MET A 199 2.939 8.408 1.677 1.00 0.00 C ATOM 1184 CG MET A 199 3.326 7.018 1.199 1.00 0.00 C ATOM 1185 SD MET A 199 2.344 6.468 -0.209 1.00 0.00 S ATOM 1186 CE MET A 199 2.783 7.703 -1.430 1.00 0.00 C ATOM 0 H MET A 199 4.603 7.002 3.310 1.00 0.00 H new ATOM 0 HA MET A 199 3.645 9.802 3.153 1.00 0.00 H new ATOM 0 HB2 MET A 199 1.853 8.501 1.657 1.00 0.00 H new ATOM 0 HB3 MET A 199 3.335 9.146 0.980 1.00 0.00 H new ATOM 0 HG2 MET A 199 4.381 7.013 0.925 1.00 0.00 H new ATOM 0 HG3 MET A 199 3.206 6.310 2.019 1.00 0.00 H new ATOM 0 HE1 MET A 199 2.214 7.530 -2.343 1.00 0.00 H new ATOM 0 HE2 MET A 199 2.554 8.696 -1.042 1.00 0.00 H new ATOM 0 HE3 MET A 199 3.849 7.636 -1.649 1.00 0.00 H new ATOM 1196 N ASP A 200 1.530 9.351 4.445 1.00 0.00 N ATOM 1197 CA ASP A 200 0.462 9.140 5.416 1.00 0.00 C ATOM 1198 C ASP A 200 -0.862 8.855 4.713 1.00 0.00 C ATOM 1199 O ASP A 200 -1.102 9.328 3.602 1.00 0.00 O ATOM 1200 CB ASP A 200 0.319 10.364 6.322 1.00 0.00 C ATOM 1201 CG ASP A 200 -0.631 10.120 7.478 1.00 0.00 C ATOM 1202 OD1 ASP A 200 -1.848 9.991 7.228 1.00 0.00 O ATOM 1203 OD2 ASP A 200 -0.159 10.059 8.633 1.00 0.00 O ATOM 0 H ASP A 200 1.567 10.293 4.056 1.00 0.00 H new ATOM 0 HA ASP A 200 0.723 8.275 6.025 1.00 0.00 H new ATOM 0 HB2 ASP A 200 1.299 10.640 6.712 1.00 0.00 H new ATOM 0 HB3 ASP A 200 -0.039 11.209 5.733 1.00 0.00 H new ATOM 1208 N HIS A 201 -1.718 8.077 5.369 1.00 0.00 N ATOM 1209 CA HIS A 201 -3.018 7.728 4.807 1.00 0.00 C ATOM 1210 C HIS A 201 -4.147 8.184 5.726 1.00 0.00 C ATOM 1211 O HIS A 201 -3.932 8.438 6.910 1.00 0.00 O ATOM 1212 CB HIS A 201 -3.110 6.219 4.578 1.00 0.00 C ATOM 1213 CG HIS A 201 -3.643 5.465 5.757 1.00 0.00 C ATOM 1214 ND1 HIS A 201 -4.969 5.495 6.132 1.00 0.00 N ATOM 1215 CD2 HIS A 201 -3.020 4.656 6.646 1.00 0.00 C ATOM 1216 CE1 HIS A 201 -5.139 4.738 7.201 1.00 0.00 C ATOM 1217 NE2 HIS A 201 -3.972 4.217 7.533 1.00 0.00 N ATOM 0 H HIS A 201 -1.535 7.677 6.289 1.00 0.00 H new ATOM 0 HA HIS A 201 -3.122 8.240 3.850 1.00 0.00 H new ATOM 0 HB2 HIS A 201 -3.750 6.029 3.716 1.00 0.00 H new ATOM 0 HB3 HIS A 201 -2.120 5.837 4.330 1.00 0.00 H new ATOM 0 HD2 HIS A 201 -1.970 4.403 6.656 1.00 0.00 H new ATOM 0 HE1 HIS A 201 -6.074 4.573 7.716 1.00 0.00 H new ATOM 0 HE2 HIS A 201 -3.805 3.590 8.320 1.00 0.00 H new ATOM 1226 N ASN A 202 -5.351 8.286 5.171 1.00 0.00 N ATOM 1227 CA ASN A 202 -6.514 8.713 5.941 1.00 0.00 C ATOM 1228 C ASN A 202 -7.700 7.787 5.693 1.00 0.00 C ATOM 1229 O ASN A 202 -7.730 7.048 4.709 1.00 0.00 O ATOM 1230 CB ASN A 202 -6.891 10.151 5.579 1.00 0.00 C ATOM 1231 CG ASN A 202 -5.868 11.158 6.069 1.00 0.00 C ATOM 1232 OD1 ASN A 202 -4.894 11.456 5.378 1.00 0.00 O ATOM 1233 ND2 ASN A 202 -6.085 11.687 7.268 1.00 0.00 N ATOM 0 H ASN A 202 -5.546 8.079 4.192 1.00 0.00 H new ATOM 0 HA ASN A 202 -6.255 8.667 6.999 1.00 0.00 H new ATOM 0 HB2 ASN A 202 -6.991 10.236 4.497 1.00 0.00 H new ATOM 0 HB3 ASN A 202 -7.864 10.388 6.009 1.00 0.00 H new ATOM 0 HD21 ASN A 202 -5.431 12.370 7.650 1.00 0.00 H new ATOM 0 HD22 ASN A 202 -6.906 11.411 7.806 1.00 0.00 H new ATOM 1240 N VAL A 203 -8.677 7.832 6.593 1.00 0.00 N ATOM 1241 CA VAL A 203 -9.867 6.998 6.472 1.00 0.00 C ATOM 1242 C VAL A 203 -11.065 7.815 6.001 1.00 0.00 C ATOM 1243 O VAL A 203 -11.205 8.988 6.348 1.00 0.00 O ATOM 1244 CB VAL A 203 -10.217 6.321 7.811 1.00 0.00 C ATOM 1245 CG1 VAL A 203 -9.059 5.459 8.291 1.00 0.00 C ATOM 1246 CG2 VAL A 203 -10.585 7.364 8.855 1.00 0.00 C ATOM 0 H VAL A 203 -8.668 8.437 7.414 1.00 0.00 H new ATOM 0 HA VAL A 203 -9.641 6.230 5.733 1.00 0.00 H new ATOM 0 HB VAL A 203 -11.081 5.674 7.657 1.00 0.00 H new ATOM 0 HG11 VAL A 203 -9.324 4.989 9.238 1.00 0.00 H new ATOM 0 HG12 VAL A 203 -8.847 4.688 7.550 1.00 0.00 H new ATOM 0 HG13 VAL A 203 -8.175 6.082 8.430 1.00 0.00 H new ATOM 0 HG21 VAL A 203 -10.829 6.868 9.794 1.00 0.00 H new ATOM 0 HG22 VAL A 203 -9.742 8.038 9.009 1.00 0.00 H new ATOM 0 HG23 VAL A 203 -11.448 7.935 8.511 1.00 0.00 H new ATOM 1256 N ASP A 204 -11.927 7.188 5.208 1.00 0.00 N ATOM 1257 CA ASP A 204 -13.115 7.856 4.689 1.00 0.00 C ATOM 1258 C ASP A 204 -14.325 7.579 5.576 1.00 0.00 C ATOM 1259 O ASP A 204 -14.271 6.733 6.468 1.00 0.00 O ATOM 1260 CB ASP A 204 -13.399 7.399 3.258 1.00 0.00 C ATOM 1261 CG ASP A 204 -14.294 6.176 3.208 1.00 0.00 C ATOM 1262 OD1 ASP A 204 -13.800 5.067 3.500 1.00 0.00 O ATOM 1263 OD2 ASP A 204 -15.488 6.328 2.878 1.00 0.00 O ATOM 0 H ASP A 204 -11.825 6.218 4.910 1.00 0.00 H new ATOM 0 HA ASP A 204 -12.927 8.930 4.688 1.00 0.00 H new ATOM 0 HB2 ASP A 204 -13.870 8.213 2.706 1.00 0.00 H new ATOM 0 HB3 ASP A 204 -12.457 7.177 2.757 1.00 0.00 H new ATOM 1268 N GLN A 205 -15.414 8.297 5.323 1.00 0.00 N ATOM 1269 CA GLN A 205 -16.637 8.128 6.100 1.00 0.00 C ATOM 1270 C GLN A 205 -16.855 6.662 6.460 1.00 0.00 C ATOM 1271 O GLN A 205 -17.075 6.323 7.623 1.00 0.00 O ATOM 1272 CB GLN A 205 -17.840 8.658 5.318 1.00 0.00 C ATOM 1273 CG GLN A 205 -19.172 8.400 6.002 1.00 0.00 C ATOM 1274 CD GLN A 205 -20.346 8.964 5.226 1.00 0.00 C ATOM 1275 OE1 GLN A 205 -20.513 10.180 5.127 1.00 0.00 O ATOM 1276 NE2 GLN A 205 -21.168 8.081 4.671 1.00 0.00 N ATOM 0 H GLN A 205 -15.475 9.001 4.587 1.00 0.00 H new ATOM 0 HA GLN A 205 -16.533 8.698 7.023 1.00 0.00 H new ATOM 0 HB2 GLN A 205 -17.720 9.731 5.167 1.00 0.00 H new ATOM 0 HB3 GLN A 205 -17.853 8.197 4.331 1.00 0.00 H new ATOM 0 HG2 GLN A 205 -19.308 7.326 6.130 1.00 0.00 H new ATOM 0 HG3 GLN A 205 -19.155 8.840 6.999 1.00 0.00 H new ATOM 0 HE21 GLN A 205 -20.991 7.082 4.778 1.00 0.00 H new ATOM 0 HE22 GLN A 205 -21.976 8.402 4.137 1.00 0.00 H new ATOM 1285 N THR A 206 -16.794 5.795 5.454 1.00 0.00 N ATOM 1286 CA THR A 206 -16.986 4.366 5.663 1.00 0.00 C ATOM 1287 C THR A 206 -15.733 3.722 6.244 1.00 0.00 C ATOM 1288 O THR A 206 -15.814 2.783 7.034 1.00 0.00 O ATOM 1289 CB THR A 206 -17.357 3.650 4.351 1.00 0.00 C ATOM 1290 OG1 THR A 206 -16.277 3.750 3.416 1.00 0.00 O ATOM 1291 CG2 THR A 206 -18.616 4.251 3.744 1.00 0.00 C ATOM 0 H THR A 206 -16.613 6.059 4.485 1.00 0.00 H new ATOM 0 HA THR A 206 -17.808 4.258 6.371 1.00 0.00 H new ATOM 0 HB THR A 206 -17.546 2.601 4.577 1.00 0.00 H new ATOM 0 HG1 THR A 206 -16.148 4.688 3.164 1.00 0.00 H new ATOM 0 HG21 THR A 206 -18.858 3.729 2.818 1.00 0.00 H new ATOM 0 HG22 THR A 206 -19.443 4.148 4.446 1.00 0.00 H new ATOM 0 HG23 THR A 206 -18.449 5.307 3.532 1.00 0.00 H new ATOM 1299 N GLY A 207 -14.572 4.234 5.846 1.00 0.00 N ATOM 1300 CA GLY A 207 -13.317 3.695 6.337 1.00 0.00 C ATOM 1301 C GLY A 207 -12.788 2.572 5.468 1.00 0.00 C ATOM 1302 O GLY A 207 -11.617 2.203 5.560 1.00 0.00 O ATOM 0 H GLY A 207 -14.478 5.012 5.193 1.00 0.00 H new ATOM 0 HA2 GLY A 207 -12.576 4.493 6.384 1.00 0.00 H new ATOM 0 HA3 GLY A 207 -13.456 3.328 7.354 1.00 0.00 H new ATOM 1306 N LYS A 208 -13.653 2.023 4.622 1.00 0.00 N ATOM 1307 CA LYS A 208 -13.268 0.934 3.732 1.00 0.00 C ATOM 1308 C LYS A 208 -11.983 1.272 2.983 1.00 0.00 C ATOM 1309 O LYS A 208 -10.996 0.542 3.065 1.00 0.00 O ATOM 1310 CB LYS A 208 -14.391 0.642 2.735 1.00 0.00 C ATOM 1311 CG LYS A 208 -15.558 -0.119 3.338 1.00 0.00 C ATOM 1312 CD LYS A 208 -15.198 -1.571 3.608 1.00 0.00 C ATOM 1313 CE LYS A 208 -15.990 -2.134 4.778 1.00 0.00 C ATOM 1314 NZ LYS A 208 -16.164 -3.609 4.671 1.00 0.00 N ATOM 0 H LYS A 208 -14.626 2.315 4.534 1.00 0.00 H new ATOM 0 HA LYS A 208 -13.090 0.047 4.340 1.00 0.00 H new ATOM 0 HB2 LYS A 208 -14.755 1.584 2.325 1.00 0.00 H new ATOM 0 HB3 LYS A 208 -13.985 0.068 1.902 1.00 0.00 H new ATOM 0 HG2 LYS A 208 -15.864 0.360 4.268 1.00 0.00 H new ATOM 0 HG3 LYS A 208 -16.411 -0.075 2.661 1.00 0.00 H new ATOM 0 HD2 LYS A 208 -15.392 -2.167 2.716 1.00 0.00 H new ATOM 0 HD3 LYS A 208 -14.131 -1.649 3.818 1.00 0.00 H new ATOM 0 HE2 LYS A 208 -15.479 -1.895 5.711 1.00 0.00 H new ATOM 0 HE3 LYS A 208 -16.968 -1.655 4.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 208 -16.709 -3.954 5.487 1.00 0.00 H new ATOM 0 HZ2 LYS A 208 -16.674 -3.836 3.793 1.00 0.00 H new ATOM 0 HZ3 LYS A 208 -15.231 -4.069 4.658 1.00 0.00 H new ATOM 1328 N ALA A 209 -12.003 2.383 2.254 1.00 0.00 N ATOM 1329 CA ALA A 209 -10.838 2.819 1.494 1.00 0.00 C ATOM 1330 C ALA A 209 -10.076 3.912 2.235 1.00 0.00 C ATOM 1331 O ALA A 209 -10.620 4.568 3.124 1.00 0.00 O ATOM 1332 CB ALA A 209 -11.261 3.308 0.116 1.00 0.00 C ATOM 0 H ALA A 209 -12.813 2.997 2.174 1.00 0.00 H new ATOM 0 HA ALA A 209 -10.171 1.965 1.376 1.00 0.00 H new ATOM 0 HB1 ALA A 209 -10.382 3.631 -0.441 1.00 0.00 H new ATOM 0 HB2 ALA A 209 -11.754 2.498 -0.422 1.00 0.00 H new ATOM 0 HB3 ALA A 209 -11.950 4.146 0.223 1.00 0.00 H new ATOM 1338 N VAL A 210 -8.814 4.103 1.864 1.00 0.00 N ATOM 1339 CA VAL A 210 -7.977 5.117 2.494 1.00 0.00 C ATOM 1340 C VAL A 210 -7.535 6.170 1.484 1.00 0.00 C ATOM 1341 O VAL A 210 -7.448 5.897 0.286 1.00 0.00 O ATOM 1342 CB VAL A 210 -6.730 4.491 3.145 1.00 0.00 C ATOM 1343 CG1 VAL A 210 -7.132 3.536 4.259 1.00 0.00 C ATOM 1344 CG2 VAL A 210 -5.885 3.779 2.100 1.00 0.00 C ATOM 0 H VAL A 210 -8.349 3.569 1.130 1.00 0.00 H new ATOM 0 HA VAL A 210 -8.582 5.590 3.267 1.00 0.00 H new ATOM 0 HB VAL A 210 -6.130 5.289 3.582 1.00 0.00 H new ATOM 0 HG11 VAL A 210 -6.238 3.103 4.707 1.00 0.00 H new ATOM 0 HG12 VAL A 210 -7.693 4.080 5.020 1.00 0.00 H new ATOM 0 HG13 VAL A 210 -7.754 2.740 3.849 1.00 0.00 H new ATOM 0 HG21 VAL A 210 -5.008 3.342 2.577 1.00 0.00 H new ATOM 0 HG22 VAL A 210 -6.474 2.990 1.632 1.00 0.00 H new ATOM 0 HG23 VAL A 210 -5.567 4.494 1.341 1.00 0.00 H new ATOM 1354 N ILE A 211 -7.257 7.373 1.974 1.00 0.00 N ATOM 1355 CA ILE A 211 -6.822 8.466 1.114 1.00 0.00 C ATOM 1356 C ILE A 211 -5.424 8.943 1.495 1.00 0.00 C ATOM 1357 O ILE A 211 -5.146 9.210 2.664 1.00 0.00 O ATOM 1358 CB ILE A 211 -7.795 9.658 1.183 1.00 0.00 C ATOM 1359 CG1 ILE A 211 -9.207 9.215 0.793 1.00 0.00 C ATOM 1360 CG2 ILE A 211 -7.319 10.784 0.277 1.00 0.00 C ATOM 1361 CD1 ILE A 211 -10.298 10.062 1.409 1.00 0.00 C ATOM 0 H ILE A 211 -7.325 7.615 2.962 1.00 0.00 H new ATOM 0 HA ILE A 211 -6.806 8.079 0.095 1.00 0.00 H new ATOM 0 HB ILE A 211 -7.820 10.028 2.208 1.00 0.00 H new ATOM 0 HG12 ILE A 211 -9.302 9.247 -0.292 1.00 0.00 H new ATOM 0 HG13 ILE A 211 -9.350 8.177 1.095 1.00 0.00 H new ATOM 0 HG21 ILE A 211 -8.017 11.619 0.337 1.00 0.00 H new ATOM 0 HG22 ILE A 211 -6.330 11.114 0.596 1.00 0.00 H new ATOM 0 HG23 ILE A 211 -7.268 10.427 -0.751 1.00 0.00 H new ATOM 0 HD11 ILE A 211 -11.271 9.690 1.089 1.00 0.00 H new ATOM 0 HD12 ILE A 211 -10.229 10.010 2.496 1.00 0.00 H new ATOM 0 HD13 ILE A 211 -10.181 11.097 1.087 1.00 0.00 H new ATOM 1373 N ILE A 212 -4.550 9.050 0.500 1.00 0.00 N ATOM 1374 CA ILE A 212 -3.182 9.497 0.731 1.00 0.00 C ATOM 1375 C ILE A 212 -2.908 10.817 0.017 1.00 0.00 C ATOM 1376 O ILE A 212 -3.522 11.121 -1.004 1.00 0.00 O ATOM 1377 CB ILE A 212 -2.159 8.448 0.257 1.00 0.00 C ATOM 1378 CG1 ILE A 212 -2.224 8.290 -1.263 1.00 0.00 C ATOM 1379 CG2 ILE A 212 -2.411 7.115 0.945 1.00 0.00 C ATOM 1380 CD1 ILE A 212 -1.021 7.586 -1.850 1.00 0.00 C ATOM 0 H ILE A 212 -4.765 8.833 -0.473 1.00 0.00 H new ATOM 0 HA ILE A 212 -3.073 9.638 1.806 1.00 0.00 H new ATOM 0 HB ILE A 212 -1.159 8.790 0.525 1.00 0.00 H new ATOM 0 HG12 ILE A 212 -3.124 7.733 -1.524 1.00 0.00 H new ATOM 0 HG13 ILE A 212 -2.316 9.276 -1.719 1.00 0.00 H new ATOM 0 HG21 ILE A 212 -1.680 6.384 0.600 1.00 0.00 H new ATOM 0 HG22 ILE A 212 -2.318 7.239 2.024 1.00 0.00 H new ATOM 0 HG23 ILE A 212 -3.415 6.766 0.705 1.00 0.00 H new ATOM 0 HD11 ILE A 212 -1.136 7.510 -2.931 1.00 0.00 H new ATOM 0 HD12 ILE A 212 -0.119 8.154 -1.620 1.00 0.00 H new ATOM 0 HD13 ILE A 212 -0.940 6.587 -1.422 1.00 0.00 H new ATOM 1392 N ASN A 213 -1.980 11.596 0.562 1.00 0.00 N ATOM 1393 CA ASN A 213 -1.622 12.883 -0.023 1.00 0.00 C ATOM 1394 C ASN A 213 -0.125 12.955 -0.306 1.00 0.00 C ATOM 1395 O ASN A 213 0.625 12.035 0.020 1.00 0.00 O ATOM 1396 CB ASN A 213 -2.032 14.023 0.911 1.00 0.00 C ATOM 1397 CG ASN A 213 -1.530 13.819 2.328 1.00 0.00 C ATOM 1398 OD1 ASN A 213 -1.721 12.755 2.918 1.00 0.00 O ATOM 1399 ND2 ASN A 213 -0.884 14.840 2.880 1.00 0.00 N ATOM 0 H ASN A 213 -1.462 11.359 1.408 1.00 0.00 H new ATOM 0 HA ASN A 213 -2.157 12.986 -0.967 1.00 0.00 H new ATOM 0 HB2 ASN A 213 -1.643 14.965 0.523 1.00 0.00 H new ATOM 0 HB3 ASN A 213 -3.119 14.107 0.922 1.00 0.00 H new ATOM 0 HD21 ASN A 213 -0.523 14.761 3.831 1.00 0.00 H new ATOM 0 HD22 ASN A 213 -0.749 15.703 2.353 1.00 0.00 H new ATOM 1406 N LYS A 214 0.305 14.056 -0.913 1.00 0.00 N ATOM 1407 CA LYS A 214 1.712 14.251 -1.239 1.00 0.00 C ATOM 1408 C LYS A 214 2.420 15.042 -0.143 1.00 0.00 C ATOM 1409 O LYS A 214 2.129 16.219 0.074 1.00 0.00 O ATOM 1410 CB LYS A 214 1.851 14.979 -2.578 1.00 0.00 C ATOM 1411 CG LYS A 214 3.251 14.913 -3.164 1.00 0.00 C ATOM 1412 CD LYS A 214 3.425 13.699 -4.060 1.00 0.00 C ATOM 1413 CE LYS A 214 2.754 13.901 -5.409 1.00 0.00 C ATOM 1414 NZ LYS A 214 3.456 14.927 -6.229 1.00 0.00 N ATOM 0 H LYS A 214 -0.302 14.828 -1.189 1.00 0.00 H new ATOM 0 HA LYS A 214 2.180 13.270 -1.316 1.00 0.00 H new ATOM 0 HB2 LYS A 214 1.147 14.549 -3.291 1.00 0.00 H new ATOM 0 HB3 LYS A 214 1.571 16.024 -2.445 1.00 0.00 H new ATOM 0 HG2 LYS A 214 3.450 15.819 -3.736 1.00 0.00 H new ATOM 0 HG3 LYS A 214 3.983 14.878 -2.357 1.00 0.00 H new ATOM 0 HD2 LYS A 214 4.487 13.503 -4.207 1.00 0.00 H new ATOM 0 HD3 LYS A 214 3.003 12.821 -3.571 1.00 0.00 H new ATOM 0 HE2 LYS A 214 2.734 12.955 -5.950 1.00 0.00 H new ATOM 0 HE3 LYS A 214 1.718 14.204 -5.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 214 2.999 14.999 -7.160 1.00 0.00 H new ATOM 0 HZ2 LYS A 214 3.409 15.848 -5.748 1.00 0.00 H new ATOM 0 HZ3 LYS A 214 4.451 14.651 -6.352 1.00 0.00 H new ATOM 1428 N THR A 215 3.351 14.389 0.545 1.00 0.00 N ATOM 1429 CA THR A 215 4.100 15.031 1.618 1.00 0.00 C ATOM 1430 C THR A 215 5.601 14.954 1.363 1.00 0.00 C ATOM 1431 O THR A 215 6.118 13.915 0.953 1.00 0.00 O ATOM 1432 CB THR A 215 3.789 14.388 2.983 1.00 0.00 C ATOM 1433 OG1 THR A 215 4.035 12.979 2.928 1.00 0.00 O ATOM 1434 CG2 THR A 215 2.343 14.640 3.383 1.00 0.00 C ATOM 0 H THR A 215 3.604 13.415 0.378 1.00 0.00 H new ATOM 0 HA THR A 215 3.791 16.076 1.638 1.00 0.00 H new ATOM 0 HB THR A 215 4.440 14.841 3.730 1.00 0.00 H new ATOM 0 HG1 THR A 215 4.699 12.790 2.232 1.00 0.00 H new ATOM 0 HG21 THR A 215 2.147 14.177 4.350 1.00 0.00 H new ATOM 0 HG22 THR A 215 2.166 15.713 3.453 1.00 0.00 H new ATOM 0 HG23 THR A 215 1.678 14.211 2.633 1.00 0.00 H new ATOM 1442 N SER A 216 6.295 16.061 1.609 1.00 0.00 N ATOM 1443 CA SER A 216 7.738 16.119 1.403 1.00 0.00 C ATOM 1444 C SER A 216 8.426 14.915 2.038 1.00 0.00 C ATOM 1445 O SER A 216 9.240 14.246 1.404 1.00 0.00 O ATOM 1446 CB SER A 216 8.305 17.414 1.988 1.00 0.00 C ATOM 1447 OG SER A 216 8.004 17.525 3.368 1.00 0.00 O ATOM 0 H SER A 216 5.882 16.929 1.951 1.00 0.00 H new ATOM 0 HA SER A 216 7.929 16.099 0.330 1.00 0.00 H new ATOM 0 HB2 SER A 216 9.385 17.439 1.845 1.00 0.00 H new ATOM 0 HB3 SER A 216 7.893 18.269 1.453 1.00 0.00 H new ATOM 0 HG SER A 216 8.379 18.360 3.718 1.00 0.00 H new ATOM 1453 N ASN A 217 8.093 14.647 3.296 1.00 0.00 N ATOM 1454 CA ASN A 217 8.679 13.524 4.019 1.00 0.00 C ATOM 1455 C ASN A 217 8.741 12.281 3.137 1.00 0.00 C ATOM 1456 O ASN A 217 9.662 11.471 3.249 1.00 0.00 O ATOM 1457 CB ASN A 217 7.870 13.226 5.283 1.00 0.00 C ATOM 1458 CG ASN A 217 8.358 14.016 6.482 1.00 0.00 C ATOM 1459 OD1 ASN A 217 7.706 14.963 6.922 1.00 0.00 O ATOM 1460 ND2 ASN A 217 9.510 13.628 7.016 1.00 0.00 N ATOM 0 H ASN A 217 7.421 15.192 3.836 1.00 0.00 H new ATOM 0 HA ASN A 217 9.695 13.798 4.302 1.00 0.00 H new ATOM 0 HB2 ASN A 217 6.820 13.457 5.102 1.00 0.00 H new ATOM 0 HB3 ASN A 217 7.928 12.161 5.505 1.00 0.00 H new ATOM 0 HD21 ASN A 217 9.889 14.121 7.825 1.00 0.00 H new ATOM 0 HD22 ASN A 217 10.016 12.837 6.618 1.00 0.00 H new ATOM 1467 N THR A 218 7.755 12.137 2.257 1.00 0.00 N ATOM 1468 CA THR A 218 7.696 10.994 1.355 1.00 0.00 C ATOM 1469 C THR A 218 8.841 11.028 0.349 1.00 0.00 C ATOM 1470 O THR A 218 8.971 11.976 -0.425 1.00 0.00 O ATOM 1471 CB THR A 218 6.359 10.947 0.592 1.00 0.00 C ATOM 1472 OG1 THR A 218 5.294 11.383 1.445 1.00 0.00 O ATOM 1473 CG2 THR A 218 6.070 9.541 0.090 1.00 0.00 C ATOM 0 H THR A 218 6.986 12.798 2.150 1.00 0.00 H new ATOM 0 HA THR A 218 7.784 10.100 1.973 1.00 0.00 H new ATOM 0 HB THR A 218 6.433 11.613 -0.268 1.00 0.00 H new ATOM 0 HG1 THR A 218 5.353 10.918 2.306 1.00 0.00 H new ATOM 0 HG21 THR A 218 5.121 9.534 -0.445 1.00 0.00 H new ATOM 0 HG22 THR A 218 6.868 9.223 -0.581 1.00 0.00 H new ATOM 0 HG23 THR A 218 6.014 8.857 0.937 1.00 0.00 H new ATOM 1481 N ARG A 219 9.668 9.988 0.365 1.00 0.00 N ATOM 1482 CA ARG A 219 10.803 9.899 -0.546 1.00 0.00 C ATOM 1483 C ARG A 219 10.958 8.480 -1.086 1.00 0.00 C ATOM 1484 O ARG A 219 10.320 7.547 -0.597 1.00 0.00 O ATOM 1485 CB ARG A 219 12.088 10.330 0.162 1.00 0.00 C ATOM 1486 CG ARG A 219 12.284 9.675 1.519 1.00 0.00 C ATOM 1487 CD ARG A 219 13.044 8.362 1.400 1.00 0.00 C ATOM 1488 NE ARG A 219 14.487 8.570 1.325 1.00 0.00 N ATOM 1489 CZ ARG A 219 15.260 8.749 2.390 1.00 0.00 C ATOM 1490 NH1 ARG A 219 14.731 8.745 3.606 1.00 0.00 N ATOM 1491 NH2 ARG A 219 16.566 8.932 2.241 1.00 0.00 N ATOM 0 H ARG A 219 9.573 9.195 0.999 1.00 0.00 H new ATOM 0 HA ARG A 219 10.616 10.570 -1.385 1.00 0.00 H new ATOM 0 HB2 ARG A 219 12.941 10.092 -0.474 1.00 0.00 H new ATOM 0 HB3 ARG A 219 12.078 11.413 0.289 1.00 0.00 H new ATOM 0 HG2 ARG A 219 12.828 10.353 2.176 1.00 0.00 H new ATOM 0 HG3 ARG A 219 11.313 9.494 1.981 1.00 0.00 H new ATOM 0 HD2 ARG A 219 12.813 7.730 2.258 1.00 0.00 H new ATOM 0 HD3 ARG A 219 12.708 7.828 0.511 1.00 0.00 H new ATOM 0 HE ARG A 219 14.926 8.578 0.404 1.00 0.00 H new ATOM 0 HH11 ARG A 219 13.728 8.604 3.725 1.00 0.00 H new ATOM 0 HH12 ARG A 219 15.327 8.883 4.422 1.00 0.00 H new ATOM 0 HH21 ARG A 219 16.977 8.935 1.308 1.00 0.00 H new ATOM 0 HH22 ARG A 219 17.158 9.069 3.060 1.00 0.00 H new ATOM 1505 N ILE A 220 11.807 8.327 -2.096 1.00 0.00 N ATOM 1506 CA ILE A 220 12.046 7.022 -2.701 1.00 0.00 C ATOM 1507 C ILE A 220 12.842 6.120 -1.765 1.00 0.00 C ATOM 1508 O ILE A 220 13.794 6.547 -1.111 1.00 0.00 O ATOM 1509 CB ILE A 220 12.801 7.151 -4.037 1.00 0.00 C ATOM 1510 CG1 ILE A 220 11.993 7.995 -5.025 1.00 0.00 C ATOM 1511 CG2 ILE A 220 13.086 5.774 -4.619 1.00 0.00 C ATOM 1512 CD1 ILE A 220 12.778 8.406 -6.251 1.00 0.00 C ATOM 0 H ILE A 220 12.341 9.090 -2.513 1.00 0.00 H new ATOM 0 HA ILE A 220 11.069 6.576 -2.887 1.00 0.00 H new ATOM 0 HB ILE A 220 13.752 7.651 -3.853 1.00 0.00 H new ATOM 0 HG12 ILE A 220 11.114 7.431 -5.338 1.00 0.00 H new ATOM 0 HG13 ILE A 220 11.633 8.890 -4.517 1.00 0.00 H new ATOM 0 HG21 ILE A 220 13.620 5.881 -5.563 1.00 0.00 H new ATOM 0 HG22 ILE A 220 13.697 5.203 -3.920 1.00 0.00 H new ATOM 0 HG23 ILE A 220 12.146 5.250 -4.792 1.00 0.00 H new ATOM 0 HD11 ILE A 220 12.143 9.001 -6.907 1.00 0.00 H new ATOM 0 HD12 ILE A 220 13.642 8.997 -5.948 1.00 0.00 H new ATOM 0 HD13 ILE A 220 13.115 7.516 -6.782 1.00 0.00 H new ATOM 1524 N PRO A 221 12.447 4.839 -1.699 1.00 0.00 N ATOM 1525 CA PRO A 221 13.112 3.848 -0.848 1.00 0.00 C ATOM 1526 C PRO A 221 14.507 3.494 -1.352 1.00 0.00 C ATOM 1527 O PRO A 221 14.951 4.000 -2.382 1.00 0.00 O ATOM 1528 CB PRO A 221 12.188 2.631 -0.932 1.00 0.00 C ATOM 1529 CG PRO A 221 11.481 2.781 -2.235 1.00 0.00 C ATOM 1530 CD PRO A 221 11.321 4.261 -2.451 1.00 0.00 C ATOM 0 HA PRO A 221 13.262 4.217 0.167 1.00 0.00 H new ATOM 0 HB2 PRO A 221 12.754 1.701 -0.894 1.00 0.00 H new ATOM 0 HB3 PRO A 221 11.484 2.610 -0.100 1.00 0.00 H new ATOM 0 HG2 PRO A 221 12.054 2.328 -3.044 1.00 0.00 H new ATOM 0 HG3 PRO A 221 10.512 2.283 -2.213 1.00 0.00 H new ATOM 0 HD2 PRO A 221 11.369 4.520 -3.509 1.00 0.00 H new ATOM 0 HD3 PRO A 221 10.362 4.620 -2.078 1.00 0.00 H new ATOM 1538 N GLU A 222 15.192 2.622 -0.619 1.00 0.00 N ATOM 1539 CA GLU A 222 16.537 2.201 -0.993 1.00 0.00 C ATOM 1540 C GLU A 222 16.496 1.232 -2.171 1.00 0.00 C ATOM 1541 O GLU A 222 17.287 1.344 -3.107 1.00 0.00 O ATOM 1542 CB GLU A 222 17.240 1.545 0.197 1.00 0.00 C ATOM 1543 CG GLU A 222 17.857 2.541 1.165 1.00 0.00 C ATOM 1544 CD GLU A 222 18.814 1.888 2.143 1.00 0.00 C ATOM 1545 OE1 GLU A 222 19.989 1.680 1.774 1.00 0.00 O ATOM 1546 OE2 GLU A 222 18.388 1.586 3.277 1.00 0.00 O ATOM 0 H GLU A 222 14.838 2.194 0.236 1.00 0.00 H new ATOM 0 HA GLU A 222 17.097 3.087 -1.293 1.00 0.00 H new ATOM 0 HB2 GLU A 222 16.523 0.925 0.735 1.00 0.00 H new ATOM 0 HB3 GLU A 222 18.020 0.881 -0.174 1.00 0.00 H new ATOM 0 HG2 GLU A 222 18.387 3.309 0.602 1.00 0.00 H new ATOM 0 HG3 GLU A 222 17.064 3.043 1.719 1.00 0.00 H new ATOM 1553 N GLN A 223 15.569 0.281 -2.115 1.00 0.00 N ATOM 1554 CA GLN A 223 15.426 -0.709 -3.177 1.00 0.00 C ATOM 1555 C GLN A 223 13.956 -0.941 -3.509 1.00 0.00 C ATOM 1556 O GLN A 223 13.096 -0.895 -2.630 1.00 0.00 O ATOM 1557 CB GLN A 223 16.082 -2.027 -2.765 1.00 0.00 C ATOM 1558 CG GLN A 223 17.596 -2.023 -2.904 1.00 0.00 C ATOM 1559 CD GLN A 223 18.249 -3.202 -2.210 1.00 0.00 C ATOM 1560 OE1 GLN A 223 17.609 -4.224 -1.963 1.00 0.00 O ATOM 1561 NE2 GLN A 223 19.531 -3.065 -1.890 1.00 0.00 N ATOM 0 H GLN A 223 14.906 0.175 -1.347 1.00 0.00 H new ATOM 0 HA GLN A 223 15.925 -0.326 -4.067 1.00 0.00 H new ATOM 0 HB2 GLN A 223 15.821 -2.245 -1.729 1.00 0.00 H new ATOM 0 HB3 GLN A 223 15.672 -2.833 -3.373 1.00 0.00 H new ATOM 0 HG2 GLN A 223 17.860 -2.037 -3.961 1.00 0.00 H new ATOM 0 HG3 GLN A 223 17.993 -1.097 -2.489 1.00 0.00 H new ATOM 0 HE21 GLN A 223 20.023 -2.200 -2.114 1.00 0.00 H new ATOM 0 HE22 GLN A 223 20.023 -3.825 -1.421 1.00 0.00 H new ATOM 1570 N ARG A 224 13.675 -1.189 -4.784 1.00 0.00 N ATOM 1571 CA ARG A 224 12.309 -1.427 -5.234 1.00 0.00 C ATOM 1572 C ARG A 224 11.863 -2.846 -4.892 1.00 0.00 C ATOM 1573 O ARG A 224 12.594 -3.599 -4.248 1.00 0.00 O ATOM 1574 CB ARG A 224 12.197 -1.194 -6.741 1.00 0.00 C ATOM 1575 CG ARG A 224 12.316 0.267 -7.143 1.00 0.00 C ATOM 1576 CD ARG A 224 11.007 1.011 -6.933 1.00 0.00 C ATOM 1577 NE ARG A 224 11.183 2.459 -7.000 1.00 0.00 N ATOM 1578 CZ ARG A 224 11.327 3.130 -8.138 1.00 0.00 C ATOM 1579 NH1 ARG A 224 11.315 2.487 -9.297 1.00 0.00 N ATOM 1580 NH2 ARG A 224 11.483 4.448 -8.117 1.00 0.00 N ATOM 0 H ARG A 224 14.376 -1.230 -5.524 1.00 0.00 H new ATOM 0 HA ARG A 224 11.655 -0.725 -4.716 1.00 0.00 H new ATOM 0 HB2 ARG A 224 12.975 -1.766 -7.247 1.00 0.00 H new ATOM 0 HB3 ARG A 224 11.239 -1.581 -7.090 1.00 0.00 H new ATOM 0 HG2 ARG A 224 13.104 0.743 -6.559 1.00 0.00 H new ATOM 0 HG3 ARG A 224 12.610 0.334 -8.190 1.00 0.00 H new ATOM 0 HD2 ARG A 224 10.287 0.698 -7.689 1.00 0.00 H new ATOM 0 HD3 ARG A 224 10.588 0.741 -5.963 1.00 0.00 H new ATOM 0 HE ARG A 224 11.196 2.984 -6.126 1.00 0.00 H new ATOM 0 HH11 ARG A 224 11.195 1.474 -9.317 1.00 0.00 H new ATOM 0 HH12 ARG A 224 11.426 3.005 -10.169 1.00 0.00 H new ATOM 0 HH21 ARG A 224 11.492 4.946 -7.227 1.00 0.00 H new ATOM 0 HH22 ARG A 224 11.594 4.962 -8.991 1.00 0.00 H new ATOM 1594 N PHE A 225 10.660 -3.204 -5.329 1.00 0.00 N ATOM 1595 CA PHE A 225 10.116 -4.532 -5.068 1.00 0.00 C ATOM 1596 C PHE A 225 10.747 -5.568 -5.994 1.00 0.00 C ATOM 1597 O PHE A 225 11.002 -6.703 -5.590 1.00 0.00 O ATOM 1598 CB PHE A 225 8.597 -4.528 -5.248 1.00 0.00 C ATOM 1599 CG PHE A 225 7.854 -3.982 -4.063 1.00 0.00 C ATOM 1600 CD1 PHE A 225 8.273 -2.815 -3.444 1.00 0.00 C ATOM 1601 CD2 PHE A 225 6.737 -4.635 -3.567 1.00 0.00 C ATOM 1602 CE1 PHE A 225 7.592 -2.310 -2.352 1.00 0.00 C ATOM 1603 CE2 PHE A 225 6.052 -4.135 -2.476 1.00 0.00 C ATOM 1604 CZ PHE A 225 6.479 -2.970 -1.868 1.00 0.00 C ATOM 0 H PHE A 225 10.043 -2.593 -5.865 1.00 0.00 H new ATOM 0 HA PHE A 225 10.352 -4.799 -4.038 1.00 0.00 H new ATOM 0 HB2 PHE A 225 8.345 -3.937 -6.128 1.00 0.00 H new ATOM 0 HB3 PHE A 225 8.259 -5.546 -5.441 1.00 0.00 H new ATOM 0 HD1 PHE A 225 9.142 -2.294 -3.819 1.00 0.00 H new ATOM 0 HD2 PHE A 225 6.398 -5.545 -4.039 1.00 0.00 H new ATOM 0 HE1 PHE A 225 7.930 -1.400 -1.878 1.00 0.00 H new ATOM 0 HE2 PHE A 225 5.183 -4.654 -2.099 1.00 0.00 H new ATOM 0 HZ PHE A 225 5.944 -2.576 -1.016 1.00 0.00 H new ATOM 1614 N SER A 226 10.995 -5.170 -7.237 1.00 0.00 N ATOM 1615 CA SER A 226 11.592 -6.065 -8.222 1.00 0.00 C ATOM 1616 C SER A 226 13.067 -6.304 -7.915 1.00 0.00 C ATOM 1617 O SER A 226 13.628 -7.336 -8.280 1.00 0.00 O ATOM 1618 CB SER A 226 11.439 -5.484 -9.629 1.00 0.00 C ATOM 1619 OG SER A 226 11.717 -6.461 -10.617 1.00 0.00 O ATOM 0 H SER A 226 10.792 -4.234 -7.587 1.00 0.00 H new ATOM 0 HA SER A 226 11.069 -7.020 -8.173 1.00 0.00 H new ATOM 0 HB2 SER A 226 10.425 -5.106 -9.762 1.00 0.00 H new ATOM 0 HB3 SER A 226 12.113 -4.636 -9.751 1.00 0.00 H new ATOM 0 HG SER A 226 11.611 -6.065 -11.507 1.00 0.00 H new ATOM 1625 N GLU A 227 13.689 -5.340 -7.243 1.00 0.00 N ATOM 1626 CA GLU A 227 15.100 -5.445 -6.888 1.00 0.00 C ATOM 1627 C GLU A 227 15.322 -6.557 -5.867 1.00 0.00 C ATOM 1628 O GLU A 227 16.448 -7.014 -5.666 1.00 0.00 O ATOM 1629 CB GLU A 227 15.608 -4.115 -6.329 1.00 0.00 C ATOM 1630 CG GLU A 227 15.786 -3.038 -7.386 1.00 0.00 C ATOM 1631 CD GLU A 227 17.012 -3.265 -8.249 1.00 0.00 C ATOM 1632 OE1 GLU A 227 17.984 -3.870 -7.750 1.00 0.00 O ATOM 1633 OE2 GLU A 227 16.999 -2.838 -9.422 1.00 0.00 O ATOM 0 H GLU A 227 13.239 -4.479 -6.934 1.00 0.00 H new ATOM 0 HA GLU A 227 15.659 -5.688 -7.792 1.00 0.00 H new ATOM 0 HB2 GLU A 227 14.909 -3.758 -5.573 1.00 0.00 H new ATOM 0 HB3 GLU A 227 16.562 -4.282 -5.828 1.00 0.00 H new ATOM 0 HG2 GLU A 227 14.900 -3.007 -8.021 1.00 0.00 H new ATOM 0 HG3 GLU A 227 15.864 -2.066 -6.899 1.00 0.00 H new