USER MOD reduce.3.24.130724 H: found=0, std=0, add=870, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 874 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: A1573 SER OG : rot -7:sc= 1.1 USER MOD Set 1.2: A1596 SER OG : rot -140:sc= 1.06 USER MOD Set 2.1: A1589 GLN : amide:sc= -0.0795 X(o=-0.23,f=-0.15) USER MOD Set 2.2: A1611 SER OG : rot 180:sc= -0.149 USER MOD Set 3.1: A1578 ASN : amide:sc= -0.872 K(o=0.28,f=-9.3!) USER MOD Set 3.2: A1593 LYS NZ :NH3+ 141:sc= 1.15 (180deg=0) USER MOD Single : A1517 GLN : amide:sc= -0.169 K(o=-0.17,f=-0.8) USER MOD Single : A1519 THR OG1 : rot 180:sc=-0.000332 USER MOD Single : A1520 ASN : amide:sc= -0.0503 K(o=-0.05,f=-0.82) USER MOD Single : A1522 SER OG : rot 110:sc= -1.03 USER MOD Single : A1523 THR OG1 : rot 180:sc= 0.0146 USER MOD Single : A1525 HIS : no HD1:sc= -0.228 X(o=-0.23,f=0.019) USER MOD Single : A1530 SER OG : rot 31:sc= 0.969 USER MOD Single : A1531 SER OG : rot 68:sc= 1.27 USER MOD Single : A1533 SER OG : rot 69:sc= 1.19 USER MOD Single : A1539 THR OG1 : rot -106:sc= 0.39 USER MOD Single : A1542 TYR OH : rot 4:sc= 0.197 USER MOD Single : A1549 TYR OH : rot 180:sc= 0 USER MOD Single : A1550 MET CE :methyl -166:sc= -0.0463 (180deg=-0.333) USER MOD Single : A1551 SER OG : rot 86:sc= 1.25 USER MOD Single : A1556 ASN : amide:sc= 0.53 K(o=0.53,f=-9.5!) USER MOD Single : A1558 ASN :FLIP amide:sc= 0 F(o=-0.66,f=0) USER MOD Single : A1569 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1570 THR OG1 : rot 180:sc= 0 USER MOD Single : A1576 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1579 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0321) USER MOD Single : A1583 TYR OH : rot 180:sc= 0 USER MOD Single : A1586 GLN : amide:sc= -0.0846 X(o=-0.085,f=-0.085) USER MOD Single : A1592 TYR OH : rot -117:sc= 2.25 USER MOD Single : A1605 SER OG : rot 180:sc= 0 USER MOD Single : A1606 TYR OH : rot 180:sc= 0 USER MOD Single : A1607 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1608 SER OG : rot 67:sc= 0.648 USER MOD Single : A1625 MET CE :methyl 162:sc= -0.128 (180deg=-0.565) USER MOD Single : A1628 SER OG : rot 180:sc= 0 USER MOD Single : A1631 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1632 GLN : amide:sc= -0.154 X(o=-0.15,f=-0.55) USER MOD Single : A1633 THR OG1 : rot -59:sc= 1.05 USER MOD Single : A1635 THR OG1 : rot 180:sc=-4.59e-05 USER MOD Single : A1639 SER OG : rot -51:sc= 0.434 USER MOD Single : A1641 HIS : no HD1:sc= 0 X(o=0,f=-0.026) USER MOD Single : A1642 THR OG1 : rot 130:sc= -0.533 USER MOD ----------------------------------------------------------------- ATOM 124 N CYS A1516 8.449 7.560 -0.980 1.00 0.00 N ATOM 125 CA CYS A1516 8.369 6.160 -0.579 1.00 0.00 C ATOM 126 C CYS A1516 9.712 5.482 -0.745 1.00 0.00 C ATOM 127 O CYS A1516 9.885 4.518 -1.532 1.00 0.00 O ATOM 128 CB CYS A1516 7.267 5.438 -1.326 1.00 0.00 C ATOM 129 SG CYS A1516 5.680 6.303 -1.205 1.00 0.00 S ATOM 0 HA CYS A1516 8.110 6.118 0.479 1.00 0.00 H new ATOM 0 HB2 CYS A1516 7.546 5.339 -2.375 1.00 0.00 H new ATOM 0 HB3 CYS A1516 7.161 4.429 -0.927 1.00 0.00 H new ATOM 134 N GLN A1517 10.660 5.992 -0.003 1.00 0.00 N ATOM 135 CA GLN A1517 12.002 5.512 -0.011 1.00 0.00 C ATOM 136 C GLN A1517 12.532 5.509 1.405 1.00 0.00 C ATOM 137 O GLN A1517 12.239 6.413 2.190 1.00 0.00 O ATOM 138 CB GLN A1517 12.881 6.377 -0.921 1.00 0.00 C ATOM 139 CG GLN A1517 12.848 7.863 -0.588 1.00 0.00 C ATOM 140 CD GLN A1517 13.790 8.676 -1.440 1.00 0.00 C ATOM 141 OE1 GLN A1517 14.941 8.890 -1.078 1.00 0.00 O ATOM 142 NE2 GLN A1517 13.332 9.123 -2.567 1.00 0.00 N ATOM 0 H GLN A1517 10.508 6.772 0.637 1.00 0.00 H new ATOM 0 HA GLN A1517 12.022 4.496 -0.405 1.00 0.00 H new ATOM 0 HB2 GLN A1517 13.910 6.024 -0.856 1.00 0.00 H new ATOM 0 HB3 GLN A1517 12.561 6.240 -1.954 1.00 0.00 H new ATOM 0 HG2 GLN A1517 11.833 8.237 -0.719 1.00 0.00 H new ATOM 0 HG3 GLN A1517 13.105 8.001 0.462 1.00 0.00 H new ATOM 0 HE21 GLN A1517 12.369 8.927 -2.840 1.00 0.00 H new ATOM 0 HE22 GLN A1517 13.935 9.670 -3.181 1.00 0.00 H new ATOM 151 N VAL A1518 13.254 4.492 1.742 1.00 0.00 N ATOM 152 CA VAL A1518 13.830 4.346 3.052 1.00 0.00 C ATOM 153 C VAL A1518 15.337 4.325 2.927 1.00 0.00 C ATOM 154 O VAL A1518 15.892 3.555 2.137 1.00 0.00 O ATOM 155 CB VAL A1518 13.337 3.038 3.747 1.00 0.00 C ATOM 156 CG1 VAL A1518 14.007 2.845 5.095 1.00 0.00 C ATOM 157 CG2 VAL A1518 11.832 3.071 3.930 1.00 0.00 C ATOM 0 H VAL A1518 13.468 3.722 1.109 1.00 0.00 H new ATOM 0 HA VAL A1518 13.515 5.189 3.668 1.00 0.00 H new ATOM 0 HB VAL A1518 13.606 2.201 3.103 1.00 0.00 H new ATOM 0 HG11 VAL A1518 13.643 1.926 5.554 1.00 0.00 H new ATOM 0 HG12 VAL A1518 15.086 2.780 4.959 1.00 0.00 H new ATOM 0 HG13 VAL A1518 13.773 3.691 5.742 1.00 0.00 H new ATOM 0 HG21 VAL A1518 11.504 2.152 4.416 1.00 0.00 H new ATOM 0 HG22 VAL A1518 11.559 3.926 4.549 1.00 0.00 H new ATOM 0 HG23 VAL A1518 11.349 3.159 2.957 1.00 0.00 H new ATOM 167 N THR A1519 15.988 5.191 3.644 1.00 0.00 N ATOM 168 CA THR A1519 17.413 5.230 3.647 1.00 0.00 C ATOM 169 C THR A1519 17.900 4.687 4.971 1.00 0.00 C ATOM 170 O THR A1519 17.634 5.273 6.026 1.00 0.00 O ATOM 171 CB THR A1519 17.918 6.667 3.470 1.00 0.00 C ATOM 172 OG1 THR A1519 17.224 7.257 2.368 1.00 0.00 O ATOM 173 CG2 THR A1519 19.415 6.669 3.177 1.00 0.00 C ATOM 0 H THR A1519 15.544 5.888 4.242 1.00 0.00 H new ATOM 0 HA THR A1519 17.793 4.630 2.820 1.00 0.00 H new ATOM 0 HB THR A1519 17.738 7.232 4.385 1.00 0.00 H new ATOM 0 HG1 THR A1519 17.534 8.178 2.242 1.00 0.00 H new ATOM 0 HG21 THR A1519 19.760 7.695 3.054 1.00 0.00 H new ATOM 0 HG22 THR A1519 19.949 6.204 4.006 1.00 0.00 H new ATOM 0 HG23 THR A1519 19.607 6.109 2.262 1.00 0.00 H new ATOM 181 N ASN A1520 18.557 3.566 4.924 1.00 0.00 N ATOM 182 CA ASN A1520 19.080 2.955 6.123 1.00 0.00 C ATOM 183 C ASN A1520 20.547 3.252 6.223 1.00 0.00 C ATOM 184 O ASN A1520 21.327 2.691 5.461 1.00 0.00 O ATOM 185 CB ASN A1520 18.875 1.434 6.113 1.00 0.00 C ATOM 186 CG ASN A1520 17.426 1.012 6.190 1.00 0.00 C ATOM 187 OD1 ASN A1520 16.595 1.692 6.773 1.00 0.00 O ATOM 188 ND2 ASN A1520 17.122 -0.111 5.619 1.00 0.00 N ATOM 0 H ASN A1520 18.747 3.049 4.066 1.00 0.00 H new ATOM 0 HA ASN A1520 18.544 3.366 6.979 1.00 0.00 H new ATOM 0 HB2 ASN A1520 19.315 1.024 5.204 1.00 0.00 H new ATOM 0 HB3 ASN A1520 19.415 0.999 6.954 1.00 0.00 H new ATOM 0 HD21 ASN A1520 16.162 -0.454 5.647 1.00 0.00 H new ATOM 0 HD22 ASN A1520 17.843 -0.652 5.141 1.00 0.00 H new ATOM 195 N PRO A1521 20.968 4.147 7.146 1.00 0.00 N ATOM 196 CA PRO A1521 22.387 4.503 7.325 1.00 0.00 C ATOM 197 C PRO A1521 23.209 3.318 7.827 1.00 0.00 C ATOM 198 O PRO A1521 24.434 3.327 7.760 1.00 0.00 O ATOM 199 CB PRO A1521 22.358 5.617 8.384 1.00 0.00 C ATOM 200 CG PRO A1521 20.951 6.104 8.389 1.00 0.00 C ATOM 201 CD PRO A1521 20.109 4.907 8.074 1.00 0.00 C ATOM 0 HA PRO A1521 22.851 4.809 6.387 1.00 0.00 H new ATOM 0 HB2 PRO A1521 22.648 5.238 9.364 1.00 0.00 H new ATOM 0 HB3 PRO A1521 23.053 6.419 8.133 1.00 0.00 H new ATOM 0 HG2 PRO A1521 20.686 6.526 9.359 1.00 0.00 H new ATOM 0 HG3 PRO A1521 20.806 6.891 7.649 1.00 0.00 H new ATOM 0 HD2 PRO A1521 19.870 4.332 8.969 1.00 0.00 H new ATOM 0 HD3 PRO A1521 19.162 5.187 7.613 1.00 0.00 H new ATOM 209 N SER A1522 22.513 2.309 8.313 1.00 0.00 N ATOM 210 CA SER A1522 23.094 1.086 8.787 1.00 0.00 C ATOM 211 C SER A1522 23.846 0.353 7.666 1.00 0.00 C ATOM 212 O SER A1522 25.003 -0.064 7.833 1.00 0.00 O ATOM 213 CB SER A1522 21.967 0.242 9.367 1.00 0.00 C ATOM 214 OG SER A1522 20.760 0.461 8.620 1.00 0.00 O ATOM 0 H SER A1522 21.496 2.327 8.388 1.00 0.00 H new ATOM 0 HA SER A1522 23.838 1.289 9.558 1.00 0.00 H new ATOM 0 HB2 SER A1522 22.238 -0.813 9.336 1.00 0.00 H new ATOM 0 HB3 SER A1522 21.809 0.500 10.414 1.00 0.00 H new ATOM 0 HG SER A1522 20.546 -0.343 8.102 1.00 0.00 H new ATOM 220 N THR A1523 23.207 0.208 6.536 1.00 0.00 N ATOM 221 CA THR A1523 23.826 -0.426 5.410 1.00 0.00 C ATOM 222 C THR A1523 24.254 0.587 4.352 1.00 0.00 C ATOM 223 O THR A1523 25.143 0.328 3.549 1.00 0.00 O ATOM 224 CB THR A1523 22.902 -1.489 4.814 1.00 0.00 C ATOM 225 OG1 THR A1523 21.548 -0.984 4.819 1.00 0.00 O ATOM 226 CG2 THR A1523 22.986 -2.780 5.611 1.00 0.00 C ATOM 0 H THR A1523 22.251 0.524 6.373 1.00 0.00 H new ATOM 0 HA THR A1523 24.731 -0.918 5.766 1.00 0.00 H new ATOM 0 HB THR A1523 23.211 -1.706 3.792 1.00 0.00 H new ATOM 0 HG1 THR A1523 20.946 -1.657 4.437 1.00 0.00 H new ATOM 0 HG21 THR A1523 22.321 -3.523 5.171 1.00 0.00 H new ATOM 0 HG22 THR A1523 24.010 -3.153 5.593 1.00 0.00 H new ATOM 0 HG23 THR A1523 22.687 -2.591 6.642 1.00 0.00 H new ATOM 234 N GLY A1524 23.616 1.744 4.378 1.00 0.00 N ATOM 235 CA GLY A1524 23.932 2.805 3.457 1.00 0.00 C ATOM 236 C GLY A1524 23.223 2.631 2.139 1.00 0.00 C ATOM 237 O GLY A1524 23.708 3.081 1.106 1.00 0.00 O ATOM 0 H GLY A1524 22.870 1.967 5.037 1.00 0.00 H new ATOM 0 HA2 GLY A1524 23.653 3.763 3.896 1.00 0.00 H new ATOM 0 HA3 GLY A1524 25.009 2.833 3.290 1.00 0.00 H new ATOM 241 N HIS A1525 22.065 1.992 2.166 1.00 0.00 N ATOM 242 CA HIS A1525 21.318 1.712 0.941 1.00 0.00 C ATOM 243 C HIS A1525 19.968 2.392 0.948 1.00 0.00 C ATOM 244 O HIS A1525 19.377 2.626 2.022 1.00 0.00 O ATOM 245 CB HIS A1525 21.156 0.198 0.692 1.00 0.00 C ATOM 246 CG HIS A1525 22.420 -0.507 0.302 1.00 0.00 C ATOM 247 ND1 HIS A1525 22.649 -1.014 -0.956 1.00 0.00 N ATOM 248 CD2 HIS A1525 23.525 -0.793 1.020 1.00 0.00 C ATOM 249 CE1 HIS A1525 23.839 -1.573 -0.985 1.00 0.00 C ATOM 250 NE2 HIS A1525 24.389 -1.452 0.200 1.00 0.00 N ATOM 0 H HIS A1525 21.619 1.656 3.019 1.00 0.00 H new ATOM 0 HA HIS A1525 21.905 2.122 0.119 1.00 0.00 H new ATOM 0 HB2 HIS A1525 20.760 -0.266 1.596 1.00 0.00 H new ATOM 0 HB3 HIS A1525 20.415 0.049 -0.093 1.00 0.00 H new ATOM 0 HD2 HIS A1525 23.694 -0.544 2.057 1.00 0.00 H new ATOM 0 HE1 HIS A1525 24.289 -2.052 -1.842 1.00 0.00 H new ATOM 0 HE2 HIS A1525 25.313 -1.795 0.464 1.00 0.00 H new ATOM 259 N LEU A1526 19.496 2.706 -0.240 1.00 0.00 N ATOM 260 CA LEU A1526 18.231 3.365 -0.449 1.00 0.00 C ATOM 261 C LEU A1526 17.231 2.365 -1.013 1.00 0.00 C ATOM 262 O LEU A1526 17.359 1.914 -2.160 1.00 0.00 O ATOM 263 CB LEU A1526 18.415 4.531 -1.430 1.00 0.00 C ATOM 264 CG LEU A1526 17.168 5.354 -1.768 1.00 0.00 C ATOM 265 CD1 LEU A1526 16.620 6.032 -0.530 1.00 0.00 C ATOM 266 CD2 LEU A1526 17.478 6.379 -2.848 1.00 0.00 C ATOM 0 H LEU A1526 19.996 2.504 -1.106 1.00 0.00 H new ATOM 0 HA LEU A1526 17.858 3.753 0.499 1.00 0.00 H new ATOM 0 HB2 LEU A1526 19.166 5.206 -1.018 1.00 0.00 H new ATOM 0 HB3 LEU A1526 18.821 4.132 -2.360 1.00 0.00 H new ATOM 0 HG LEU A1526 16.406 4.675 -2.149 1.00 0.00 H new ATOM 0 HD11 LEU A1526 15.735 6.611 -0.794 1.00 0.00 H new ATOM 0 HD12 LEU A1526 16.353 5.278 0.210 1.00 0.00 H new ATOM 0 HD13 LEU A1526 17.377 6.696 -0.114 1.00 0.00 H new ATOM 0 HD21 LEU A1526 16.579 6.953 -3.074 1.00 0.00 H new ATOM 0 HD22 LEU A1526 18.260 7.052 -2.497 1.00 0.00 H new ATOM 0 HD23 LEU A1526 17.817 5.867 -3.749 1.00 0.00 H new ATOM 278 N PHE A1527 16.267 2.012 -0.221 1.00 0.00 N ATOM 279 CA PHE A1527 15.256 1.062 -0.626 1.00 0.00 C ATOM 280 C PHE A1527 14.019 1.821 -0.997 1.00 0.00 C ATOM 281 O PHE A1527 13.535 2.638 -0.217 1.00 0.00 O ATOM 282 CB PHE A1527 14.981 0.064 0.497 1.00 0.00 C ATOM 283 CG PHE A1527 16.228 -0.639 0.932 1.00 0.00 C ATOM 284 CD1 PHE A1527 16.787 -1.624 0.143 1.00 0.00 C ATOM 285 CD2 PHE A1527 16.860 -0.291 2.114 1.00 0.00 C ATOM 286 CE1 PHE A1527 17.952 -2.247 0.521 1.00 0.00 C ATOM 287 CE2 PHE A1527 18.023 -0.916 2.500 1.00 0.00 C ATOM 288 CZ PHE A1527 18.569 -1.894 1.701 1.00 0.00 C ATOM 0 H PHE A1527 16.151 2.370 0.727 1.00 0.00 H new ATOM 0 HA PHE A1527 15.600 0.489 -1.487 1.00 0.00 H new ATOM 0 HB2 PHE A1527 14.542 0.586 1.348 1.00 0.00 H new ATOM 0 HB3 PHE A1527 14.249 -0.670 0.160 1.00 0.00 H new ATOM 0 HD1 PHE A1527 16.304 -1.908 -0.780 1.00 0.00 H new ATOM 0 HD2 PHE A1527 16.435 0.480 2.740 1.00 0.00 H new ATOM 0 HE1 PHE A1527 18.384 -3.013 -0.107 1.00 0.00 H new ATOM 0 HE2 PHE A1527 18.505 -0.640 3.426 1.00 0.00 H new ATOM 0 HZ PHE A1527 19.483 -2.386 1.999 1.00 0.00 H new ATOM 298 N ASP A1528 13.517 1.591 -2.173 1.00 0.00 N ATOM 299 CA ASP A1528 12.403 2.371 -2.654 1.00 0.00 C ATOM 300 C ASP A1528 11.280 1.475 -3.105 1.00 0.00 C ATOM 301 O ASP A1528 11.504 0.347 -3.562 1.00 0.00 O ATOM 302 CB ASP A1528 12.832 3.261 -3.842 1.00 0.00 C ATOM 303 CG ASP A1528 12.926 2.499 -5.161 1.00 0.00 C ATOM 304 OD1 ASP A1528 13.945 1.814 -5.413 1.00 0.00 O ATOM 305 OD2 ASP A1528 11.959 2.559 -5.963 1.00 0.00 O1- ATOM 0 H ASP A1528 13.854 0.876 -2.818 1.00 0.00 H new ATOM 0 HA ASP A1528 12.062 2.998 -1.830 1.00 0.00 H new ATOM 0 HB2 ASP A1528 12.119 4.078 -3.952 1.00 0.00 H new ATOM 0 HB3 ASP A1528 13.800 3.711 -3.620 1.00 0.00 H new ATOM 310 N LEU A1529 10.082 1.968 -2.963 1.00 0.00 N ATOM 311 CA LEU A1529 8.911 1.297 -3.485 1.00 0.00 C ATOM 312 C LEU A1529 8.378 2.083 -4.663 1.00 0.00 C ATOM 313 O LEU A1529 7.345 1.749 -5.241 1.00 0.00 O ATOM 314 CB LEU A1529 7.828 1.134 -2.418 1.00 0.00 C ATOM 315 CG LEU A1529 8.149 0.180 -1.266 1.00 0.00 C ATOM 316 CD1 LEU A1529 7.028 0.191 -0.258 1.00 0.00 C ATOM 317 CD2 LEU A1529 8.361 -1.235 -1.781 1.00 0.00 C ATOM 0 H LEU A1529 9.883 2.846 -2.483 1.00 0.00 H new ATOM 0 HA LEU A1529 9.198 0.295 -3.805 1.00 0.00 H new ATOM 0 HB2 LEU A1529 7.611 2.116 -1.998 1.00 0.00 H new ATOM 0 HB3 LEU A1529 6.917 0.787 -2.906 1.00 0.00 H new ATOM 0 HG LEU A1529 9.068 0.518 -0.788 1.00 0.00 H new ATOM 0 HD11 LEU A1529 7.266 -0.491 0.558 1.00 0.00 H new ATOM 0 HD12 LEU A1529 6.903 1.199 0.137 1.00 0.00 H new ATOM 0 HD13 LEU A1529 6.103 -0.127 -0.739 1.00 0.00 H new ATOM 0 HD21 LEU A1529 8.588 -1.896 -0.945 1.00 0.00 H new ATOM 0 HD22 LEU A1529 7.456 -1.580 -2.281 1.00 0.00 H new ATOM 0 HD23 LEU A1529 9.191 -1.245 -2.487 1.00 0.00 H new ATOM 329 N SER A1530 9.123 3.101 -5.046 1.00 0.00 N ATOM 330 CA SER A1530 8.738 3.969 -6.137 1.00 0.00 C ATOM 331 C SER A1530 8.856 3.249 -7.480 1.00 0.00 C ATOM 332 O SER A1530 8.130 3.532 -8.415 1.00 0.00 O ATOM 333 CB SER A1530 9.553 5.264 -6.089 1.00 0.00 C ATOM 334 OG SER A1530 10.925 4.998 -5.806 1.00 0.00 O ATOM 0 H SER A1530 10.011 3.348 -4.609 1.00 0.00 H new ATOM 0 HA SER A1530 7.688 4.239 -6.025 1.00 0.00 H new ATOM 0 HB2 SER A1530 9.470 5.785 -7.043 1.00 0.00 H new ATOM 0 HB3 SER A1530 9.143 5.927 -5.327 1.00 0.00 H new ATOM 0 HG SER A1530 11.171 4.123 -6.172 1.00 0.00 H new ATOM 340 N SER A1531 9.727 2.261 -7.534 1.00 0.00 N ATOM 341 CA SER A1531 9.904 1.456 -8.723 1.00 0.00 C ATOM 342 C SER A1531 8.692 0.520 -8.954 1.00 0.00 C ATOM 343 O SER A1531 8.575 -0.108 -10.003 1.00 0.00 O ATOM 344 CB SER A1531 11.205 0.667 -8.605 1.00 0.00 C ATOM 345 OG SER A1531 12.308 1.560 -8.384 1.00 0.00 O ATOM 0 H SER A1531 10.330 1.995 -6.756 1.00 0.00 H new ATOM 0 HA SER A1531 9.965 2.111 -9.592 1.00 0.00 H new ATOM 0 HB2 SER A1531 11.134 -0.045 -7.783 1.00 0.00 H new ATOM 0 HB3 SER A1531 11.372 0.089 -9.514 1.00 0.00 H new ATOM 0 HG SER A1531 12.229 1.964 -7.495 1.00 0.00 H new ATOM 351 N LEU A1532 7.798 0.460 -7.965 1.00 0.00 N ATOM 352 CA LEU A1532 6.582 -0.332 -8.048 1.00 0.00 C ATOM 353 C LEU A1532 5.385 0.607 -8.135 1.00 0.00 C ATOM 354 O LEU A1532 4.228 0.178 -8.061 1.00 0.00 O ATOM 355 CB LEU A1532 6.420 -1.199 -6.790 1.00 0.00 C ATOM 356 CG LEU A1532 7.545 -2.181 -6.472 1.00 0.00 C ATOM 357 CD1 LEU A1532 7.242 -2.918 -5.179 1.00 0.00 C ATOM 358 CD2 LEU A1532 7.733 -3.168 -7.607 1.00 0.00 C ATOM 0 H LEU A1532 7.903 0.963 -7.084 1.00 0.00 H new ATOM 0 HA LEU A1532 6.640 -0.973 -8.928 1.00 0.00 H new ATOM 0 HB2 LEU A1532 6.299 -0.534 -5.935 1.00 0.00 H new ATOM 0 HB3 LEU A1532 5.494 -1.766 -6.887 1.00 0.00 H new ATOM 0 HG LEU A1532 8.471 -1.619 -6.351 1.00 0.00 H new ATOM 0 HD11 LEU A1532 8.050 -3.616 -4.960 1.00 0.00 H new ATOM 0 HD12 LEU A1532 7.152 -2.200 -4.364 1.00 0.00 H new ATOM 0 HD13 LEU A1532 6.306 -3.467 -5.284 1.00 0.00 H new ATOM 0 HD21 LEU A1532 8.539 -3.858 -7.359 1.00 0.00 H new ATOM 0 HD22 LEU A1532 6.810 -3.728 -7.759 1.00 0.00 H new ATOM 0 HD23 LEU A1532 7.985 -2.629 -8.520 1.00 0.00 H new ATOM 370 N SER A1533 5.664 1.877 -8.296 1.00 0.00 N ATOM 371 CA SER A1533 4.643 2.882 -8.286 1.00 0.00 C ATOM 372 C SER A1533 4.120 3.137 -9.697 1.00 0.00 C ATOM 373 O SER A1533 4.803 2.860 -10.686 1.00 0.00 O ATOM 374 CB SER A1533 5.197 4.170 -7.666 1.00 0.00 C ATOM 375 OG SER A1533 4.177 5.133 -7.440 1.00 0.00 O ATOM 0 H SER A1533 6.607 2.238 -8.437 1.00 0.00 H new ATOM 0 HA SER A1533 3.806 2.532 -7.683 1.00 0.00 H new ATOM 0 HB2 SER A1533 5.690 3.935 -6.722 1.00 0.00 H new ATOM 0 HB3 SER A1533 5.955 4.593 -8.325 1.00 0.00 H new ATOM 0 HG SER A1533 3.584 4.820 -6.725 1.00 0.00 H new ATOM 381 N GLY A1534 2.911 3.620 -9.766 1.00 0.00 N ATOM 382 CA GLY A1534 2.270 3.956 -11.002 1.00 0.00 C ATOM 383 C GLY A1534 0.958 4.597 -10.690 1.00 0.00 C ATOM 384 O GLY A1534 0.333 4.228 -9.693 1.00 0.00 O ATOM 0 H GLY A1534 2.332 3.794 -8.944 1.00 0.00 H new ATOM 0 HA2 GLY A1534 2.896 4.634 -11.582 1.00 0.00 H new ATOM 0 HA3 GLY A1534 2.121 3.062 -11.608 1.00 0.00 H new ATOM 388 N ARG A1535 0.513 5.538 -11.507 1.00 0.00 N ATOM 389 CA ARG A1535 -0.716 6.277 -11.202 1.00 0.00 C ATOM 390 C ARG A1535 -1.944 5.388 -11.297 1.00 0.00 C ATOM 391 O ARG A1535 -2.911 5.609 -10.602 1.00 0.00 O ATOM 392 CB ARG A1535 -0.930 7.480 -12.108 1.00 0.00 C ATOM 393 CG ARG A1535 0.213 8.469 -12.197 1.00 0.00 C ATOM 394 CD ARG A1535 -0.238 9.737 -12.915 1.00 0.00 C ATOM 395 NE ARG A1535 -1.041 9.441 -14.109 1.00 0.00 N ATOM 396 CZ ARG A1535 -1.348 10.296 -15.082 1.00 0.00 C ATOM 397 NH1 ARG A1535 -0.894 11.557 -15.066 1.00 0.00 N1+ ATOM 398 NH2 ARG A1535 -2.140 9.888 -16.061 1.00 0.00 N ATOM 0 H ARG A1535 0.972 5.811 -12.376 1.00 0.00 H new ATOM 0 HA ARG A1535 -0.585 6.630 -10.179 1.00 0.00 H new ATOM 0 HB2 ARG A1535 -1.146 7.117 -13.113 1.00 0.00 H new ATOM 0 HB3 ARG A1535 -1.817 8.013 -11.764 1.00 0.00 H new ATOM 0 HG2 ARG A1535 0.568 8.716 -11.196 1.00 0.00 H new ATOM 0 HG3 ARG A1535 1.051 8.020 -12.730 1.00 0.00 H new ATOM 0 HD2 ARG A1535 -0.821 10.353 -12.230 1.00 0.00 H new ATOM 0 HD3 ARG A1535 0.637 10.321 -13.203 1.00 0.00 H new ATOM 0 HE ARG A1535 -1.397 8.490 -14.201 1.00 0.00 H new ATOM 0 HH11 ARG A1535 -0.302 11.876 -14.299 1.00 0.00 H new ATOM 0 HH12 ARG A1535 -1.140 12.197 -15.821 1.00 0.00 H new ATOM 0 HH21 ARG A1535 -2.503 8.935 -16.060 1.00 0.00 H new ATOM 0 HH22 ARG A1535 -2.388 10.527 -16.816 1.00 0.00 H new ATOM 412 N ALA A1536 -1.907 4.402 -12.173 1.00 0.00 N ATOM 413 CA ALA A1536 -3.038 3.489 -12.324 1.00 0.00 C ATOM 414 C ALA A1536 -2.949 2.361 -11.309 1.00 0.00 C ATOM 415 O ALA A1536 -3.894 1.570 -11.132 1.00 0.00 O ATOM 416 CB ALA A1536 -3.106 2.943 -13.739 1.00 0.00 C ATOM 0 H ALA A1536 -1.117 4.209 -12.788 1.00 0.00 H new ATOM 0 HA ALA A1536 -3.956 4.045 -12.136 1.00 0.00 H new ATOM 0 HB1 ALA A1536 -3.956 2.266 -13.827 1.00 0.00 H new ATOM 0 HB2 ALA A1536 -3.225 3.768 -14.442 1.00 0.00 H new ATOM 0 HB3 ALA A1536 -2.187 2.403 -13.965 1.00 0.00 H new ATOM 422 N GLY A1537 -1.799 2.299 -10.654 1.00 0.00 N ATOM 423 CA GLY A1537 -1.544 1.334 -9.629 1.00 0.00 C ATOM 424 C GLY A1537 -1.636 -0.081 -10.117 1.00 0.00 C ATOM 425 O GLY A1537 -1.130 -0.419 -11.192 1.00 0.00 O ATOM 0 H GLY A1537 -1.017 2.930 -10.831 1.00 0.00 H new ATOM 0 HA2 GLY A1537 -0.550 1.506 -9.216 1.00 0.00 H new ATOM 0 HA3 GLY A1537 -2.256 1.479 -8.817 1.00 0.00 H new ATOM 429 N PHE A1538 -2.259 -0.886 -9.332 1.00 0.00 N ATOM 430 CA PHE A1538 -2.511 -2.253 -9.630 1.00 0.00 C ATOM 431 C PHE A1538 -3.961 -2.514 -9.282 1.00 0.00 C ATOM 432 O PHE A1538 -4.439 -2.080 -8.225 1.00 0.00 O ATOM 433 CB PHE A1538 -1.571 -3.154 -8.801 1.00 0.00 C ATOM 434 CG PHE A1538 -1.714 -4.630 -9.075 1.00 0.00 C ATOM 435 CD1 PHE A1538 -1.133 -5.195 -10.198 1.00 0.00 C ATOM 436 CD2 PHE A1538 -2.417 -5.449 -8.202 1.00 0.00 C ATOM 437 CE1 PHE A1538 -1.254 -6.548 -10.450 1.00 0.00 C ATOM 438 CE2 PHE A1538 -2.541 -6.803 -8.451 1.00 0.00 C ATOM 439 CZ PHE A1538 -1.958 -7.350 -9.576 1.00 0.00 C ATOM 0 H PHE A1538 -2.624 -0.598 -8.424 1.00 0.00 H new ATOM 0 HA PHE A1538 -2.326 -2.474 -10.681 1.00 0.00 H new ATOM 0 HB2 PHE A1538 -0.540 -2.859 -8.998 1.00 0.00 H new ATOM 0 HB3 PHE A1538 -1.757 -2.975 -7.742 1.00 0.00 H new ATOM 0 HD1 PHE A1538 -0.579 -4.571 -10.884 1.00 0.00 H new ATOM 0 HD2 PHE A1538 -2.872 -5.024 -7.319 1.00 0.00 H new ATOM 0 HE1 PHE A1538 -0.798 -6.977 -11.330 1.00 0.00 H new ATOM 0 HE2 PHE A1538 -3.093 -7.431 -7.767 1.00 0.00 H new ATOM 0 HZ PHE A1538 -2.053 -8.408 -9.772 1.00 0.00 H new ATOM 449 N THR A1539 -4.669 -3.152 -10.155 1.00 0.00 N ATOM 450 CA THR A1539 -6.046 -3.430 -9.916 1.00 0.00 C ATOM 451 C THR A1539 -6.224 -4.892 -9.574 1.00 0.00 C ATOM 452 O THR A1539 -6.051 -5.779 -10.426 1.00 0.00 O ATOM 453 CB THR A1539 -6.894 -3.075 -11.129 1.00 0.00 C ATOM 454 OG1 THR A1539 -6.608 -1.718 -11.513 1.00 0.00 O ATOM 455 CG2 THR A1539 -8.376 -3.206 -10.801 1.00 0.00 C ATOM 0 H THR A1539 -4.312 -3.493 -11.048 1.00 0.00 H new ATOM 0 HA THR A1539 -6.377 -2.818 -9.077 1.00 0.00 H new ATOM 0 HB THR A1539 -6.657 -3.758 -11.945 1.00 0.00 H new ATOM 0 HG1 THR A1539 -7.358 -1.141 -11.259 1.00 0.00 H new ATOM 0 HG21 THR A1539 -8.967 -2.948 -11.680 1.00 0.00 H new ATOM 0 HG22 THR A1539 -8.594 -4.232 -10.505 1.00 0.00 H new ATOM 0 HG23 THR A1539 -8.629 -2.531 -9.983 1.00 0.00 H new ATOM 463 N ALA A1540 -6.550 -5.145 -8.349 1.00 0.00 N ATOM 464 CA ALA A1540 -6.724 -6.479 -7.887 1.00 0.00 C ATOM 465 C ALA A1540 -8.197 -6.773 -7.713 1.00 0.00 C ATOM 466 O ALA A1540 -8.838 -6.261 -6.800 1.00 0.00 O ATOM 467 CB ALA A1540 -5.984 -6.662 -6.584 1.00 0.00 C ATOM 0 H ALA A1540 -6.703 -4.428 -7.639 1.00 0.00 H new ATOM 0 HA ALA A1540 -6.318 -7.177 -8.620 1.00 0.00 H new ATOM 0 HB1 ALA A1540 -6.118 -7.684 -6.230 1.00 0.00 H new ATOM 0 HB2 ALA A1540 -4.923 -6.467 -6.738 1.00 0.00 H new ATOM 0 HB3 ALA A1540 -6.377 -5.967 -5.842 1.00 0.00 H new ATOM 473 N ALA A1541 -8.740 -7.556 -8.607 1.00 0.00 N ATOM 474 CA ALA A1541 -10.125 -7.954 -8.518 1.00 0.00 C ATOM 475 C ALA A1541 -10.226 -9.160 -7.606 1.00 0.00 C ATOM 476 O ALA A1541 -9.635 -10.211 -7.893 1.00 0.00 O ATOM 477 CB ALA A1541 -10.676 -8.275 -9.900 1.00 0.00 C ATOM 0 H ALA A1541 -8.242 -7.935 -9.412 1.00 0.00 H new ATOM 0 HA ALA A1541 -10.718 -7.137 -8.107 1.00 0.00 H new ATOM 0 HB1 ALA A1541 -11.721 -8.573 -9.815 1.00 0.00 H new ATOM 0 HB2 ALA A1541 -10.601 -7.393 -10.536 1.00 0.00 H new ATOM 0 HB3 ALA A1541 -10.101 -9.089 -10.341 1.00 0.00 H new ATOM 483 N TYR A1542 -10.912 -9.011 -6.501 1.00 0.00 N ATOM 484 CA TYR A1542 -11.040 -10.089 -5.554 1.00 0.00 C ATOM 485 C TYR A1542 -12.370 -10.782 -5.723 1.00 0.00 C ATOM 486 O TYR A1542 -13.382 -10.152 -6.079 1.00 0.00 O ATOM 487 CB TYR A1542 -10.835 -9.602 -4.114 1.00 0.00 C ATOM 488 CG TYR A1542 -9.450 -9.070 -3.851 1.00 0.00 C ATOM 489 CD1 TYR A1542 -8.379 -9.935 -3.673 1.00 0.00 C ATOM 490 CD2 TYR A1542 -9.211 -7.705 -3.793 1.00 0.00 C ATOM 491 CE1 TYR A1542 -7.107 -9.454 -3.450 1.00 0.00 C ATOM 492 CE2 TYR A1542 -7.942 -7.215 -3.565 1.00 0.00 C ATOM 493 CZ TYR A1542 -6.894 -8.093 -3.396 1.00 0.00 C ATOM 494 OH TYR A1542 -5.623 -7.609 -3.198 1.00 0.00 O ATOM 0 H TYR A1542 -11.392 -8.151 -6.235 1.00 0.00 H new ATOM 0 HA TYR A1542 -10.252 -10.814 -5.757 1.00 0.00 H new ATOM 0 HB2 TYR A1542 -11.563 -8.821 -3.896 1.00 0.00 H new ATOM 0 HB3 TYR A1542 -11.036 -10.425 -3.428 1.00 0.00 H new ATOM 0 HD1 TYR A1542 -8.545 -11.001 -3.710 1.00 0.00 H new ATOM 0 HD2 TYR A1542 -10.031 -7.015 -3.928 1.00 0.00 H new ATOM 0 HE1 TYR A1542 -6.282 -10.139 -3.318 1.00 0.00 H new ATOM 0 HE2 TYR A1542 -7.771 -6.150 -3.519 1.00 0.00 H new ATOM 0 HH TYR A1542 -4.987 -8.355 -3.187 1.00 0.00 H new ATOM 567 N GLY A1547 -13.303 -5.261 -6.406 1.00 0.00 N ATOM 568 CA GLY A1547 -11.951 -5.136 -6.852 1.00 0.00 C ATOM 569 C GLY A1547 -11.348 -3.885 -6.274 1.00 0.00 C ATOM 570 O GLY A1547 -12.060 -2.911 -6.042 1.00 0.00 O ATOM 0 HA2 GLY A1547 -11.373 -6.007 -6.544 1.00 0.00 H new ATOM 0 HA3 GLY A1547 -11.918 -5.100 -7.941 1.00 0.00 H new ATOM 574 N VAL A1548 -10.079 -3.903 -6.012 1.00 0.00 N ATOM 575 CA VAL A1548 -9.426 -2.767 -5.411 1.00 0.00 C ATOM 576 C VAL A1548 -8.436 -2.157 -6.385 1.00 0.00 C ATOM 577 O VAL A1548 -7.552 -2.853 -6.911 1.00 0.00 O ATOM 578 CB VAL A1548 -8.683 -3.159 -4.096 1.00 0.00 C ATOM 579 CG1 VAL A1548 -8.060 -1.936 -3.423 1.00 0.00 C ATOM 580 CG2 VAL A1548 -9.622 -3.870 -3.135 1.00 0.00 C ATOM 0 H VAL A1548 -9.465 -4.695 -6.204 1.00 0.00 H new ATOM 0 HA VAL A1548 -10.198 -2.039 -5.164 1.00 0.00 H new ATOM 0 HB VAL A1548 -7.878 -3.843 -4.365 1.00 0.00 H new ATOM 0 HG11 VAL A1548 -7.550 -2.243 -2.510 1.00 0.00 H new ATOM 0 HG12 VAL A1548 -7.343 -1.473 -4.101 1.00 0.00 H new ATOM 0 HG13 VAL A1548 -8.842 -1.218 -3.177 1.00 0.00 H new ATOM 0 HG21 VAL A1548 -9.081 -4.133 -2.226 1.00 0.00 H new ATOM 0 HG22 VAL A1548 -10.454 -3.211 -2.885 1.00 0.00 H new ATOM 0 HG23 VAL A1548 -10.005 -4.776 -3.604 1.00 0.00 H new ATOM 590 N TYR A1549 -8.606 -0.890 -6.650 1.00 0.00 N ATOM 591 CA TYR A1549 -7.679 -0.151 -7.465 1.00 0.00 C ATOM 592 C TYR A1549 -6.710 0.496 -6.509 1.00 0.00 C ATOM 593 O TYR A1549 -7.045 1.477 -5.849 1.00 0.00 O ATOM 594 CB TYR A1549 -8.397 0.937 -8.279 1.00 0.00 C ATOM 595 CG TYR A1549 -9.386 0.440 -9.315 1.00 0.00 C ATOM 596 CD1 TYR A1549 -10.636 -0.040 -8.946 1.00 0.00 C ATOM 597 CD2 TYR A1549 -9.072 0.471 -10.664 1.00 0.00 C ATOM 598 CE1 TYR A1549 -11.541 -0.477 -9.892 1.00 0.00 C ATOM 599 CE2 TYR A1549 -9.972 0.040 -11.616 1.00 0.00 C ATOM 600 CZ TYR A1549 -11.203 -0.434 -11.224 1.00 0.00 C ATOM 601 OH TYR A1549 -12.110 -0.858 -12.176 1.00 0.00 O ATOM 0 H TYR A1549 -9.393 -0.339 -6.306 1.00 0.00 H new ATOM 0 HA TYR A1549 -7.183 -0.812 -8.176 1.00 0.00 H new ATOM 0 HB2 TYR A1549 -8.924 1.594 -7.587 1.00 0.00 H new ATOM 0 HB3 TYR A1549 -7.645 1.543 -8.784 1.00 0.00 H new ATOM 0 HD1 TYR A1549 -10.905 -0.072 -7.900 1.00 0.00 H new ATOM 0 HD2 TYR A1549 -8.106 0.839 -10.976 1.00 0.00 H new ATOM 0 HE1 TYR A1549 -12.508 -0.850 -9.588 1.00 0.00 H new ATOM 0 HE2 TYR A1549 -9.712 0.074 -12.664 1.00 0.00 H new ATOM 0 HH TYR A1549 -11.717 -0.762 -13.068 1.00 0.00 H new ATOM 611 N MET A1550 -5.535 -0.036 -6.421 1.00 0.00 N ATOM 612 CA MET A1550 -4.584 0.430 -5.444 1.00 0.00 C ATOM 613 C MET A1550 -3.299 0.878 -6.091 1.00 0.00 C ATOM 614 O MET A1550 -2.722 0.168 -6.894 1.00 0.00 O ATOM 615 CB MET A1550 -4.336 -0.659 -4.376 1.00 0.00 C ATOM 616 CG MET A1550 -3.890 -2.012 -4.935 1.00 0.00 C ATOM 617 SD MET A1550 -3.776 -3.302 -3.678 1.00 0.00 S ATOM 618 CE MET A1550 -2.523 -2.626 -2.597 1.00 0.00 C ATOM 0 H MET A1550 -5.202 -0.797 -7.013 1.00 0.00 H new ATOM 0 HA MET A1550 -5.006 1.303 -4.947 1.00 0.00 H new ATOM 0 HB2 MET A1550 -3.577 -0.301 -3.680 1.00 0.00 H new ATOM 0 HB3 MET A1550 -5.252 -0.802 -3.803 1.00 0.00 H new ATOM 0 HG2 MET A1550 -4.592 -2.328 -5.707 1.00 0.00 H new ATOM 0 HG3 MET A1550 -2.919 -1.896 -5.416 1.00 0.00 H new ATOM 0 HE1 MET A1550 -2.166 -3.404 -1.922 1.00 0.00 H new ATOM 0 HE2 MET A1550 -1.690 -2.253 -3.194 1.00 0.00 H new ATOM 0 HE3 MET A1550 -2.947 -1.808 -2.015 1.00 0.00 H new ATOM 628 N SER A1551 -2.880 2.061 -5.771 1.00 0.00 N ATOM 629 CA SER A1551 -1.657 2.593 -6.280 1.00 0.00 C ATOM 630 C SER A1551 -0.621 2.476 -5.191 1.00 0.00 C ATOM 631 O SER A1551 -0.909 2.773 -4.034 1.00 0.00 O ATOM 632 CB SER A1551 -1.854 4.067 -6.701 1.00 0.00 C ATOM 633 OG SER A1551 -0.675 4.631 -7.260 1.00 0.00 O ATOM 0 H SER A1551 -3.382 2.690 -5.144 1.00 0.00 H new ATOM 0 HA SER A1551 -1.332 2.042 -7.163 1.00 0.00 H new ATOM 0 HB2 SER A1551 -2.664 4.130 -7.428 1.00 0.00 H new ATOM 0 HB3 SER A1551 -2.158 4.653 -5.834 1.00 0.00 H new ATOM 0 HG SER A1551 -0.638 4.429 -8.218 1.00 0.00 H new ATOM 639 N ILE A1552 0.539 1.986 -5.527 1.00 0.00 N ATOM 640 CA ILE A1552 1.607 1.892 -4.575 1.00 0.00 C ATOM 641 C ILE A1552 2.361 3.206 -4.606 1.00 0.00 C ATOM 642 O ILE A1552 2.977 3.536 -5.618 1.00 0.00 O ATOM 643 CB ILE A1552 2.593 0.679 -4.847 1.00 0.00 C ATOM 644 CG1 ILE A1552 1.906 -0.703 -4.651 1.00 0.00 C ATOM 645 CG2 ILE A1552 3.835 0.763 -3.956 1.00 0.00 C ATOM 646 CD1 ILE A1552 0.851 -1.072 -5.684 1.00 0.00 C ATOM 0 H ILE A1552 0.769 1.644 -6.460 1.00 0.00 H new ATOM 0 HA ILE A1552 1.177 1.699 -3.592 1.00 0.00 H new ATOM 0 HB ILE A1552 2.892 0.761 -5.892 1.00 0.00 H new ATOM 0 HG12 ILE A1552 2.676 -1.474 -4.655 1.00 0.00 H new ATOM 0 HG13 ILE A1552 1.443 -0.720 -3.664 1.00 0.00 H new ATOM 0 HG21 ILE A1552 4.491 -0.082 -4.166 1.00 0.00 H new ATOM 0 HG22 ILE A1552 4.366 1.693 -4.158 1.00 0.00 H new ATOM 0 HG23 ILE A1552 3.534 0.737 -2.909 1.00 0.00 H new ATOM 0 HD11 ILE A1552 0.440 -2.054 -5.449 1.00 0.00 H new ATOM 0 HD12 ILE A1552 0.052 -0.331 -5.669 1.00 0.00 H new ATOM 0 HD13 ILE A1552 1.305 -1.096 -6.675 1.00 0.00 H new ATOM 658 N CYS A1553 2.228 3.972 -3.532 1.00 0.00 N ATOM 659 CA CYS A1553 2.877 5.265 -3.355 1.00 0.00 C ATOM 660 C CYS A1553 2.243 6.328 -4.244 1.00 0.00 C ATOM 661 O CYS A1553 2.580 6.452 -5.430 1.00 0.00 O ATOM 662 CB CYS A1553 4.383 5.195 -3.621 1.00 0.00 C ATOM 663 SG CYS A1553 5.262 6.694 -3.134 1.00 0.00 S ATOM 0 H CYS A1553 1.649 3.704 -2.736 1.00 0.00 H new ATOM 0 HA CYS A1553 2.732 5.544 -2.312 1.00 0.00 H new ATOM 0 HB2 CYS A1553 4.801 4.345 -3.082 1.00 0.00 H new ATOM 0 HB3 CYS A1553 4.550 5.013 -4.683 1.00 0.00 H new ATOM 668 N GLY A1554 1.311 7.064 -3.696 1.00 0.00 N ATOM 669 CA GLY A1554 0.696 8.123 -4.435 1.00 0.00 C ATOM 670 C GLY A1554 -0.779 7.912 -4.565 1.00 0.00 C ATOM 671 O GLY A1554 -1.352 7.078 -3.854 1.00 0.00 O ATOM 0 H GLY A1554 0.966 6.946 -2.743 1.00 0.00 H new ATOM 0 HA2 GLY A1554 0.887 9.074 -3.938 1.00 0.00 H new ATOM 0 HA3 GLY A1554 1.145 8.186 -5.426 1.00 0.00 H new ATOM 675 N GLU A1555 -1.403 8.656 -5.442 1.00 0.00 N ATOM 676 CA GLU A1555 -2.823 8.552 -5.642 1.00 0.00 C ATOM 677 C GLU A1555 -3.118 7.876 -6.962 1.00 0.00 C ATOM 678 O GLU A1555 -2.384 8.054 -7.946 1.00 0.00 O ATOM 679 CB GLU A1555 -3.508 9.919 -5.558 1.00 0.00 C ATOM 680 CG GLU A1555 -3.009 10.957 -6.535 1.00 0.00 C ATOM 681 CD GLU A1555 -3.816 12.207 -6.444 1.00 0.00 C ATOM 682 OE1 GLU A1555 -4.939 12.226 -6.972 1.00 0.00 O1- ATOM 683 OE2 GLU A1555 -3.368 13.185 -5.815 1.00 0.00 O ATOM 0 H GLU A1555 -0.943 9.347 -6.034 1.00 0.00 H new ATOM 0 HA GLU A1555 -3.231 7.939 -4.839 1.00 0.00 H new ATOM 0 HB2 GLU A1555 -4.577 9.780 -5.717 1.00 0.00 H new ATOM 0 HB3 GLU A1555 -3.383 10.307 -4.547 1.00 0.00 H new ATOM 0 HG2 GLU A1555 -1.962 11.180 -6.331 1.00 0.00 H new ATOM 0 HG3 GLU A1555 -3.059 10.561 -7.549 1.00 0.00 H new ATOM 690 N ASN A1556 -4.172 7.117 -6.988 1.00 0.00 N ATOM 691 CA ASN A1556 -4.534 6.368 -8.164 1.00 0.00 C ATOM 692 C ASN A1556 -5.423 7.231 -9.045 1.00 0.00 C ATOM 693 O ASN A1556 -6.376 7.855 -8.563 1.00 0.00 O ATOM 694 CB ASN A1556 -5.249 5.055 -7.769 1.00 0.00 C ATOM 695 CG ASN A1556 -5.426 4.068 -8.931 1.00 0.00 C ATOM 696 OD1 ASN A1556 -5.571 4.448 -10.079 1.00 0.00 O ATOM 697 ND2 ASN A1556 -5.416 2.797 -8.632 1.00 0.00 N ATOM 0 H ASN A1556 -4.807 6.996 -6.199 1.00 0.00 H new ATOM 0 HA ASN A1556 -3.636 6.099 -8.720 1.00 0.00 H new ATOM 0 HB2 ASN A1556 -4.682 4.569 -6.976 1.00 0.00 H new ATOM 0 HB3 ASN A1556 -6.229 5.296 -7.358 1.00 0.00 H new ATOM 0 HD21 ASN A1556 -5.531 2.099 -9.367 1.00 0.00 H new ATOM 0 HD22 ASN A1556 -5.293 2.502 -7.663 1.00 0.00 H new ATOM 704 N GLU A1557 -5.105 7.262 -10.331 1.00 0.00 N ATOM 705 CA GLU A1557 -5.825 8.067 -11.308 1.00 0.00 C ATOM 706 C GLU A1557 -7.190 7.466 -11.617 1.00 0.00 C ATOM 707 O GLU A1557 -8.048 8.112 -12.204 1.00 0.00 O ATOM 708 CB GLU A1557 -5.010 8.245 -12.601 1.00 0.00 C ATOM 709 CG GLU A1557 -4.643 6.948 -13.319 1.00 0.00 C ATOM 710 CD GLU A1557 -3.994 7.192 -14.664 1.00 0.00 C ATOM 711 OE1 GLU A1557 -2.760 7.367 -14.736 1.00 0.00 O ATOM 712 OE2 GLU A1557 -4.716 7.215 -15.687 1.00 0.00 O1- ATOM 0 H GLU A1557 -4.334 6.725 -10.729 1.00 0.00 H new ATOM 0 HA GLU A1557 -5.976 9.052 -10.867 1.00 0.00 H new ATOM 0 HB2 GLU A1557 -5.578 8.873 -13.287 1.00 0.00 H new ATOM 0 HB3 GLU A1557 -4.092 8.782 -12.363 1.00 0.00 H new ATOM 0 HG2 GLU A1557 -3.965 6.369 -12.692 1.00 0.00 H new ATOM 0 HG3 GLU A1557 -5.541 6.346 -13.457 1.00 0.00 H new ATOM 719 N ASN A1558 -7.374 6.234 -11.217 1.00 0.00 N ATOM 720 CA ASN A1558 -8.628 5.527 -11.407 1.00 0.00 C ATOM 721 C ASN A1558 -9.507 5.705 -10.184 1.00 0.00 C ATOM 722 O ASN A1558 -10.642 5.224 -10.132 1.00 0.00 O ATOM 723 CB ASN A1558 -8.367 4.036 -11.656 1.00 0.00 C ATOM 724 CG ASN A1558 -7.566 3.756 -12.926 1.00 0.00 C ATOM 725 OD1 ASN A1558 -7.758 4.549 -13.963 1.00 0.00 O flip ATOM 726 ND2 ASN A1558 -6.794 2.804 -12.981 1.00 0.00 N flip ATOM 0 H ASN A1558 -6.656 5.683 -10.746 1.00 0.00 H new ATOM 0 HA ASN A1558 -9.138 5.940 -12.277 1.00 0.00 H new ATOM 0 HB2 ASN A1558 -7.832 3.622 -10.801 1.00 0.00 H new ATOM 0 HB3 ASN A1558 -9.322 3.514 -11.717 1.00 0.00 H new ATOM 0 HD21 ASN A1558 -6.663 2.206 -12.165 1.00 0.00 H new ATOM 0 HD22 ASN A1558 -6.283 2.611 -13.842 1.00 0.00 H new ATOM 733 N CYS A1559 -8.985 6.410 -9.221 1.00 0.00 N ATOM 734 CA CYS A1559 -9.671 6.682 -7.990 1.00 0.00 C ATOM 735 C CYS A1559 -9.821 8.196 -7.851 1.00 0.00 C ATOM 736 O CYS A1559 -9.186 8.932 -8.610 1.00 0.00 O ATOM 737 CB CYS A1559 -8.867 6.114 -6.808 1.00 0.00 C ATOM 738 SG CYS A1559 -8.560 4.313 -6.879 1.00 0.00 S ATOM 0 H CYS A1559 -8.052 6.820 -9.271 1.00 0.00 H new ATOM 0 HA CYS A1559 -10.654 6.211 -7.992 1.00 0.00 H new ATOM 0 HB2 CYS A1559 -7.908 6.629 -6.759 1.00 0.00 H new ATOM 0 HB3 CYS A1559 -9.398 6.341 -5.884 1.00 0.00 H new ATOM 743 N PRO A1560 -10.692 8.692 -6.940 1.00 0.00 N ATOM 744 CA PRO A1560 -10.838 10.144 -6.686 1.00 0.00 C ATOM 745 C PRO A1560 -9.486 10.810 -6.321 1.00 0.00 C ATOM 746 O PRO A1560 -8.554 10.144 -5.831 1.00 0.00 O ATOM 747 CB PRO A1560 -11.785 10.186 -5.480 1.00 0.00 C ATOM 748 CG PRO A1560 -12.565 8.928 -5.564 1.00 0.00 C ATOM 749 CD PRO A1560 -11.637 7.901 -6.126 1.00 0.00 C ATOM 0 HA PRO A1560 -11.201 10.683 -7.561 1.00 0.00 H new ATOM 0 HB2 PRO A1560 -11.230 10.245 -4.544 1.00 0.00 H new ATOM 0 HB3 PRO A1560 -12.437 11.059 -5.520 1.00 0.00 H new ATOM 0 HG2 PRO A1560 -12.928 8.628 -4.581 1.00 0.00 H new ATOM 0 HG3 PRO A1560 -13.440 9.054 -6.202 1.00 0.00 H new ATOM 0 HD2 PRO A1560 -11.123 7.351 -5.337 1.00 0.00 H new ATOM 0 HD3 PRO A1560 -12.170 7.168 -6.731 1.00 0.00 H new ATOM 757 N PRO A1561 -9.360 12.127 -6.583 1.00 0.00 N ATOM 758 CA PRO A1561 -8.136 12.892 -6.307 1.00 0.00 C ATOM 759 C PRO A1561 -7.705 12.803 -4.843 1.00 0.00 C ATOM 760 O PRO A1561 -8.486 13.106 -3.917 1.00 0.00 O ATOM 761 CB PRO A1561 -8.512 14.340 -6.672 1.00 0.00 C ATOM 762 CG PRO A1561 -10.000 14.348 -6.744 1.00 0.00 C ATOM 763 CD PRO A1561 -10.395 12.980 -7.190 1.00 0.00 C ATOM 0 HA PRO A1561 -7.289 12.507 -6.875 1.00 0.00 H new ATOM 0 HB2 PRO A1561 -8.150 15.043 -5.921 1.00 0.00 H new ATOM 0 HB3 PRO A1561 -8.070 14.634 -7.624 1.00 0.00 H new ATOM 0 HG2 PRO A1561 -10.437 14.584 -5.774 1.00 0.00 H new ATOM 0 HG3 PRO A1561 -10.353 15.105 -7.445 1.00 0.00 H new ATOM 0 HD2 PRO A1561 -11.393 12.714 -6.843 1.00 0.00 H new ATOM 0 HD3 PRO A1561 -10.403 12.895 -8.277 1.00 0.00 H new ATOM 771 N GLY A1562 -6.484 12.359 -4.642 1.00 0.00 N ATOM 772 CA GLY A1562 -5.926 12.228 -3.316 1.00 0.00 C ATOM 773 C GLY A1562 -6.076 10.832 -2.746 1.00 0.00 C ATOM 774 O GLY A1562 -5.528 10.524 -1.690 1.00 0.00 O ATOM 0 H GLY A1562 -5.852 12.079 -5.392 1.00 0.00 H new ATOM 0 HA2 GLY A1562 -4.869 12.491 -3.345 1.00 0.00 H new ATOM 0 HA3 GLY A1562 -6.413 12.941 -2.651 1.00 0.00 H new ATOM 778 N VAL A1563 -6.821 9.999 -3.425 1.00 0.00 N ATOM 779 CA VAL A1563 -7.067 8.641 -2.980 1.00 0.00 C ATOM 780 C VAL A1563 -5.999 7.677 -3.508 1.00 0.00 C ATOM 781 O VAL A1563 -5.771 7.583 -4.715 1.00 0.00 O ATOM 782 CB VAL A1563 -8.472 8.176 -3.412 1.00 0.00 C ATOM 783 CG1 VAL A1563 -8.738 6.755 -2.975 1.00 0.00 C ATOM 784 CG2 VAL A1563 -9.521 9.109 -2.841 1.00 0.00 C ATOM 0 H VAL A1563 -7.278 10.238 -4.305 1.00 0.00 H new ATOM 0 HA VAL A1563 -7.015 8.634 -1.891 1.00 0.00 H new ATOM 0 HB VAL A1563 -8.522 8.203 -4.501 1.00 0.00 H new ATOM 0 HG11 VAL A1563 -9.737 6.457 -3.295 1.00 0.00 H new ATOM 0 HG12 VAL A1563 -8.000 6.092 -3.425 1.00 0.00 H new ATOM 0 HG13 VAL A1563 -8.670 6.690 -1.889 1.00 0.00 H new ATOM 0 HG21 VAL A1563 -10.512 8.775 -3.150 1.00 0.00 H new ATOM 0 HG22 VAL A1563 -9.459 9.104 -1.753 1.00 0.00 H new ATOM 0 HG23 VAL A1563 -9.348 10.120 -3.209 1.00 0.00 H new ATOM 794 N GLY A1564 -5.372 6.956 -2.595 1.00 0.00 N ATOM 795 CA GLY A1564 -4.322 6.021 -2.954 1.00 0.00 C ATOM 796 C GLY A1564 -4.875 4.691 -3.404 1.00 0.00 C ATOM 797 O GLY A1564 -4.294 4.017 -4.262 1.00 0.00 O ATOM 0 H GLY A1564 -5.573 7.001 -1.596 1.00 0.00 H new ATOM 0 HA2 GLY A1564 -3.714 6.448 -3.751 1.00 0.00 H new ATOM 0 HA3 GLY A1564 -3.665 5.869 -2.098 1.00 0.00 H new ATOM 801 N ALA A1565 -5.994 4.310 -2.834 1.00 0.00 N ATOM 802 CA ALA A1565 -6.629 3.062 -3.167 1.00 0.00 C ATOM 803 C ALA A1565 -8.130 3.198 -3.032 1.00 0.00 C ATOM 804 O ALA A1565 -8.625 3.777 -2.054 1.00 0.00 O ATOM 805 CB ALA A1565 -6.111 1.947 -2.265 1.00 0.00 C ATOM 0 H ALA A1565 -6.487 4.857 -2.128 1.00 0.00 H new ATOM 0 HA ALA A1565 -6.390 2.807 -4.199 1.00 0.00 H new ATOM 0 HB1 ALA A1565 -6.600 1.009 -2.528 1.00 0.00 H new ATOM 0 HB2 ALA A1565 -5.034 1.844 -2.396 1.00 0.00 H new ATOM 0 HB3 ALA A1565 -6.328 2.190 -1.225 1.00 0.00 H new ATOM 811 N CYS A1566 -8.854 2.720 -3.996 1.00 0.00 N ATOM 812 CA CYS A1566 -10.285 2.763 -3.930 1.00 0.00 C ATOM 813 C CYS A1566 -10.871 1.362 -4.027 1.00 0.00 C ATOM 814 O CYS A1566 -10.462 0.548 -4.871 1.00 0.00 O ATOM 815 CB CYS A1566 -10.879 3.742 -4.961 1.00 0.00 C ATOM 816 SG CYS A1566 -10.397 3.452 -6.697 1.00 0.00 S ATOM 0 H CYS A1566 -8.477 2.293 -4.842 1.00 0.00 H new ATOM 0 HA CYS A1566 -10.570 3.158 -2.955 1.00 0.00 H new ATOM 0 HB2 CYS A1566 -11.966 3.697 -4.893 1.00 0.00 H new ATOM 0 HB3 CYS A1566 -10.584 4.754 -4.685 1.00 0.00 H new ATOM 821 N PHE A1567 -11.799 1.091 -3.150 1.00 0.00 N ATOM 822 CA PHE A1567 -12.414 -0.196 -2.999 1.00 0.00 C ATOM 823 C PHE A1567 -13.711 -0.246 -3.791 1.00 0.00 C ATOM 824 O PHE A1567 -14.588 0.630 -3.637 1.00 0.00 O ATOM 825 CB PHE A1567 -12.685 -0.429 -1.495 1.00 0.00 C ATOM 826 CG PHE A1567 -13.262 -1.773 -1.123 1.00 0.00 C ATOM 827 CD1 PHE A1567 -12.437 -2.875 -0.989 1.00 0.00 C ATOM 828 CD2 PHE A1567 -14.623 -1.929 -0.884 1.00 0.00 C ATOM 829 CE1 PHE A1567 -12.950 -4.107 -0.632 1.00 0.00 C ATOM 830 CE2 PHE A1567 -15.139 -3.161 -0.523 1.00 0.00 C ATOM 831 CZ PHE A1567 -14.299 -4.249 -0.399 1.00 0.00 C ATOM 0 H PHE A1567 -12.160 1.787 -2.498 1.00 0.00 H new ATOM 0 HA PHE A1567 -11.757 -0.978 -3.379 1.00 0.00 H new ATOM 0 HB2 PHE A1567 -11.748 -0.296 -0.953 1.00 0.00 H new ATOM 0 HB3 PHE A1567 -13.368 0.346 -1.146 1.00 0.00 H new ATOM 0 HD1 PHE A1567 -11.377 -2.771 -1.166 1.00 0.00 H new ATOM 0 HD2 PHE A1567 -15.284 -1.080 -0.981 1.00 0.00 H new ATOM 0 HE1 PHE A1567 -12.293 -4.958 -0.536 1.00 0.00 H new ATOM 0 HE2 PHE A1567 -16.197 -3.271 -0.339 1.00 0.00 H new ATOM 0 HZ PHE A1567 -14.700 -5.212 -0.119 1.00 0.00 H new ATOM 841 N GLY A1568 -13.803 -1.217 -4.671 1.00 0.00 N ATOM 842 CA GLY A1568 -15.003 -1.439 -5.418 1.00 0.00 C ATOM 843 C GLY A1568 -15.143 -0.498 -6.587 1.00 0.00 C ATOM 844 O GLY A1568 -14.393 0.474 -6.718 1.00 0.00 O ATOM 0 H GLY A1568 -13.047 -1.868 -4.883 1.00 0.00 H new ATOM 0 HA2 GLY A1568 -15.015 -2.467 -5.781 1.00 0.00 H new ATOM 0 HA3 GLY A1568 -15.863 -1.323 -4.759 1.00 0.00 H new ATOM 848 N GLN A1569 -16.124 -0.752 -7.416 1.00 0.00 N ATOM 849 CA GLN A1569 -16.386 0.068 -8.582 1.00 0.00 C ATOM 850 C GLN A1569 -17.225 1.293 -8.199 1.00 0.00 C ATOM 851 O GLN A1569 -17.569 2.122 -9.045 1.00 0.00 O ATOM 852 CB GLN A1569 -17.070 -0.745 -9.678 1.00 0.00 C ATOM 853 CG GLN A1569 -16.255 -1.938 -10.151 1.00 0.00 C ATOM 854 CD GLN A1569 -16.932 -2.720 -11.258 1.00 0.00 C ATOM 855 OE1 GLN A1569 -16.735 -2.448 -12.443 1.00 0.00 O ATOM 856 NE2 GLN A1569 -17.734 -3.684 -10.898 1.00 0.00 N ATOM 0 H GLN A1569 -16.768 -1.535 -7.305 1.00 0.00 H new ATOM 0 HA GLN A1569 -15.432 0.419 -8.976 1.00 0.00 H new ATOM 0 HB2 GLN A1569 -18.033 -1.097 -9.310 1.00 0.00 H new ATOM 0 HB3 GLN A1569 -17.273 -0.094 -10.529 1.00 0.00 H new ATOM 0 HG2 GLN A1569 -15.283 -1.590 -10.502 1.00 0.00 H new ATOM 0 HG3 GLN A1569 -16.070 -2.602 -9.306 1.00 0.00 H new ATOM 0 HE21 GLN A1569 -17.877 -3.886 -9.908 1.00 0.00 H new ATOM 0 HE22 GLN A1569 -18.218 -4.236 -11.606 1.00 0.00 H new ATOM 865 N THR A1570 -17.564 1.391 -6.921 1.00 0.00 N ATOM 866 CA THR A1570 -18.236 2.558 -6.389 1.00 0.00 C ATOM 867 C THR A1570 -17.173 3.643 -6.041 1.00 0.00 C ATOM 868 O THR A1570 -17.489 4.770 -5.651 1.00 0.00 O ATOM 869 CB THR A1570 -19.069 2.171 -5.130 1.00 0.00 C ATOM 870 OG1 THR A1570 -19.903 1.056 -5.451 1.00 0.00 O ATOM 871 CG2 THR A1570 -19.969 3.311 -4.673 1.00 0.00 C ATOM 0 H THR A1570 -17.380 0.664 -6.230 1.00 0.00 H new ATOM 0 HA THR A1570 -18.923 2.960 -7.134 1.00 0.00 H new ATOM 0 HB THR A1570 -18.369 1.934 -4.329 1.00 0.00 H new ATOM 0 HG1 THR A1570 -20.430 0.804 -4.664 1.00 0.00 H new ATOM 0 HG21 THR A1570 -20.532 3.000 -3.793 1.00 0.00 H new ATOM 0 HG22 THR A1570 -19.359 4.179 -4.425 1.00 0.00 H new ATOM 0 HG23 THR A1570 -20.661 3.571 -5.474 1.00 0.00 H new ATOM 879 N ARG A1571 -15.888 3.258 -6.218 1.00 0.00 N ATOM 880 CA ARG A1571 -14.728 4.127 -5.996 1.00 0.00 C ATOM 881 C ARG A1571 -14.652 4.620 -4.566 1.00 0.00 C ATOM 882 O ARG A1571 -14.284 5.772 -4.314 1.00 0.00 O ATOM 883 CB ARG A1571 -14.683 5.309 -6.991 1.00 0.00 C ATOM 884 CG ARG A1571 -14.426 4.901 -8.431 1.00 0.00 C ATOM 885 CD ARG A1571 -14.401 6.097 -9.365 1.00 0.00 C ATOM 886 NE ARG A1571 -15.688 6.787 -9.400 1.00 0.00 N ATOM 887 CZ ARG A1571 -15.950 7.909 -10.071 1.00 0.00 C ATOM 888 NH1 ARG A1571 -14.999 8.520 -10.770 1.00 0.00 N1+ ATOM 889 NH2 ARG A1571 -17.168 8.418 -10.036 1.00 0.00 N ATOM 0 H ARG A1571 -15.633 2.319 -6.524 1.00 0.00 H new ATOM 0 HA ARG A1571 -13.848 3.512 -6.180 1.00 0.00 H new ATOM 0 HB2 ARG A1571 -15.629 5.848 -6.941 1.00 0.00 H new ATOM 0 HB3 ARG A1571 -13.904 6.004 -6.677 1.00 0.00 H new ATOM 0 HG2 ARG A1571 -13.475 4.372 -8.494 1.00 0.00 H new ATOM 0 HG3 ARG A1571 -15.200 4.205 -8.754 1.00 0.00 H new ATOM 0 HD2 ARG A1571 -13.625 6.792 -9.044 1.00 0.00 H new ATOM 0 HD3 ARG A1571 -14.138 5.767 -10.370 1.00 0.00 H new ATOM 0 HE ARG A1571 -16.452 6.375 -8.865 1.00 0.00 H new ATOM 0 HH11 ARG A1571 -14.056 8.131 -10.797 1.00 0.00 H new ATOM 0 HH12 ARG A1571 -15.212 9.378 -11.279 1.00 0.00 H new ATOM 0 HH21 ARG A1571 -17.900 7.953 -9.499 1.00 0.00 H new ATOM 0 HH22 ARG A1571 -17.377 9.276 -10.546 1.00 0.00 H new ATOM 903 N ILE A1572 -14.977 3.742 -3.636 1.00 0.00 N ATOM 904 CA ILE A1572 -14.954 4.080 -2.230 1.00 0.00 C ATOM 905 C ILE A1572 -13.511 4.206 -1.783 1.00 0.00 C ATOM 906 O ILE A1572 -12.748 3.245 -1.853 1.00 0.00 O ATOM 907 CB ILE A1572 -15.712 3.010 -1.382 1.00 0.00 C ATOM 908 CG1 ILE A1572 -17.195 2.984 -1.792 1.00 0.00 C ATOM 909 CG2 ILE A1572 -15.564 3.278 0.120 1.00 0.00 C ATOM 910 CD1 ILE A1572 -18.030 1.934 -1.088 1.00 0.00 C ATOM 0 H ILE A1572 -15.262 2.783 -3.834 1.00 0.00 H new ATOM 0 HA ILE A1572 -15.466 5.030 -2.077 1.00 0.00 H new ATOM 0 HB ILE A1572 -15.270 2.033 -1.579 1.00 0.00 H new ATOM 0 HG12 ILE A1572 -17.629 3.965 -1.596 1.00 0.00 H new ATOM 0 HG13 ILE A1572 -17.257 2.817 -2.867 1.00 0.00 H new ATOM 0 HG21 ILE A1572 -16.104 2.515 0.681 1.00 0.00 H new ATOM 0 HG22 ILE A1572 -14.509 3.250 0.392 1.00 0.00 H new ATOM 0 HG23 ILE A1572 -15.974 4.260 0.357 1.00 0.00 H new ATOM 0 HD11 ILE A1572 -19.060 1.991 -1.441 1.00 0.00 H new ATOM 0 HD12 ILE A1572 -17.627 0.944 -1.303 1.00 0.00 H new ATOM 0 HD13 ILE A1572 -18.005 2.110 -0.013 1.00 0.00 H new ATOM 922 N SER A1573 -13.128 5.394 -1.405 1.00 0.00 N ATOM 923 CA SER A1573 -11.785 5.664 -0.989 1.00 0.00 C ATOM 924 C SER A1573 -11.419 4.884 0.261 1.00 0.00 C ATOM 925 O SER A1573 -11.977 5.102 1.334 1.00 0.00 O ATOM 926 CB SER A1573 -11.588 7.164 -0.802 1.00 0.00 C ATOM 927 OG SER A1573 -12.569 7.743 0.048 1.00 0.00 O ATOM 0 H SER A1573 -13.745 6.206 -1.378 1.00 0.00 H new ATOM 0 HA SER A1573 -11.106 5.327 -1.773 1.00 0.00 H new ATOM 0 HB2 SER A1573 -10.598 7.347 -0.385 1.00 0.00 H new ATOM 0 HB3 SER A1573 -11.620 7.655 -1.775 1.00 0.00 H new ATOM 0 HG SER A1573 -13.249 7.072 0.267 1.00 0.00 H new ATOM 933 N VAL A1574 -10.491 3.981 0.119 1.00 0.00 N ATOM 934 CA VAL A1574 -10.089 3.162 1.220 1.00 0.00 C ATOM 935 C VAL A1574 -8.719 3.639 1.748 1.00 0.00 C ATOM 936 O VAL A1574 -7.974 2.911 2.410 1.00 0.00 O ATOM 937 CB VAL A1574 -10.137 1.636 0.842 1.00 0.00 C ATOM 938 CG1 VAL A1574 -9.138 1.246 -0.225 1.00 0.00 C ATOM 939 CG2 VAL A1574 -10.049 0.727 2.056 1.00 0.00 C ATOM 0 H VAL A1574 -9.998 3.795 -0.754 1.00 0.00 H new ATOM 0 HA VAL A1574 -10.797 3.271 2.042 1.00 0.00 H new ATOM 0 HB VAL A1574 -11.123 1.486 0.402 1.00 0.00 H new ATOM 0 HG11 VAL A1574 -9.228 0.180 -0.435 1.00 0.00 H new ATOM 0 HG12 VAL A1574 -9.337 1.813 -1.134 1.00 0.00 H new ATOM 0 HG13 VAL A1574 -8.129 1.463 0.125 1.00 0.00 H new ATOM 0 HG21 VAL A1574 -10.087 -0.314 1.735 1.00 0.00 H new ATOM 0 HG22 VAL A1574 -9.112 0.911 2.581 1.00 0.00 H new ATOM 0 HG23 VAL A1574 -10.885 0.931 2.725 1.00 0.00 H new ATOM 949 N GLY A1575 -8.396 4.881 1.414 1.00 0.00 N ATOM 950 CA GLY A1575 -7.223 5.491 1.945 1.00 0.00 C ATOM 951 C GLY A1575 -6.695 6.617 1.085 1.00 0.00 C ATOM 952 O GLY A1575 -6.785 6.568 -0.154 1.00 0.00 O ATOM 0 H GLY A1575 -8.937 5.469 0.780 1.00 0.00 H new ATOM 0 HA2 GLY A1575 -7.441 5.875 2.942 1.00 0.00 H new ATOM 0 HA3 GLY A1575 -6.447 4.734 2.058 1.00 0.00 H new ATOM 956 N LYS A1576 -6.176 7.635 1.736 1.00 0.00 N ATOM 957 CA LYS A1576 -5.548 8.771 1.083 1.00 0.00 C ATOM 958 C LYS A1576 -4.143 8.398 0.660 1.00 0.00 C ATOM 959 O LYS A1576 -3.553 7.458 1.190 1.00 0.00 O ATOM 960 CB LYS A1576 -5.469 9.972 2.036 1.00 0.00 C ATOM 961 CG LYS A1576 -6.801 10.588 2.427 1.00 0.00 C ATOM 962 CD LYS A1576 -7.536 11.163 1.224 1.00 0.00 C ATOM 963 CE LYS A1576 -8.772 11.931 1.660 1.00 0.00 C ATOM 964 NZ LYS A1576 -9.498 12.523 0.516 1.00 0.00 N1+ ATOM 0 H LYS A1576 -6.177 7.701 2.754 1.00 0.00 H new ATOM 0 HA LYS A1576 -6.149 9.041 0.215 1.00 0.00 H new ATOM 0 HB2 LYS A1576 -4.953 9.659 2.944 1.00 0.00 H new ATOM 0 HB3 LYS A1576 -4.855 10.743 1.570 1.00 0.00 H new ATOM 0 HG2 LYS A1576 -7.424 9.832 2.906 1.00 0.00 H new ATOM 0 HG3 LYS A1576 -6.635 11.376 3.161 1.00 0.00 H new ATOM 0 HD2 LYS A1576 -6.870 11.823 0.668 1.00 0.00 H new ATOM 0 HD3 LYS A1576 -7.823 10.357 0.549 1.00 0.00 H new ATOM 0 HE2 LYS A1576 -9.439 11.262 2.204 1.00 0.00 H new ATOM 0 HE3 LYS A1576 -8.480 12.722 2.351 1.00 0.00 H new ATOM 0 HZ1 LYS A1576 -10.333 13.037 0.863 1.00 0.00 H new ATOM 0 HZ2 LYS A1576 -8.872 13.182 0.011 1.00 0.00 H new ATOM 0 HZ3 LYS A1576 -9.801 11.768 -0.132 1.00 0.00 H new ATOM 978 N ALA A1577 -3.632 9.130 -0.296 1.00 0.00 N ATOM 979 CA ALA A1577 -2.311 8.938 -0.854 1.00 0.00 C ATOM 980 C ALA A1577 -1.217 9.264 0.155 1.00 0.00 C ATOM 981 O ALA A1577 -0.714 10.389 0.209 1.00 0.00 O ATOM 982 CB ALA A1577 -2.162 9.810 -2.075 1.00 0.00 C ATOM 0 H ALA A1577 -4.139 9.904 -0.725 1.00 0.00 H new ATOM 0 HA ALA A1577 -2.202 7.888 -1.124 1.00 0.00 H new ATOM 0 HB1 ALA A1577 -1.169 9.671 -2.502 1.00 0.00 H new ATOM 0 HB2 ALA A1577 -2.916 9.535 -2.813 1.00 0.00 H new ATOM 0 HB3 ALA A1577 -2.294 10.855 -1.794 1.00 0.00 H new ATOM 988 N ASN A1578 -0.869 8.297 0.951 1.00 0.00 N ATOM 989 CA ASN A1578 0.180 8.456 1.935 1.00 0.00 C ATOM 990 C ASN A1578 1.486 7.990 1.352 1.00 0.00 C ATOM 991 O ASN A1578 1.507 7.125 0.474 1.00 0.00 O ATOM 992 CB ASN A1578 -0.119 7.699 3.247 1.00 0.00 C ATOM 993 CG ASN A1578 -1.244 8.301 4.102 1.00 0.00 C ATOM 994 OD1 ASN A1578 -1.222 8.209 5.322 1.00 0.00 O ATOM 995 ND2 ASN A1578 -2.235 8.886 3.490 1.00 0.00 N ATOM 0 H ASN A1578 -1.300 7.372 0.943 1.00 0.00 H new ATOM 0 HA ASN A1578 0.239 9.515 2.188 1.00 0.00 H new ATOM 0 HB2 ASN A1578 -0.380 6.669 3.003 1.00 0.00 H new ATOM 0 HB3 ASN A1578 0.792 7.664 3.844 1.00 0.00 H new ATOM 0 HD21 ASN A1578 -3.008 9.276 4.029 1.00 0.00 H new ATOM 0 HD22 ASN A1578 -2.237 8.954 2.472 1.00 0.00 H new ATOM 1002 N LYS A1579 2.556 8.564 1.820 1.00 0.00 N ATOM 1003 CA LYS A1579 3.876 8.248 1.330 1.00 0.00 C ATOM 1004 C LYS A1579 4.790 7.850 2.482 1.00 0.00 C ATOM 1005 O LYS A1579 6.006 7.735 2.325 1.00 0.00 O ATOM 1006 CB LYS A1579 4.421 9.453 0.504 1.00 0.00 C ATOM 1007 CG LYS A1579 4.451 10.833 1.228 1.00 0.00 C ATOM 1008 CD LYS A1579 5.535 10.964 2.313 1.00 0.00 C ATOM 1009 CE LYS A1579 6.946 11.056 1.722 1.00 0.00 C ATOM 1010 NZ LYS A1579 7.195 12.359 1.047 1.00 0.00 N1+ ATOM 0 H LYS A1579 2.543 9.269 2.557 1.00 0.00 H new ATOM 0 HA LYS A1579 3.835 7.387 0.663 1.00 0.00 H new ATOM 0 HB2 LYS A1579 5.434 9.215 0.180 1.00 0.00 H new ATOM 0 HB3 LYS A1579 3.814 9.553 -0.396 1.00 0.00 H new ATOM 0 HG2 LYS A1579 4.603 11.615 0.484 1.00 0.00 H new ATOM 0 HG3 LYS A1579 3.477 11.011 1.683 1.00 0.00 H new ATOM 0 HD2 LYS A1579 5.338 11.851 2.915 1.00 0.00 H new ATOM 0 HD3 LYS A1579 5.480 10.106 2.983 1.00 0.00 H new ATOM 0 HE2 LYS A1579 7.679 10.915 2.516 1.00 0.00 H new ATOM 0 HE3 LYS A1579 7.091 10.246 1.007 1.00 0.00 H new ATOM 0 HZ1 LYS A1579 8.187 12.406 0.738 1.00 0.00 H new ATOM 0 HZ2 LYS A1579 6.571 12.446 0.220 1.00 0.00 H new ATOM 0 HZ3 LYS A1579 7.001 13.136 1.710 1.00 0.00 H new ATOM 1024 N ARG A1580 4.181 7.642 3.633 1.00 0.00 N ATOM 1025 CA ARG A1580 4.892 7.314 4.855 1.00 0.00 C ATOM 1026 C ARG A1580 5.338 5.856 4.841 1.00 0.00 C ATOM 1027 O ARG A1580 4.579 4.950 5.231 1.00 0.00 O ATOM 1028 CB ARG A1580 3.994 7.572 6.066 1.00 0.00 C ATOM 1029 CG ARG A1580 4.673 7.353 7.406 1.00 0.00 C ATOM 1030 CD ARG A1580 3.693 7.517 8.545 1.00 0.00 C ATOM 1031 NE ARG A1580 4.349 7.401 9.845 1.00 0.00 N ATOM 1032 CZ ARG A1580 3.738 7.548 11.025 1.00 0.00 C ATOM 1033 NH1 ARG A1580 2.423 7.737 11.082 1.00 0.00 N1+ ATOM 1034 NH2 ARG A1580 4.450 7.501 12.141 1.00 0.00 N ATOM 0 H ARG A1580 3.169 7.696 3.748 1.00 0.00 H new ATOM 0 HA ARG A1580 5.777 7.947 4.922 1.00 0.00 H new ATOM 0 HB2 ARG A1580 3.629 8.598 6.021 1.00 0.00 H new ATOM 0 HB3 ARG A1580 3.123 6.920 6.003 1.00 0.00 H new ATOM 0 HG2 ARG A1580 5.109 6.354 7.438 1.00 0.00 H new ATOM 0 HG3 ARG A1580 5.493 8.062 7.522 1.00 0.00 H new ATOM 0 HD2 ARG A1580 3.206 8.489 8.469 1.00 0.00 H new ATOM 0 HD3 ARG A1580 2.911 6.762 8.464 1.00 0.00 H new ATOM 0 HE ARG A1580 5.347 7.192 9.853 1.00 0.00 H new ATOM 0 HH11 ARG A1580 1.875 7.770 10.222 1.00 0.00 H new ATOM 0 HH12 ARG A1580 1.962 7.848 11.985 1.00 0.00 H new ATOM 0 HH21 ARG A1580 5.458 7.353 12.097 1.00 0.00 H new ATOM 0 HH22 ARG A1580 3.990 7.612 13.045 1.00 0.00 H new ATOM 1048 N LEU A1581 6.541 5.621 4.392 1.00 0.00 N ATOM 1049 CA LEU A1581 7.061 4.291 4.342 1.00 0.00 C ATOM 1050 C LEU A1581 7.687 3.956 5.685 1.00 0.00 C ATOM 1051 O LEU A1581 8.564 4.671 6.171 1.00 0.00 O ATOM 1052 CB LEU A1581 8.093 4.141 3.220 1.00 0.00 C ATOM 1053 CG LEU A1581 7.916 2.920 2.303 1.00 0.00 C ATOM 1054 CD1 LEU A1581 9.076 2.782 1.346 1.00 0.00 C ATOM 1055 CD2 LEU A1581 7.721 1.642 3.098 1.00 0.00 C ATOM 0 H LEU A1581 7.179 6.342 4.055 1.00 0.00 H new ATOM 0 HA LEU A1581 6.245 3.599 4.131 1.00 0.00 H new ATOM 0 HB2 LEU A1581 8.065 5.040 2.605 1.00 0.00 H new ATOM 0 HB3 LEU A1581 9.085 4.093 3.669 1.00 0.00 H new ATOM 0 HG LEU A1581 7.011 3.087 1.719 1.00 0.00 H new ATOM 0 HD11 LEU A1581 8.922 1.910 0.711 1.00 0.00 H new ATOM 0 HD12 LEU A1581 9.144 3.675 0.725 1.00 0.00 H new ATOM 0 HD13 LEU A1581 10.001 2.661 1.910 1.00 0.00 H new ATOM 0 HD21 LEU A1581 7.600 0.803 2.413 1.00 0.00 H new ATOM 0 HD22 LEU A1581 8.592 1.471 3.731 1.00 0.00 H new ATOM 0 HD23 LEU A1581 6.831 1.733 3.721 1.00 0.00 H new ATOM 1067 N ARG A1582 7.218 2.909 6.287 1.00 0.00 N ATOM 1068 CA ARG A1582 7.704 2.480 7.580 1.00 0.00 C ATOM 1069 C ARG A1582 8.507 1.209 7.415 1.00 0.00 C ATOM 1070 O ARG A1582 8.027 0.262 6.811 1.00 0.00 O ATOM 1071 CB ARG A1582 6.513 2.232 8.494 1.00 0.00 C ATOM 1072 CG ARG A1582 5.676 3.472 8.748 1.00 0.00 C ATOM 1073 CD ARG A1582 4.365 3.130 9.409 1.00 0.00 C ATOM 1074 NE ARG A1582 3.492 2.339 8.524 1.00 0.00 N ATOM 1075 CZ ARG A1582 2.312 1.811 8.886 1.00 0.00 C ATOM 1076 NH1 ARG A1582 1.897 1.891 10.145 1.00 0.00 N1+ ATOM 1077 NH2 ARG A1582 1.562 1.182 7.989 1.00 0.00 N ATOM 0 H ARG A1582 6.482 2.317 5.901 1.00 0.00 H new ATOM 0 HA ARG A1582 8.342 3.248 8.017 1.00 0.00 H new ATOM 0 HB2 ARG A1582 5.881 1.461 8.053 1.00 0.00 H new ATOM 0 HB3 ARG A1582 6.871 1.844 9.447 1.00 0.00 H new ATOM 0 HG2 ARG A1582 6.233 4.165 9.379 1.00 0.00 H new ATOM 0 HG3 ARG A1582 5.486 3.983 7.804 1.00 0.00 H new ATOM 0 HD2 ARG A1582 4.556 2.571 10.325 1.00 0.00 H new ATOM 0 HD3 ARG A1582 3.853 4.048 9.697 1.00 0.00 H new ATOM 0 HE ARG A1582 3.807 2.181 7.567 1.00 0.00 H new ATOM 0 HH11 ARG A1582 2.476 2.356 10.844 1.00 0.00 H new ATOM 0 HH12 ARG A1582 0.999 1.488 10.413 1.00 0.00 H new ATOM 0 HH21 ARG A1582 1.882 1.100 7.024 1.00 0.00 H new ATOM 0 HH22 ARG A1582 0.666 0.781 8.265 1.00 0.00 H new ATOM 1091 N TYR A1583 9.721 1.198 7.907 1.00 0.00 N ATOM 1092 CA TYR A1583 10.562 0.023 7.818 1.00 0.00 C ATOM 1093 C TYR A1583 10.871 -0.498 9.201 1.00 0.00 C ATOM 1094 O TYR A1583 11.703 0.063 9.915 1.00 0.00 O ATOM 1095 CB TYR A1583 11.863 0.319 7.054 1.00 0.00 C ATOM 1096 CG TYR A1583 12.811 -0.871 6.962 1.00 0.00 C ATOM 1097 CD1 TYR A1583 12.438 -2.032 6.298 1.00 0.00 C ATOM 1098 CD2 TYR A1583 14.081 -0.826 7.529 1.00 0.00 C ATOM 1099 CE1 TYR A1583 13.289 -3.107 6.203 1.00 0.00 C ATOM 1100 CE2 TYR A1583 14.941 -1.907 7.437 1.00 0.00 C ATOM 1101 CZ TYR A1583 14.536 -3.044 6.771 1.00 0.00 C ATOM 1102 OH TYR A1583 15.386 -4.117 6.665 1.00 0.00 O ATOM 0 H TYR A1583 10.154 1.993 8.377 1.00 0.00 H new ATOM 0 HA TYR A1583 10.018 -0.740 7.262 1.00 0.00 H new ATOM 0 HB2 TYR A1583 11.613 0.651 6.046 1.00 0.00 H new ATOM 0 HB3 TYR A1583 12.379 1.145 7.543 1.00 0.00 H new ATOM 0 HD1 TYR A1583 11.459 -2.092 5.847 1.00 0.00 H new ATOM 0 HD2 TYR A1583 14.400 0.065 8.048 1.00 0.00 H new ATOM 0 HE1 TYR A1583 12.976 -4.000 5.682 1.00 0.00 H new ATOM 0 HE2 TYR A1583 15.923 -1.860 7.884 1.00 0.00 H new ATOM 0 HH TYR A1583 16.230 -3.912 7.120 1.00 0.00 H new ATOM 1112 N VAL A1584 10.190 -1.540 9.581 1.00 0.00 N ATOM 1113 CA VAL A1584 10.381 -2.168 10.869 1.00 0.00 C ATOM 1114 C VAL A1584 10.295 -3.662 10.711 1.00 0.00 C ATOM 1115 O VAL A1584 9.584 -4.126 9.870 1.00 0.00 O ATOM 1116 CB VAL A1584 9.334 -1.695 11.936 1.00 0.00 C ATOM 1117 CG1 VAL A1584 9.634 -0.284 12.420 1.00 0.00 C ATOM 1118 CG2 VAL A1584 7.913 -1.756 11.368 1.00 0.00 C ATOM 0 H VAL A1584 9.478 -1.987 9.004 1.00 0.00 H new ATOM 0 HA VAL A1584 11.366 -1.873 11.231 1.00 0.00 H new ATOM 0 HB VAL A1584 9.407 -2.374 12.786 1.00 0.00 H new ATOM 0 HG11 VAL A1584 8.890 0.013 13.159 1.00 0.00 H new ATOM 0 HG12 VAL A1584 10.625 -0.258 12.873 1.00 0.00 H new ATOM 0 HG13 VAL A1584 9.602 0.405 11.576 1.00 0.00 H new ATOM 0 HG21 VAL A1584 7.204 -1.423 12.126 1.00 0.00 H new ATOM 0 HG22 VAL A1584 7.842 -1.107 10.495 1.00 0.00 H new ATOM 0 HG23 VAL A1584 7.681 -2.781 11.078 1.00 0.00 H new ATOM 1128 N ASP A1585 11.093 -4.387 11.473 1.00 0.00 N ATOM 1129 CA ASP A1585 11.071 -5.872 11.541 1.00 0.00 C ATOM 1130 C ASP A1585 11.194 -6.544 10.179 1.00 0.00 C ATOM 1131 O ASP A1585 10.574 -7.593 9.946 1.00 0.00 O ATOM 1132 CB ASP A1585 9.803 -6.397 12.251 1.00 0.00 C ATOM 1133 CG ASP A1585 9.635 -5.867 13.645 1.00 0.00 C ATOM 1134 OD1 ASP A1585 10.524 -6.094 14.494 1.00 0.00 O ATOM 1135 OD2 ASP A1585 8.598 -5.216 13.927 1.00 0.00 O1- ATOM 0 H ASP A1585 11.797 -3.970 12.082 1.00 0.00 H new ATOM 0 HA ASP A1585 11.953 -6.137 12.125 1.00 0.00 H new ATOM 0 HB2 ASP A1585 8.927 -6.127 11.660 1.00 0.00 H new ATOM 0 HB3 ASP A1585 9.841 -7.486 12.287 1.00 0.00 H new ATOM 1140 N GLN A1586 12.004 -5.960 9.301 1.00 0.00 N ATOM 1141 CA GLN A1586 12.205 -6.449 7.921 1.00 0.00 C ATOM 1142 C GLN A1586 10.895 -6.436 7.117 1.00 0.00 C ATOM 1143 O GLN A1586 10.683 -7.283 6.242 1.00 0.00 O ATOM 1144 CB GLN A1586 12.848 -7.870 7.843 1.00 0.00 C ATOM 1145 CG GLN A1586 14.315 -8.009 8.280 1.00 0.00 C ATOM 1146 CD GLN A1586 14.555 -7.777 9.755 1.00 0.00 C ATOM 1147 OE1 GLN A1586 14.449 -8.698 10.564 1.00 0.00 O ATOM 1148 NE2 GLN A1586 14.937 -6.584 10.115 1.00 0.00 N ATOM 0 H GLN A1586 12.549 -5.126 9.519 1.00 0.00 H new ATOM 0 HA GLN A1586 12.913 -5.748 7.478 1.00 0.00 H new ATOM 0 HB2 GLN A1586 12.249 -8.544 8.455 1.00 0.00 H new ATOM 0 HB3 GLN A1586 12.769 -8.219 6.813 1.00 0.00 H new ATOM 0 HG2 GLN A1586 14.665 -9.008 8.021 1.00 0.00 H new ATOM 0 HG3 GLN A1586 14.919 -7.302 7.711 1.00 0.00 H new ATOM 0 HE21 GLN A1586 15.015 -5.842 9.420 1.00 0.00 H new ATOM 0 HE22 GLN A1586 15.158 -6.392 11.092 1.00 0.00 H new ATOM 1157 N VAL A1587 10.007 -5.534 7.444 1.00 0.00 N ATOM 1158 CA VAL A1587 8.780 -5.381 6.716 1.00 0.00 C ATOM 1159 C VAL A1587 8.503 -3.905 6.451 1.00 0.00 C ATOM 1160 O VAL A1587 8.522 -3.070 7.369 1.00 0.00 O ATOM 1161 CB VAL A1587 7.541 -6.116 7.396 1.00 0.00 C ATOM 1162 CG1 VAL A1587 7.323 -5.710 8.839 1.00 0.00 C ATOM 1163 CG2 VAL A1587 6.262 -5.887 6.616 1.00 0.00 C ATOM 0 H VAL A1587 10.117 -4.885 8.224 1.00 0.00 H new ATOM 0 HA VAL A1587 8.911 -5.885 5.758 1.00 0.00 H new ATOM 0 HB VAL A1587 7.794 -7.176 7.383 1.00 0.00 H new ATOM 0 HG11 VAL A1587 6.464 -6.247 9.242 1.00 0.00 H new ATOM 0 HG12 VAL A1587 8.210 -5.953 9.423 1.00 0.00 H new ATOM 0 HG13 VAL A1587 7.137 -4.637 8.891 1.00 0.00 H new ATOM 0 HG21 VAL A1587 5.438 -6.403 7.109 1.00 0.00 H new ATOM 0 HG22 VAL A1587 6.048 -4.819 6.574 1.00 0.00 H new ATOM 0 HG23 VAL A1587 6.379 -6.274 5.604 1.00 0.00 H new ATOM 1173 N LEU A1588 8.338 -3.580 5.197 1.00 0.00 N ATOM 1174 CA LEU A1588 7.977 -2.247 4.804 1.00 0.00 C ATOM 1175 C LEU A1588 6.481 -2.158 4.924 1.00 0.00 C ATOM 1176 O LEU A1588 5.772 -3.014 4.423 1.00 0.00 O ATOM 1177 CB LEU A1588 8.419 -1.952 3.358 1.00 0.00 C ATOM 1178 CG LEU A1588 9.922 -1.928 3.077 1.00 0.00 C ATOM 1179 CD1 LEU A1588 10.165 -1.889 1.581 1.00 0.00 C ATOM 1180 CD2 LEU A1588 10.558 -0.711 3.715 1.00 0.00 C ATOM 0 H LEU A1588 8.450 -4.232 4.421 1.00 0.00 H new ATOM 0 HA LEU A1588 8.472 -1.512 5.439 1.00 0.00 H new ATOM 0 HB2 LEU A1588 7.966 -2.700 2.707 1.00 0.00 H new ATOM 0 HB3 LEU A1588 8.006 -0.986 3.069 1.00 0.00 H new ATOM 0 HG LEU A1588 10.368 -2.829 3.499 1.00 0.00 H new ATOM 0 HD11 LEU A1588 11.237 -1.872 1.387 1.00 0.00 H new ATOM 0 HD12 LEU A1588 9.726 -2.773 1.118 1.00 0.00 H new ATOM 0 HD13 LEU A1588 9.706 -0.994 1.161 1.00 0.00 H new ATOM 0 HD21 LEU A1588 11.628 -0.708 3.506 1.00 0.00 H new ATOM 0 HD22 LEU A1588 10.106 0.192 3.306 1.00 0.00 H new ATOM 0 HD23 LEU A1588 10.399 -0.740 4.793 1.00 0.00 H new ATOM 1192 N GLN A1589 5.993 -1.199 5.620 1.00 0.00 N ATOM 1193 CA GLN A1589 4.585 -1.125 5.810 1.00 0.00 C ATOM 1194 C GLN A1589 4.043 0.255 5.480 1.00 0.00 C ATOM 1195 O GLN A1589 4.486 1.276 6.030 1.00 0.00 O ATOM 1196 CB GLN A1589 4.234 -1.585 7.230 1.00 0.00 C ATOM 1197 CG GLN A1589 2.758 -1.787 7.488 1.00 0.00 C ATOM 1198 CD GLN A1589 2.504 -2.446 8.825 1.00 0.00 C ATOM 1199 OE1 GLN A1589 2.439 -3.668 8.921 1.00 0.00 O ATOM 1200 NE2 GLN A1589 2.375 -1.661 9.862 1.00 0.00 N ATOM 0 H GLN A1589 6.537 -0.460 6.065 1.00 0.00 H new ATOM 0 HA GLN A1589 4.094 -1.802 5.111 1.00 0.00 H new ATOM 0 HB2 GLN A1589 4.755 -2.521 7.432 1.00 0.00 H new ATOM 0 HB3 GLN A1589 4.614 -0.849 7.939 1.00 0.00 H new ATOM 0 HG2 GLN A1589 2.249 -0.824 7.455 1.00 0.00 H new ATOM 0 HG3 GLN A1589 2.331 -2.400 6.694 1.00 0.00 H new ATOM 0 HE21 GLN A1589 2.434 -0.649 9.746 1.00 0.00 H new ATOM 0 HE22 GLN A1589 2.215 -2.060 10.787 1.00 0.00 H new ATOM 1209 N LEU A1590 3.076 0.272 4.602 1.00 0.00 N ATOM 1210 CA LEU A1590 2.423 1.488 4.150 1.00 0.00 C ATOM 1211 C LEU A1590 1.003 1.470 4.622 1.00 0.00 C ATOM 1212 O LEU A1590 0.439 0.401 4.866 1.00 0.00 O ATOM 1213 CB LEU A1590 2.429 1.597 2.611 1.00 0.00 C ATOM 1214 CG LEU A1590 3.747 1.977 1.931 1.00 0.00 C ATOM 1215 CD1 LEU A1590 3.596 1.904 0.419 1.00 0.00 C ATOM 1216 CD2 LEU A1590 4.144 3.385 2.326 1.00 0.00 C ATOM 0 H LEU A1590 2.707 -0.573 4.167 1.00 0.00 H new ATOM 0 HA LEU A1590 2.966 2.341 4.556 1.00 0.00 H new ATOM 0 HB2 LEU A1590 2.106 0.638 2.205 1.00 0.00 H new ATOM 0 HB3 LEU A1590 1.679 2.333 2.324 1.00 0.00 H new ATOM 0 HG LEU A1590 4.519 1.277 2.251 1.00 0.00 H new ATOM 0 HD11 LEU A1590 4.539 2.176 -0.054 1.00 0.00 H new ATOM 0 HD12 LEU A1590 3.324 0.889 0.129 1.00 0.00 H new ATOM 0 HD13 LEU A1590 2.816 2.594 0.097 1.00 0.00 H new ATOM 0 HD21 LEU A1590 5.083 3.649 1.839 1.00 0.00 H new ATOM 0 HD22 LEU A1590 3.366 4.083 2.017 1.00 0.00 H new ATOM 0 HD23 LEU A1590 4.269 3.438 3.407 1.00 0.00 H new ATOM 1228 N VAL A1591 0.446 2.622 4.799 1.00 0.00 N ATOM 1229 CA VAL A1591 -0.905 2.738 5.229 1.00 0.00 C ATOM 1230 C VAL A1591 -1.574 3.871 4.490 1.00 0.00 C ATOM 1231 O VAL A1591 -1.030 4.959 4.383 1.00 0.00 O ATOM 1232 CB VAL A1591 -1.028 2.933 6.786 1.00 0.00 C ATOM 1233 CG1 VAL A1591 -0.276 4.172 7.282 1.00 0.00 C ATOM 1234 CG2 VAL A1591 -2.492 2.984 7.221 1.00 0.00 C ATOM 0 H VAL A1591 0.919 3.513 4.648 1.00 0.00 H new ATOM 0 HA VAL A1591 -1.411 1.801 4.996 1.00 0.00 H new ATOM 0 HB VAL A1591 -0.558 2.064 7.247 1.00 0.00 H new ATOM 0 HG11 VAL A1591 -0.393 4.260 8.362 1.00 0.00 H new ATOM 0 HG12 VAL A1591 0.782 4.077 7.038 1.00 0.00 H new ATOM 0 HG13 VAL A1591 -0.681 5.061 6.799 1.00 0.00 H new ATOM 0 HG21 VAL A1591 -2.546 3.119 8.301 1.00 0.00 H new ATOM 0 HG22 VAL A1591 -2.990 3.817 6.725 1.00 0.00 H new ATOM 0 HG23 VAL A1591 -2.986 2.052 6.947 1.00 0.00 H new ATOM 1244 N TYR A1592 -2.689 3.590 3.916 1.00 0.00 N ATOM 1245 CA TYR A1592 -3.484 4.603 3.318 1.00 0.00 C ATOM 1246 C TYR A1592 -4.630 4.827 4.244 1.00 0.00 C ATOM 1247 O TYR A1592 -5.501 3.981 4.370 1.00 0.00 O ATOM 1248 CB TYR A1592 -3.956 4.209 1.920 1.00 0.00 C ATOM 1249 CG TYR A1592 -2.832 3.964 0.946 1.00 0.00 C ATOM 1250 CD1 TYR A1592 -1.811 4.891 0.797 1.00 0.00 C ATOM 1251 CD2 TYR A1592 -2.800 2.827 0.166 1.00 0.00 C ATOM 1252 CE1 TYR A1592 -0.790 4.688 -0.095 1.00 0.00 C ATOM 1253 CE2 TYR A1592 -1.778 2.616 -0.729 1.00 0.00 C ATOM 1254 CZ TYR A1592 -0.778 3.550 -0.854 1.00 0.00 C ATOM 1255 OH TYR A1592 0.228 3.344 -1.749 1.00 0.00 O ATOM 0 H TYR A1592 -3.077 2.649 3.847 1.00 0.00 H new ATOM 0 HA TYR A1592 -2.907 5.517 3.176 1.00 0.00 H new ATOM 0 HB2 TYR A1592 -4.565 3.308 1.993 1.00 0.00 H new ATOM 0 HB3 TYR A1592 -4.599 4.997 1.528 1.00 0.00 H new ATOM 0 HD1 TYR A1592 -1.821 5.790 1.395 1.00 0.00 H new ATOM 0 HD2 TYR A1592 -3.587 2.094 0.259 1.00 0.00 H new ATOM 0 HE1 TYR A1592 -0.002 5.420 -0.198 1.00 0.00 H new ATOM 0 HE2 TYR A1592 -1.761 1.720 -1.331 1.00 0.00 H new ATOM 0 HH TYR A1592 -0.142 3.315 -2.656 1.00 0.00 H new ATOM 1265 N LYS A1593 -4.585 5.911 4.948 1.00 0.00 N ATOM 1266 CA LYS A1593 -5.562 6.189 5.965 1.00 0.00 C ATOM 1267 C LYS A1593 -6.496 7.303 5.532 1.00 0.00 C ATOM 1268 O LYS A1593 -6.306 7.887 4.464 1.00 0.00 O ATOM 1269 CB LYS A1593 -4.847 6.600 7.267 1.00 0.00 C ATOM 1270 CG LYS A1593 -4.053 7.907 7.152 1.00 0.00 C ATOM 1271 CD LYS A1593 -3.443 8.310 8.483 1.00 0.00 C ATOM 1272 CE LYS A1593 -2.785 9.692 8.414 1.00 0.00 C ATOM 1273 NZ LYS A1593 -1.601 9.745 7.518 1.00 0.00 N1+ ATOM 0 H LYS A1593 -3.872 6.633 4.839 1.00 0.00 H new ATOM 0 HA LYS A1593 -6.151 5.287 6.130 1.00 0.00 H new ATOM 0 HB2 LYS A1593 -5.588 6.705 8.060 1.00 0.00 H new ATOM 0 HB3 LYS A1593 -4.170 5.800 7.567 1.00 0.00 H new ATOM 0 HG2 LYS A1593 -3.263 7.789 6.410 1.00 0.00 H new ATOM 0 HG3 LYS A1593 -4.709 8.702 6.796 1.00 0.00 H new ATOM 0 HD2 LYS A1593 -4.217 8.314 9.251 1.00 0.00 H new ATOM 0 HD3 LYS A1593 -2.701 7.569 8.782 1.00 0.00 H new ATOM 0 HE2 LYS A1593 -3.522 10.419 8.072 1.00 0.00 H new ATOM 0 HE3 LYS A1593 -2.484 9.992 9.418 1.00 0.00 H new ATOM 0 HZ1 LYS A1593 -1.599 10.646 6.999 1.00 0.00 H new ATOM 0 HZ2 LYS A1593 -0.733 9.670 8.085 1.00 0.00 H new ATOM 0 HZ3 LYS A1593 -1.642 8.956 6.842 1.00 0.00 H new ATOM 1287 N ASP A1594 -7.494 7.567 6.365 1.00 0.00 N ATOM 1288 CA ASP A1594 -8.418 8.705 6.234 1.00 0.00 C ATOM 1289 C ASP A1594 -9.236 8.666 4.924 1.00 0.00 C ATOM 1290 O ASP A1594 -9.382 9.668 4.220 1.00 0.00 O ATOM 1291 CB ASP A1594 -7.639 10.038 6.397 1.00 0.00 C ATOM 1292 CG ASP A1594 -8.522 11.237 6.673 1.00 0.00 C ATOM 1293 OD1 ASP A1594 -8.964 11.413 7.841 1.00 0.00 O1- ATOM 1294 OD2 ASP A1594 -8.773 12.039 5.762 1.00 0.00 O ATOM 0 H ASP A1594 -7.696 6.983 7.177 1.00 0.00 H new ATOM 0 HA ASP A1594 -9.153 8.631 7.035 1.00 0.00 H new ATOM 0 HB2 ASP A1594 -6.923 9.931 7.212 1.00 0.00 H new ATOM 0 HB3 ASP A1594 -7.064 10.224 5.490 1.00 0.00 H new ATOM 1299 N GLY A1595 -9.764 7.497 4.597 1.00 0.00 N ATOM 1300 CA GLY A1595 -10.600 7.362 3.418 1.00 0.00 C ATOM 1301 C GLY A1595 -12.055 7.751 3.684 1.00 0.00 C ATOM 1302 O GLY A1595 -12.336 8.736 4.387 1.00 0.00 O ATOM 0 H GLY A1595 -9.629 6.636 5.127 1.00 0.00 H new ATOM 0 HA2 GLY A1595 -10.200 7.987 2.620 1.00 0.00 H new ATOM 0 HA3 GLY A1595 -10.561 6.331 3.065 1.00 0.00 H new ATOM 1306 N SER A1596 -12.968 6.997 3.130 1.00 0.00 N ATOM 1307 CA SER A1596 -14.394 7.233 3.283 1.00 0.00 C ATOM 1308 C SER A1596 -14.833 6.990 4.737 1.00 0.00 C ATOM 1309 O SER A1596 -14.236 6.169 5.434 1.00 0.00 O ATOM 1310 CB SER A1596 -15.133 6.281 2.351 1.00 0.00 C ATOM 1311 OG SER A1596 -14.695 6.451 1.013 1.00 0.00 O ATOM 0 H SER A1596 -12.747 6.188 2.550 1.00 0.00 H new ATOM 0 HA SER A1596 -14.625 8.269 3.033 1.00 0.00 H new ATOM 0 HB2 SER A1596 -14.965 5.251 2.666 1.00 0.00 H new ATOM 0 HB3 SER A1596 -16.206 6.462 2.414 1.00 0.00 H new ATOM 0 HG SER A1596 -15.464 6.394 0.408 1.00 0.00 H new ATOM 1317 N PRO A1597 -15.845 7.734 5.219 1.00 0.00 N ATOM 1318 CA PRO A1597 -16.381 7.554 6.562 1.00 0.00 C ATOM 1319 C PRO A1597 -17.121 6.226 6.675 1.00 0.00 C ATOM 1320 O PRO A1597 -17.901 5.854 5.785 1.00 0.00 O ATOM 1321 CB PRO A1597 -17.355 8.727 6.732 1.00 0.00 C ATOM 1322 CG PRO A1597 -17.736 9.112 5.347 1.00 0.00 C ATOM 1323 CD PRO A1597 -16.539 8.815 4.491 1.00 0.00 C ATOM 0 HA PRO A1597 -15.602 7.536 7.324 1.00 0.00 H new ATOM 0 HB2 PRO A1597 -18.228 8.434 7.315 1.00 0.00 H new ATOM 0 HB3 PRO A1597 -16.885 9.558 7.258 1.00 0.00 H new ATOM 0 HG2 PRO A1597 -18.606 8.548 5.011 1.00 0.00 H new ATOM 0 HG3 PRO A1597 -18.001 10.168 5.294 1.00 0.00 H new ATOM 0 HD2 PRO A1597 -16.832 8.499 3.490 1.00 0.00 H new ATOM 0 HD3 PRO A1597 -15.902 9.692 4.375 1.00 0.00 H new ATOM 1331 N CYS A1598 -16.863 5.520 7.732 1.00 0.00 N ATOM 1332 CA CYS A1598 -17.461 4.226 7.981 1.00 0.00 C ATOM 1333 C CYS A1598 -18.921 4.347 8.407 1.00 0.00 C ATOM 1334 O CYS A1598 -19.237 5.057 9.355 1.00 0.00 O ATOM 1335 CB CYS A1598 -16.679 3.514 9.071 1.00 0.00 C ATOM 1336 SG CYS A1598 -14.945 3.241 8.660 1.00 0.00 S ATOM 0 H CYS A1598 -16.221 5.824 8.464 1.00 0.00 H new ATOM 0 HA CYS A1598 -17.429 3.657 7.052 1.00 0.00 H new ATOM 0 HB2 CYS A1598 -16.738 4.099 9.989 1.00 0.00 H new ATOM 0 HB3 CYS A1598 -17.150 2.553 9.275 1.00 0.00 H new ATOM 1406 N LEU A1604 -14.781 7.081 11.875 1.00 0.00 N ATOM 1407 CA LEU A1604 -13.779 6.197 11.355 1.00 0.00 C ATOM 1408 C LEU A1604 -13.759 6.318 9.852 1.00 0.00 C ATOM 1409 O LEU A1604 -14.785 6.636 9.233 1.00 0.00 O ATOM 1410 CB LEU A1604 -14.019 4.743 11.783 1.00 0.00 C ATOM 1411 CG LEU A1604 -13.956 4.454 13.288 1.00 0.00 C ATOM 1412 CD1 LEU A1604 -14.160 2.973 13.550 1.00 0.00 C ATOM 1413 CD2 LEU A1604 -12.627 4.913 13.872 1.00 0.00 C ATOM 0 HA LEU A1604 -12.810 6.485 11.763 1.00 0.00 H new ATOM 0 HB2 LEU A1604 -14.999 4.437 11.417 1.00 0.00 H new ATOM 0 HB3 LEU A1604 -13.282 4.114 11.284 1.00 0.00 H new ATOM 0 HG LEU A1604 -14.756 5.011 13.775 1.00 0.00 H new ATOM 0 HD11 LEU A1604 -14.113 2.783 14.622 1.00 0.00 H new ATOM 0 HD12 LEU A1604 -15.135 2.667 13.170 1.00 0.00 H new ATOM 0 HD13 LEU A1604 -13.379 2.403 13.046 1.00 0.00 H new ATOM 0 HD21 LEU A1604 -12.605 4.698 14.940 1.00 0.00 H new ATOM 0 HD22 LEU A1604 -11.811 4.385 13.379 1.00 0.00 H new ATOM 0 HD23 LEU A1604 -12.512 5.986 13.716 1.00 0.00 H new ATOM 1425 N SER A1605 -12.617 6.098 9.278 1.00 0.00 N ATOM 1426 CA SER A1605 -12.426 6.229 7.864 1.00 0.00 C ATOM 1427 C SER A1605 -11.683 4.992 7.355 1.00 0.00 C ATOM 1428 O SER A1605 -10.822 4.454 8.057 1.00 0.00 O ATOM 1429 CB SER A1605 -11.603 7.490 7.613 1.00 0.00 C ATOM 1430 OG SER A1605 -12.174 8.610 8.302 1.00 0.00 O ATOM 0 H SER A1605 -11.777 5.818 9.785 1.00 0.00 H new ATOM 0 HA SER A1605 -13.379 6.308 7.340 1.00 0.00 H new ATOM 0 HB2 SER A1605 -10.578 7.334 7.948 1.00 0.00 H new ATOM 0 HB3 SER A1605 -11.561 7.697 6.544 1.00 0.00 H new ATOM 0 HG SER A1605 -11.633 9.409 8.132 1.00 0.00 H new ATOM 1436 N TYR A1606 -12.059 4.529 6.174 1.00 0.00 N ATOM 1437 CA TYR A1606 -11.447 3.358 5.540 1.00 0.00 C ATOM 1438 C TYR A1606 -9.924 3.507 5.381 1.00 0.00 C ATOM 1439 O TYR A1606 -9.433 4.554 4.936 1.00 0.00 O ATOM 1440 CB TYR A1606 -12.131 3.040 4.199 1.00 0.00 C ATOM 1441 CG TYR A1606 -13.546 2.484 4.317 1.00 0.00 C ATOM 1442 CD1 TYR A1606 -14.636 3.324 4.488 1.00 0.00 C ATOM 1443 CD2 TYR A1606 -13.786 1.114 4.255 1.00 0.00 C ATOM 1444 CE1 TYR A1606 -15.918 2.830 4.602 1.00 0.00 C ATOM 1445 CE2 TYR A1606 -15.074 0.608 4.366 1.00 0.00 C ATOM 1446 CZ TYR A1606 -16.135 1.475 4.540 1.00 0.00 C ATOM 1447 OH TYR A1606 -17.421 0.983 4.662 1.00 0.00 O ATOM 0 H TYR A1606 -12.802 4.954 5.619 1.00 0.00 H new ATOM 0 HA TYR A1606 -11.604 2.510 6.207 1.00 0.00 H new ATOM 0 HB2 TYR A1606 -12.162 3.949 3.599 1.00 0.00 H new ATOM 0 HB3 TYR A1606 -11.518 2.321 3.656 1.00 0.00 H new ATOM 0 HD1 TYR A1606 -14.477 4.391 4.533 1.00 0.00 H new ATOM 0 HD2 TYR A1606 -12.958 0.435 4.118 1.00 0.00 H new ATOM 0 HE1 TYR A1606 -16.749 3.506 4.740 1.00 0.00 H new ATOM 0 HE2 TYR A1606 -15.245 -0.457 4.317 1.00 0.00 H new ATOM 0 HH TYR A1606 -17.405 0.005 4.595 1.00 0.00 H new ATOM 1457 N LYS A1607 -9.206 2.470 5.798 1.00 0.00 N ATOM 1458 CA LYS A1607 -7.754 2.425 5.796 1.00 0.00 C ATOM 1459 C LYS A1607 -7.257 1.145 5.116 1.00 0.00 C ATOM 1460 O LYS A1607 -7.864 0.073 5.262 1.00 0.00 O ATOM 1461 CB LYS A1607 -7.238 2.412 7.246 1.00 0.00 C ATOM 1462 CG LYS A1607 -7.604 3.631 8.081 1.00 0.00 C ATOM 1463 CD LYS A1607 -7.290 3.420 9.564 1.00 0.00 C ATOM 1464 CE LYS A1607 -5.810 3.157 9.831 1.00 0.00 C ATOM 1465 NZ LYS A1607 -5.550 2.929 11.269 1.00 0.00 N1+ ATOM 0 H LYS A1607 -9.633 1.616 6.156 1.00 0.00 H new ATOM 0 HA LYS A1607 -7.388 3.300 5.258 1.00 0.00 H new ATOM 0 HB2 LYS A1607 -7.625 1.523 7.743 1.00 0.00 H new ATOM 0 HB3 LYS A1607 -6.152 2.319 7.226 1.00 0.00 H new ATOM 0 HG2 LYS A1607 -7.058 4.500 7.714 1.00 0.00 H new ATOM 0 HG3 LYS A1607 -8.666 3.848 7.962 1.00 0.00 H new ATOM 0 HD2 LYS A1607 -7.603 4.301 10.125 1.00 0.00 H new ATOM 0 HD3 LYS A1607 -7.875 2.580 9.937 1.00 0.00 H new ATOM 0 HE2 LYS A1607 -5.485 2.288 9.259 1.00 0.00 H new ATOM 0 HE3 LYS A1607 -5.220 4.005 9.484 1.00 0.00 H new ATOM 0 HZ1 LYS A1607 -4.535 2.754 11.415 1.00 0.00 H new ATOM 0 HZ2 LYS A1607 -5.838 3.769 11.811 1.00 0.00 H new ATOM 0 HZ3 LYS A1607 -6.094 2.104 11.594 1.00 0.00 H new ATOM 1479 N SER A1608 -6.171 1.258 4.405 1.00 0.00 N ATOM 1480 CA SER A1608 -5.524 0.127 3.778 1.00 0.00 C ATOM 1481 C SER A1608 -4.112 -0.020 4.333 1.00 0.00 C ATOM 1482 O SER A1608 -3.322 0.928 4.288 1.00 0.00 O ATOM 1483 CB SER A1608 -5.455 0.330 2.270 1.00 0.00 C ATOM 1484 OG SER A1608 -6.735 0.541 1.735 1.00 0.00 O ATOM 0 H SER A1608 -5.700 2.147 4.239 1.00 0.00 H new ATOM 0 HA SER A1608 -6.100 -0.774 3.989 1.00 0.00 H new ATOM 0 HB2 SER A1608 -4.816 1.183 2.043 1.00 0.00 H new ATOM 0 HB3 SER A1608 -5.000 -0.543 1.802 1.00 0.00 H new ATOM 0 HG SER A1608 -7.085 1.400 2.052 1.00 0.00 H new ATOM 1490 N VAL A1609 -3.809 -1.167 4.874 1.00 0.00 N ATOM 1491 CA VAL A1609 -2.493 -1.442 5.401 1.00 0.00 C ATOM 1492 C VAL A1609 -1.793 -2.413 4.473 1.00 0.00 C ATOM 1493 O VAL A1609 -2.252 -3.533 4.282 1.00 0.00 O ATOM 1494 CB VAL A1609 -2.558 -2.046 6.834 1.00 0.00 C ATOM 1495 CG1 VAL A1609 -1.162 -2.380 7.358 1.00 0.00 C ATOM 1496 CG2 VAL A1609 -3.258 -1.088 7.786 1.00 0.00 C ATOM 0 H VAL A1609 -4.466 -1.942 4.964 1.00 0.00 H new ATOM 0 HA VAL A1609 -1.943 -0.503 5.465 1.00 0.00 H new ATOM 0 HB VAL A1609 -3.131 -2.971 6.778 1.00 0.00 H new ATOM 0 HG11 VAL A1609 -1.241 -2.800 8.361 1.00 0.00 H new ATOM 0 HG12 VAL A1609 -0.689 -3.106 6.697 1.00 0.00 H new ATOM 0 HG13 VAL A1609 -0.559 -1.473 7.391 1.00 0.00 H new ATOM 0 HG21 VAL A1609 -3.294 -1.527 8.783 1.00 0.00 H new ATOM 0 HG22 VAL A1609 -2.709 -0.147 7.824 1.00 0.00 H new ATOM 0 HG23 VAL A1609 -4.273 -0.902 7.434 1.00 0.00 H new ATOM 1506 N ILE A1610 -0.721 -1.978 3.869 1.00 0.00 N ATOM 1507 CA ILE A1610 0.025 -2.827 2.981 1.00 0.00 C ATOM 1508 C ILE A1610 1.312 -3.239 3.680 1.00 0.00 C ATOM 1509 O ILE A1610 2.166 -2.392 3.981 1.00 0.00 O ATOM 1510 CB ILE A1610 0.365 -2.118 1.647 1.00 0.00 C ATOM 1511 CG1 ILE A1610 -0.904 -1.511 1.031 1.00 0.00 C ATOM 1512 CG2 ILE A1610 0.993 -3.124 0.673 1.00 0.00 C ATOM 1513 CD1 ILE A1610 -0.650 -0.699 -0.224 1.00 0.00 C ATOM 0 H ILE A1610 -0.343 -1.037 3.976 1.00 0.00 H new ATOM 0 HA ILE A1610 -0.586 -3.697 2.740 1.00 0.00 H new ATOM 0 HB ILE A1610 1.076 -1.316 1.842 1.00 0.00 H new ATOM 0 HG12 ILE A1610 -1.602 -2.314 0.797 1.00 0.00 H new ATOM 0 HG13 ILE A1610 -1.387 -0.874 1.772 1.00 0.00 H new ATOM 0 HG21 ILE A1610 1.231 -2.622 -0.265 1.00 0.00 H new ATOM 0 HG22 ILE A1610 1.905 -3.531 1.109 1.00 0.00 H new ATOM 0 HG23 ILE A1610 0.289 -3.934 0.482 1.00 0.00 H new ATOM 0 HD11 ILE A1610 -1.594 -0.304 -0.599 1.00 0.00 H new ATOM 0 HD12 ILE A1610 0.023 0.127 0.007 1.00 0.00 H new ATOM 0 HD13 ILE A1610 -0.196 -1.335 -0.983 1.00 0.00 H new ATOM 1525 N SER A1611 1.421 -4.501 3.971 1.00 0.00 N ATOM 1526 CA SER A1611 2.552 -5.051 4.658 1.00 0.00 C ATOM 1527 C SER A1611 3.444 -5.773 3.637 1.00 0.00 C ATOM 1528 O SER A1611 3.047 -6.787 3.057 1.00 0.00 O ATOM 1529 CB SER A1611 2.027 -6.026 5.732 1.00 0.00 C ATOM 1530 OG SER A1611 3.051 -6.494 6.601 1.00 0.00 O ATOM 0 H SER A1611 0.710 -5.192 3.732 1.00 0.00 H new ATOM 0 HA SER A1611 3.145 -4.275 5.142 1.00 0.00 H new ATOM 0 HB2 SER A1611 1.256 -5.529 6.321 1.00 0.00 H new ATOM 0 HB3 SER A1611 1.555 -6.878 5.243 1.00 0.00 H new ATOM 0 HG SER A1611 2.665 -7.106 7.262 1.00 0.00 H new ATOM 1536 N PHE A1612 4.609 -5.228 3.389 1.00 0.00 N ATOM 1537 CA PHE A1612 5.553 -5.799 2.449 1.00 0.00 C ATOM 1538 C PHE A1612 6.525 -6.680 3.214 1.00 0.00 C ATOM 1539 O PHE A1612 7.500 -6.191 3.786 1.00 0.00 O ATOM 1540 CB PHE A1612 6.357 -4.694 1.735 1.00 0.00 C ATOM 1541 CG PHE A1612 5.559 -3.718 0.899 1.00 0.00 C ATOM 1542 CD1 PHE A1612 4.892 -2.657 1.486 1.00 0.00 C ATOM 1543 CD2 PHE A1612 5.503 -3.851 -0.474 1.00 0.00 C ATOM 1544 CE1 PHE A1612 4.184 -1.758 0.727 1.00 0.00 C ATOM 1545 CE2 PHE A1612 4.790 -2.954 -1.247 1.00 0.00 C ATOM 1546 CZ PHE A1612 4.130 -1.905 -0.645 1.00 0.00 C ATOM 0 H PHE A1612 4.935 -4.370 3.834 1.00 0.00 H new ATOM 0 HA PHE A1612 5.001 -6.372 1.704 1.00 0.00 H new ATOM 0 HB2 PHE A1612 6.906 -4.130 2.488 1.00 0.00 H new ATOM 0 HB3 PHE A1612 7.097 -5.171 1.092 1.00 0.00 H new ATOM 0 HD1 PHE A1612 4.929 -2.534 2.558 1.00 0.00 H new ATOM 0 HD2 PHE A1612 6.024 -4.668 -0.951 1.00 0.00 H new ATOM 0 HE1 PHE A1612 3.670 -0.936 1.203 1.00 0.00 H new ATOM 0 HE2 PHE A1612 4.750 -3.075 -2.319 1.00 0.00 H new ATOM 0 HZ PHE A1612 3.572 -1.200 -1.244 1.00 0.00 H new ATOM 1556 N VAL A1613 6.273 -7.955 3.197 1.00 0.00 N ATOM 1557 CA VAL A1613 7.083 -8.918 3.903 1.00 0.00 C ATOM 1558 C VAL A1613 8.286 -9.247 3.043 1.00 0.00 C ATOM 1559 O VAL A1613 8.159 -9.422 1.817 1.00 0.00 O ATOM 1560 CB VAL A1613 6.268 -10.207 4.218 1.00 0.00 C ATOM 1561 CG1 VAL A1613 7.097 -11.218 5.003 1.00 0.00 C ATOM 1562 CG2 VAL A1613 5.022 -9.850 5.004 1.00 0.00 C ATOM 0 H VAL A1613 5.491 -8.366 2.688 1.00 0.00 H new ATOM 0 HA VAL A1613 7.407 -8.497 4.855 1.00 0.00 H new ATOM 0 HB VAL A1613 5.988 -10.664 3.269 1.00 0.00 H new ATOM 0 HG11 VAL A1613 6.495 -12.104 5.204 1.00 0.00 H new ATOM 0 HG12 VAL A1613 7.974 -11.500 4.421 1.00 0.00 H new ATOM 0 HG13 VAL A1613 7.415 -10.774 5.946 1.00 0.00 H new ATOM 0 HG21 VAL A1613 4.457 -10.756 5.221 1.00 0.00 H new ATOM 0 HG22 VAL A1613 5.307 -9.368 5.939 1.00 0.00 H new ATOM 0 HG23 VAL A1613 4.405 -9.169 4.418 1.00 0.00 H new ATOM 1572 N CYS A1614 9.434 -9.290 3.663 1.00 0.00 N ATOM 1573 CA CYS A1614 10.671 -9.518 2.967 1.00 0.00 C ATOM 1574 C CYS A1614 10.753 -10.915 2.395 1.00 0.00 C ATOM 1575 O CYS A1614 10.653 -11.913 3.120 1.00 0.00 O ATOM 1576 CB CYS A1614 11.863 -9.253 3.865 1.00 0.00 C ATOM 1577 SG CYS A1614 13.461 -9.466 3.022 1.00 0.00 S ATOM 0 H CYS A1614 9.538 -9.167 4.670 1.00 0.00 H new ATOM 0 HA CYS A1614 10.695 -8.814 2.135 1.00 0.00 H new ATOM 0 HB2 CYS A1614 11.798 -8.237 4.253 1.00 0.00 H new ATOM 0 HB3 CYS A1614 11.820 -9.925 4.722 1.00 0.00 H new ATOM 1582 N ARG A1615 10.914 -10.981 1.101 1.00 0.00 N ATOM 1583 CA ARG A1615 11.062 -12.227 0.398 1.00 0.00 C ATOM 1584 C ARG A1615 12.228 -12.080 -0.580 1.00 0.00 C ATOM 1585 O ARG A1615 12.037 -11.636 -1.708 1.00 0.00 O ATOM 1586 CB ARG A1615 9.766 -12.569 -0.356 1.00 0.00 C ATOM 1587 CG ARG A1615 9.725 -13.967 -0.969 1.00 0.00 C ATOM 1588 CD ARG A1615 9.853 -15.052 0.089 1.00 0.00 C ATOM 1589 NE ARG A1615 9.711 -16.398 -0.472 1.00 0.00 N ATOM 1590 CZ ARG A1615 9.902 -17.535 0.215 1.00 0.00 C ATOM 1591 NH1 ARG A1615 10.316 -17.494 1.472 1.00 0.00 N1+ ATOM 1592 NH2 ARG A1615 9.693 -18.702 -0.373 1.00 0.00 N ATOM 0 H ARG A1615 10.947 -10.160 0.497 1.00 0.00 H new ATOM 0 HA ARG A1615 11.262 -13.037 1.100 1.00 0.00 H new ATOM 0 HB2 ARG A1615 8.926 -12.465 0.331 1.00 0.00 H new ATOM 0 HB3 ARG A1615 9.621 -11.836 -1.150 1.00 0.00 H new ATOM 0 HG2 ARG A1615 8.789 -14.098 -1.513 1.00 0.00 H new ATOM 0 HG3 ARG A1615 10.532 -14.070 -1.694 1.00 0.00 H new ATOM 0 HD2 ARG A1615 10.823 -14.966 0.579 1.00 0.00 H new ATOM 0 HD3 ARG A1615 9.094 -14.899 0.856 1.00 0.00 H new ATOM 0 HE ARG A1615 9.448 -16.477 -1.454 1.00 0.00 H new ATOM 0 HH11 ARG A1615 10.491 -16.596 1.922 1.00 0.00 H new ATOM 0 HH12 ARG A1615 10.460 -18.361 1.990 1.00 0.00 H new ATOM 0 HH21 ARG A1615 9.388 -18.736 -1.346 1.00 0.00 H new ATOM 0 HH22 ARG A1615 9.837 -19.568 0.146 1.00 0.00 H new ATOM 1606 N PRO A1616 13.455 -12.412 -0.139 1.00 0.00 N ATOM 1607 CA PRO A1616 14.688 -12.285 -0.953 1.00 0.00 C ATOM 1608 C PRO A1616 14.606 -12.962 -2.330 1.00 0.00 C ATOM 1609 O PRO A1616 15.174 -12.477 -3.305 1.00 0.00 O ATOM 1610 CB PRO A1616 15.747 -12.969 -0.091 1.00 0.00 C ATOM 1611 CG PRO A1616 15.257 -12.787 1.298 1.00 0.00 C ATOM 1612 CD PRO A1616 13.763 -12.914 1.218 1.00 0.00 C ATOM 0 HA PRO A1616 14.893 -11.240 -1.186 1.00 0.00 H new ATOM 0 HB2 PRO A1616 15.845 -14.025 -0.344 1.00 0.00 H new ATOM 0 HB3 PRO A1616 16.728 -12.515 -0.230 1.00 0.00 H new ATOM 0 HG2 PRO A1616 15.679 -13.539 1.965 1.00 0.00 H new ATOM 0 HG3 PRO A1616 15.547 -11.813 1.692 1.00 0.00 H new ATOM 0 HD2 PRO A1616 13.439 -13.946 1.349 1.00 0.00 H new ATOM 0 HD3 PRO A1616 13.267 -12.324 1.988 1.00 0.00 H new ATOM 1694 N ARG A1623 2.114 -9.811 -5.947 1.00 0.00 N ATOM 1695 CA ARG A1623 0.858 -9.086 -5.835 1.00 0.00 C ATOM 1696 C ARG A1623 0.520 -8.995 -4.349 1.00 0.00 C ATOM 1697 O ARG A1623 1.083 -9.747 -3.546 1.00 0.00 O ATOM 1698 CB ARG A1623 -0.284 -9.865 -6.545 1.00 0.00 C ATOM 1699 CG ARG A1623 -0.618 -11.180 -5.866 1.00 0.00 C ATOM 1700 CD ARG A1623 -1.905 -11.802 -6.361 1.00 0.00 C ATOM 1701 NE ARG A1623 -2.194 -13.039 -5.622 1.00 0.00 N ATOM 1702 CZ ARG A1623 -3.418 -13.541 -5.370 1.00 0.00 C ATOM 1703 NH1 ARG A1623 -4.513 -12.907 -5.781 1.00 0.00 N1+ ATOM 1704 NH2 ARG A1623 -3.531 -14.675 -4.687 1.00 0.00 N ATOM 0 HA ARG A1623 0.955 -8.102 -6.295 1.00 0.00 H new ATOM 0 HB2 ARG A1623 -1.177 -9.241 -6.575 1.00 0.00 H new ATOM 0 HB3 ARG A1623 0.004 -10.059 -7.578 1.00 0.00 H new ATOM 0 HG2 ARG A1623 0.201 -11.881 -6.026 1.00 0.00 H new ATOM 0 HG3 ARG A1623 -0.692 -11.017 -4.791 1.00 0.00 H new ATOM 0 HD2 ARG A1623 -2.727 -11.097 -6.239 1.00 0.00 H new ATOM 0 HD3 ARG A1623 -1.826 -12.018 -7.427 1.00 0.00 H new ATOM 0 HE ARG A1623 -1.395 -13.565 -5.268 1.00 0.00 H new ATOM 0 HH11 ARG A1623 -4.432 -12.029 -6.294 1.00 0.00 H new ATOM 0 HH12 ARG A1623 -5.434 -13.299 -5.583 1.00 0.00 H new ATOM 0 HH21 ARG A1623 -2.695 -15.158 -4.358 1.00 0.00 H new ATOM 0 HH22 ARG A1623 -4.454 -15.063 -4.491 1.00 0.00 H new ATOM 1718 N PRO A1624 -0.369 -8.089 -3.950 1.00 0.00 N ATOM 1719 CA PRO A1624 -0.806 -8.009 -2.574 1.00 0.00 C ATOM 1720 C PRO A1624 -1.932 -9.016 -2.287 1.00 0.00 C ATOM 1721 O PRO A1624 -2.945 -9.027 -2.959 1.00 0.00 O ATOM 1722 CB PRO A1624 -1.326 -6.576 -2.452 1.00 0.00 C ATOM 1723 CG PRO A1624 -1.783 -6.205 -3.826 1.00 0.00 C ATOM 1724 CD PRO A1624 -1.003 -7.050 -4.797 1.00 0.00 C ATOM 0 HA PRO A1624 -0.011 -8.243 -1.866 1.00 0.00 H new ATOM 0 HB2 PRO A1624 -2.145 -6.514 -1.735 1.00 0.00 H new ATOM 0 HB3 PRO A1624 -0.544 -5.902 -2.102 1.00 0.00 H new ATOM 0 HG2 PRO A1624 -2.853 -6.381 -3.936 1.00 0.00 H new ATOM 0 HG3 PRO A1624 -1.613 -5.145 -4.015 1.00 0.00 H new ATOM 0 HD2 PRO A1624 -1.654 -7.493 -5.551 1.00 0.00 H new ATOM 0 HD3 PRO A1624 -0.256 -6.459 -5.328 1.00 0.00 H new ATOM 1732 N MET A1625 -1.736 -9.879 -1.333 1.00 0.00 N ATOM 1733 CA MET A1625 -2.783 -10.816 -0.951 1.00 0.00 C ATOM 1734 C MET A1625 -3.547 -10.260 0.227 1.00 0.00 C ATOM 1735 O MET A1625 -2.947 -9.672 1.143 1.00 0.00 O ATOM 1736 CB MET A1625 -2.228 -12.213 -0.638 1.00 0.00 C ATOM 1737 CG MET A1625 -1.611 -12.912 -1.843 1.00 0.00 C ATOM 1738 SD MET A1625 -1.063 -14.606 -1.498 1.00 0.00 S ATOM 1739 CE MET A1625 -2.620 -15.406 -1.100 1.00 0.00 C ATOM 0 H MET A1625 -0.870 -9.963 -0.800 1.00 0.00 H new ATOM 0 HA MET A1625 -3.458 -10.936 -1.799 1.00 0.00 H new ATOM 0 HB2 MET A1625 -1.475 -12.128 0.146 1.00 0.00 H new ATOM 0 HB3 MET A1625 -3.032 -12.833 -0.242 1.00 0.00 H new ATOM 0 HG2 MET A1625 -2.340 -12.933 -2.653 1.00 0.00 H new ATOM 0 HG3 MET A1625 -0.760 -12.328 -2.195 1.00 0.00 H new ATOM 0 HE1 MET A1625 -2.504 -16.487 -1.179 1.00 0.00 H new ATOM 0 HE2 MET A1625 -2.913 -15.146 -0.083 1.00 0.00 H new ATOM 0 HE3 MET A1625 -3.389 -15.072 -1.796 1.00 0.00 H new ATOM 1749 N LEU A1626 -4.844 -10.429 0.207 1.00 0.00 N ATOM 1750 CA LEU A1626 -5.717 -9.878 1.218 1.00 0.00 C ATOM 1751 C LEU A1626 -5.710 -10.828 2.424 1.00 0.00 C ATOM 1752 O LEU A1626 -6.138 -11.986 2.323 1.00 0.00 O ATOM 1753 CB LEU A1626 -7.134 -9.733 0.624 1.00 0.00 C ATOM 1754 CG LEU A1626 -8.009 -8.571 1.136 1.00 0.00 C ATOM 1755 CD1 LEU A1626 -9.349 -8.571 0.422 1.00 0.00 C ATOM 1756 CD2 LEU A1626 -8.205 -8.614 2.644 1.00 0.00 C ATOM 0 H LEU A1626 -5.331 -10.957 -0.517 1.00 0.00 H new ATOM 0 HA LEU A1626 -5.381 -8.893 1.543 1.00 0.00 H new ATOM 0 HB2 LEU A1626 -7.036 -9.628 -0.457 1.00 0.00 H new ATOM 0 HB3 LEU A1626 -7.671 -10.664 0.807 1.00 0.00 H new ATOM 0 HG LEU A1626 -7.482 -7.643 0.912 1.00 0.00 H new ATOM 0 HD11 LEU A1626 -9.958 -7.746 0.792 1.00 0.00 H new ATOM 0 HD12 LEU A1626 -9.190 -8.453 -0.650 1.00 0.00 H new ATOM 0 HD13 LEU A1626 -9.862 -9.514 0.611 1.00 0.00 H new ATOM 0 HD21 LEU A1626 -8.828 -7.775 2.954 1.00 0.00 H new ATOM 0 HD22 LEU A1626 -8.692 -9.549 2.921 1.00 0.00 H new ATOM 0 HD23 LEU A1626 -7.236 -8.549 3.139 1.00 0.00 H new ATOM 1768 N ILE A1627 -5.199 -10.349 3.537 1.00 0.00 N ATOM 1769 CA ILE A1627 -5.038 -11.158 4.735 1.00 0.00 C ATOM 1770 C ILE A1627 -6.235 -11.033 5.662 1.00 0.00 C ATOM 1771 O ILE A1627 -6.846 -12.031 6.045 1.00 0.00 O ATOM 1772 CB ILE A1627 -3.741 -10.764 5.501 1.00 0.00 C ATOM 1773 CG1 ILE A1627 -2.513 -10.990 4.620 1.00 0.00 C ATOM 1774 CG2 ILE A1627 -3.603 -11.533 6.812 1.00 0.00 C ATOM 1775 CD1 ILE A1627 -2.316 -12.431 4.182 1.00 0.00 C ATOM 0 H ILE A1627 -4.881 -9.385 3.641 1.00 0.00 H new ATOM 0 HA ILE A1627 -4.962 -12.196 4.411 1.00 0.00 H new ATOM 0 HB ILE A1627 -3.812 -9.704 5.746 1.00 0.00 H new ATOM 0 HG12 ILE A1627 -2.595 -10.361 3.734 1.00 0.00 H new ATOM 0 HG13 ILE A1627 -1.626 -10.663 5.162 1.00 0.00 H new ATOM 0 HG21 ILE A1627 -2.686 -11.230 7.317 1.00 0.00 H new ATOM 0 HG22 ILE A1627 -4.458 -11.317 7.452 1.00 0.00 H new ATOM 0 HG23 ILE A1627 -3.567 -12.602 6.604 1.00 0.00 H new ATOM 0 HD11 ILE A1627 -1.423 -12.504 3.561 1.00 0.00 H new ATOM 0 HD12 ILE A1627 -2.199 -13.066 5.061 1.00 0.00 H new ATOM 0 HD13 ILE A1627 -3.184 -12.759 3.610 1.00 0.00 H new ATOM 1787 N SER A1628 -6.593 -9.833 5.994 1.00 0.00 N ATOM 1788 CA SER A1628 -7.658 -9.622 6.920 1.00 0.00 C ATOM 1789 C SER A1628 -8.524 -8.492 6.419 1.00 0.00 C ATOM 1790 O SER A1628 -8.020 -7.520 5.821 1.00 0.00 O ATOM 1791 CB SER A1628 -7.094 -9.331 8.324 1.00 0.00 C ATOM 1792 OG SER A1628 -8.124 -9.243 9.297 1.00 0.00 O ATOM 0 H SER A1628 -6.161 -8.982 5.635 1.00 0.00 H new ATOM 0 HA SER A1628 -8.271 -10.520 6.999 1.00 0.00 H new ATOM 0 HB2 SER A1628 -6.394 -10.118 8.605 1.00 0.00 H new ATOM 0 HB3 SER A1628 -6.532 -8.397 8.304 1.00 0.00 H new ATOM 0 HG SER A1628 -7.730 -9.059 10.175 1.00 0.00 H new ATOM 1798 N LEU A1629 -9.800 -8.630 6.629 1.00 0.00 N ATOM 1799 CA LEU A1629 -10.771 -7.695 6.170 1.00 0.00 C ATOM 1800 C LEU A1629 -11.524 -7.211 7.405 1.00 0.00 C ATOM 1801 O LEU A1629 -12.440 -7.889 7.876 1.00 0.00 O ATOM 1802 CB LEU A1629 -11.753 -8.440 5.214 1.00 0.00 C ATOM 1803 CG LEU A1629 -12.612 -7.617 4.214 1.00 0.00 C ATOM 1804 CD1 LEU A1629 -13.399 -6.490 4.862 1.00 0.00 C ATOM 1805 CD2 LEU A1629 -11.773 -7.120 3.061 1.00 0.00 C ATOM 0 H LEU A1629 -10.199 -9.418 7.138 1.00 0.00 H new ATOM 0 HA LEU A1629 -10.319 -6.858 5.638 1.00 0.00 H new ATOM 0 HB2 LEU A1629 -11.167 -9.153 4.633 1.00 0.00 H new ATOM 0 HB3 LEU A1629 -12.437 -9.020 5.834 1.00 0.00 H new ATOM 0 HG LEU A1629 -13.363 -8.305 3.825 1.00 0.00 H new ATOM 0 HD11 LEU A1629 -13.973 -5.962 4.100 1.00 0.00 H new ATOM 0 HD12 LEU A1629 -14.079 -6.903 5.608 1.00 0.00 H new ATOM 0 HD13 LEU A1629 -12.711 -5.796 5.344 1.00 0.00 H new ATOM 0 HD21 LEU A1629 -12.398 -6.547 2.376 1.00 0.00 H new ATOM 0 HD22 LEU A1629 -10.973 -6.484 3.441 1.00 0.00 H new ATOM 0 HD23 LEU A1629 -11.341 -7.970 2.533 1.00 0.00 H new ATOM 1817 N ASP A1630 -11.127 -6.093 7.959 1.00 0.00 N ATOM 1818 CA ASP A1630 -11.857 -5.558 9.084 1.00 0.00 C ATOM 1819 C ASP A1630 -12.792 -4.509 8.568 1.00 0.00 C ATOM 1820 O ASP A1630 -12.387 -3.389 8.276 1.00 0.00 O ATOM 1821 CB ASP A1630 -10.947 -4.960 10.153 1.00 0.00 C ATOM 1822 CG ASP A1630 -11.717 -4.611 11.417 1.00 0.00 C ATOM 1823 OD1 ASP A1630 -12.453 -3.616 11.435 1.00 0.00 O ATOM 1824 OD2 ASP A1630 -11.588 -5.345 12.428 1.00 0.00 O1- ATOM 0 H ASP A1630 -10.321 -5.545 7.659 1.00 0.00 H new ATOM 0 HA ASP A1630 -12.397 -6.375 9.563 1.00 0.00 H new ATOM 0 HB2 ASP A1630 -10.154 -5.668 10.394 1.00 0.00 H new ATOM 0 HB3 ASP A1630 -10.466 -4.064 9.761 1.00 0.00 H new ATOM 1829 N LYS A1631 -14.024 -4.871 8.417 1.00 0.00 N ATOM 1830 CA LYS A1631 -15.012 -3.984 7.852 1.00 0.00 C ATOM 1831 C LYS A1631 -15.594 -3.044 8.925 1.00 0.00 C ATOM 1832 O LYS A1631 -16.209 -2.032 8.607 1.00 0.00 O ATOM 1833 CB LYS A1631 -16.111 -4.827 7.189 1.00 0.00 C ATOM 1834 CG LYS A1631 -17.190 -4.041 6.451 1.00 0.00 C ATOM 1835 CD LYS A1631 -18.233 -4.965 5.827 1.00 0.00 C ATOM 1836 CE LYS A1631 -18.892 -5.847 6.876 1.00 0.00 C ATOM 1837 NZ LYS A1631 -19.978 -6.669 6.323 1.00 0.00 N1+ ATOM 0 H LYS A1631 -14.383 -5.789 8.679 1.00 0.00 H new ATOM 0 HA LYS A1631 -14.543 -3.349 7.100 1.00 0.00 H new ATOM 0 HB2 LYS A1631 -15.642 -5.514 6.485 1.00 0.00 H new ATOM 0 HB3 LYS A1631 -16.590 -5.435 7.956 1.00 0.00 H new ATOM 0 HG2 LYS A1631 -17.679 -3.355 7.143 1.00 0.00 H new ATOM 0 HG3 LYS A1631 -16.729 -3.433 5.672 1.00 0.00 H new ATOM 0 HD2 LYS A1631 -18.993 -4.369 5.321 1.00 0.00 H new ATOM 0 HD3 LYS A1631 -17.761 -5.590 5.069 1.00 0.00 H new ATOM 0 HE2 LYS A1631 -18.140 -6.498 7.322 1.00 0.00 H new ATOM 0 HE3 LYS A1631 -19.287 -5.221 7.676 1.00 0.00 H new ATOM 0 HZ1 LYS A1631 -20.393 -7.251 7.079 1.00 0.00 H new ATOM 0 HZ2 LYS A1631 -20.711 -6.051 5.920 1.00 0.00 H new ATOM 0 HZ3 LYS A1631 -19.600 -7.288 5.578 1.00 0.00 H new ATOM 1851 N GLN A1632 -15.336 -3.349 10.183 1.00 0.00 N ATOM 1852 CA GLN A1632 -15.924 -2.592 11.286 1.00 0.00 C ATOM 1853 C GLN A1632 -15.157 -1.314 11.588 1.00 0.00 C ATOM 1854 O GLN A1632 -15.761 -0.273 11.859 1.00 0.00 O ATOM 1855 CB GLN A1632 -16.052 -3.450 12.534 1.00 0.00 C ATOM 1856 CG GLN A1632 -16.972 -4.645 12.359 1.00 0.00 C ATOM 1857 CD GLN A1632 -18.396 -4.266 11.971 1.00 0.00 C ATOM 1858 OE1 GLN A1632 -18.903 -3.192 12.327 1.00 0.00 O ATOM 1859 NE2 GLN A1632 -19.048 -5.132 11.247 1.00 0.00 N ATOM 0 H GLN A1632 -14.725 -4.113 10.472 1.00 0.00 H new ATOM 0 HA GLN A1632 -16.923 -2.298 10.964 1.00 0.00 H new ATOM 0 HB2 GLN A1632 -15.063 -3.803 12.825 1.00 0.00 H new ATOM 0 HB3 GLN A1632 -16.423 -2.833 13.352 1.00 0.00 H new ATOM 0 HG2 GLN A1632 -16.559 -5.302 11.594 1.00 0.00 H new ATOM 0 HG3 GLN A1632 -16.997 -5.213 13.289 1.00 0.00 H new ATOM 0 HE21 GLN A1632 -18.601 -6.006 10.972 1.00 0.00 H new ATOM 0 HE22 GLN A1632 -20.006 -4.935 10.956 1.00 0.00 H new ATOM 1868 N THR A1633 -13.847 -1.393 11.582 1.00 0.00 N ATOM 1869 CA THR A1633 -13.031 -0.217 11.778 1.00 0.00 C ATOM 1870 C THR A1633 -12.486 0.257 10.447 1.00 0.00 C ATOM 1871 O THR A1633 -11.750 1.253 10.351 1.00 0.00 O ATOM 1872 CB THR A1633 -11.889 -0.441 12.796 1.00 0.00 C ATOM 1873 OG1 THR A1633 -11.113 -1.602 12.444 1.00 0.00 O ATOM 1874 CG2 THR A1633 -12.443 -0.608 14.199 1.00 0.00 C ATOM 0 H THR A1633 -13.324 -2.258 11.444 1.00 0.00 H new ATOM 0 HA THR A1633 -13.670 0.556 12.204 1.00 0.00 H new ATOM 0 HB THR A1633 -11.245 0.438 12.771 1.00 0.00 H new ATOM 0 HG1 THR A1633 -11.696 -2.390 12.418 1.00 0.00 H new ATOM 0 HG21 THR A1633 -11.622 -0.764 14.898 1.00 0.00 H new ATOM 0 HG22 THR A1633 -12.994 0.289 14.482 1.00 0.00 H new ATOM 0 HG23 THR A1633 -13.111 -1.469 14.226 1.00 0.00 H new ATOM 1882 N CYS A1634 -12.873 -0.508 9.420 1.00 0.00 N ATOM 1883 CA CYS A1634 -12.586 -0.242 8.029 1.00 0.00 C ATOM 1884 C CYS A1634 -11.100 -0.287 7.750 1.00 0.00 C ATOM 1885 O CYS A1634 -10.494 0.710 7.410 1.00 0.00 O ATOM 1886 CB CYS A1634 -13.158 1.101 7.623 1.00 0.00 C ATOM 1887 SG CYS A1634 -14.909 1.328 8.020 1.00 0.00 S ATOM 0 H CYS A1634 -13.416 -1.361 9.554 1.00 0.00 H new ATOM 0 HA CYS A1634 -13.059 -1.024 7.435 1.00 0.00 H new ATOM 0 HB2 CYS A1634 -12.584 1.888 8.112 1.00 0.00 H new ATOM 0 HB3 CYS A1634 -13.023 1.228 6.549 1.00 0.00 H new ATOM 1892 N THR A1635 -10.506 -1.421 7.923 1.00 0.00 N ATOM 1893 CA THR A1635 -9.104 -1.563 7.666 1.00 0.00 C ATOM 1894 C THR A1635 -8.832 -2.879 6.946 1.00 0.00 C ATOM 1895 O THR A1635 -9.158 -3.961 7.445 1.00 0.00 O ATOM 1896 CB THR A1635 -8.295 -1.465 8.979 1.00 0.00 C ATOM 1897 OG1 THR A1635 -8.650 -0.234 9.642 1.00 0.00 O ATOM 1898 CG2 THR A1635 -6.802 -1.448 8.693 1.00 0.00 C ATOM 0 H THR A1635 -10.970 -2.271 8.244 1.00 0.00 H new ATOM 0 HA THR A1635 -8.782 -0.748 7.018 1.00 0.00 H new ATOM 0 HB THR A1635 -8.524 -2.329 9.603 1.00 0.00 H new ATOM 0 HG1 THR A1635 -8.146 -0.156 10.479 1.00 0.00 H new ATOM 0 HG21 THR A1635 -6.252 -1.379 9.632 1.00 0.00 H new ATOM 0 HG22 THR A1635 -6.520 -2.365 8.175 1.00 0.00 H new ATOM 0 HG23 THR A1635 -6.561 -0.589 8.067 1.00 0.00 H new ATOM 1906 N LEU A1636 -8.299 -2.776 5.757 1.00 0.00 N ATOM 1907 CA LEU A1636 -7.962 -3.941 4.981 1.00 0.00 C ATOM 1908 C LEU A1636 -6.481 -4.186 5.056 1.00 0.00 C ATOM 1909 O LEU A1636 -5.681 -3.251 4.951 1.00 0.00 O ATOM 1910 CB LEU A1636 -8.408 -3.828 3.511 1.00 0.00 C ATOM 1911 CG LEU A1636 -9.923 -3.875 3.216 1.00 0.00 C ATOM 1912 CD1 LEU A1636 -10.658 -2.630 3.692 1.00 0.00 C ATOM 1913 CD2 LEU A1636 -10.177 -4.140 1.739 1.00 0.00 C ATOM 0 H LEU A1636 -8.087 -1.888 5.301 1.00 0.00 H new ATOM 0 HA LEU A1636 -8.503 -4.784 5.409 1.00 0.00 H new ATOM 0 HB2 LEU A1636 -8.018 -2.891 3.113 1.00 0.00 H new ATOM 0 HB3 LEU A1636 -7.932 -4.635 2.953 1.00 0.00 H new ATOM 0 HG LEU A1636 -10.331 -4.706 3.791 1.00 0.00 H new ATOM 0 HD11 LEU A1636 -11.718 -2.721 3.457 1.00 0.00 H new ATOM 0 HD12 LEU A1636 -10.533 -2.523 4.770 1.00 0.00 H new ATOM 0 HD13 LEU A1636 -10.250 -1.752 3.191 1.00 0.00 H new ATOM 0 HD21 LEU A1636 -11.251 -4.169 1.554 1.00 0.00 H new ATOM 0 HD22 LEU A1636 -9.728 -3.345 1.144 1.00 0.00 H new ATOM 0 HD23 LEU A1636 -9.735 -5.096 1.460 1.00 0.00 H new ATOM 1925 N PHE A1637 -6.118 -5.419 5.265 1.00 0.00 N ATOM 1926 CA PHE A1637 -4.730 -5.793 5.383 1.00 0.00 C ATOM 1927 C PHE A1637 -4.278 -6.531 4.137 1.00 0.00 C ATOM 1928 O PHE A1637 -4.793 -7.612 3.821 1.00 0.00 O ATOM 1929 CB PHE A1637 -4.507 -6.658 6.634 1.00 0.00 C ATOM 1930 CG PHE A1637 -4.799 -5.952 7.940 1.00 0.00 C ATOM 1931 CD1 PHE A1637 -6.091 -5.898 8.447 1.00 0.00 C ATOM 1932 CD2 PHE A1637 -3.780 -5.351 8.661 1.00 0.00 C ATOM 1933 CE1 PHE A1637 -6.357 -5.262 9.641 1.00 0.00 C ATOM 1934 CE2 PHE A1637 -4.043 -4.712 9.855 1.00 0.00 C ATOM 1935 CZ PHE A1637 -5.332 -4.667 10.345 1.00 0.00 C ATOM 0 H PHE A1637 -6.772 -6.196 5.359 1.00 0.00 H new ATOM 0 HA PHE A1637 -4.134 -4.886 5.486 1.00 0.00 H new ATOM 0 HB2 PHE A1637 -5.137 -7.545 6.565 1.00 0.00 H new ATOM 0 HB3 PHE A1637 -3.473 -7.002 6.644 1.00 0.00 H new ATOM 0 HD1 PHE A1637 -6.898 -6.361 7.898 1.00 0.00 H new ATOM 0 HD2 PHE A1637 -2.768 -5.383 8.284 1.00 0.00 H new ATOM 0 HE1 PHE A1637 -7.366 -5.230 10.024 1.00 0.00 H new ATOM 0 HE2 PHE A1637 -3.239 -4.247 10.407 1.00 0.00 H new ATOM 0 HZ PHE A1637 -5.538 -4.166 11.279 1.00 0.00 H new ATOM 1945 N PHE A1638 -3.344 -5.945 3.440 1.00 0.00 N ATOM 1946 CA PHE A1638 -2.788 -6.501 2.222 1.00 0.00 C ATOM 1947 C PHE A1638 -1.335 -6.871 2.463 1.00 0.00 C ATOM 1948 O PHE A1638 -0.618 -6.158 3.161 1.00 0.00 O ATOM 1949 CB PHE A1638 -2.873 -5.490 1.062 1.00 0.00 C ATOM 1950 CG PHE A1638 -4.265 -5.070 0.691 1.00 0.00 C ATOM 1951 CD1 PHE A1638 -5.071 -5.894 -0.077 1.00 0.00 C ATOM 1952 CD2 PHE A1638 -4.764 -3.841 1.097 1.00 0.00 C ATOM 1953 CE1 PHE A1638 -6.346 -5.504 -0.431 1.00 0.00 C ATOM 1954 CE2 PHE A1638 -6.039 -3.446 0.747 1.00 0.00 C ATOM 1955 CZ PHE A1638 -6.831 -4.279 -0.019 1.00 0.00 C ATOM 0 H PHE A1638 -2.935 -5.048 3.702 1.00 0.00 H new ATOM 0 HA PHE A1638 -3.364 -7.385 1.949 1.00 0.00 H new ATOM 0 HB2 PHE A1638 -2.301 -4.602 1.330 1.00 0.00 H new ATOM 0 HB3 PHE A1638 -2.394 -5.925 0.185 1.00 0.00 H new ATOM 0 HD1 PHE A1638 -4.697 -6.853 -0.403 1.00 0.00 H new ATOM 0 HD2 PHE A1638 -4.147 -3.186 1.694 1.00 0.00 H new ATOM 0 HE1 PHE A1638 -6.964 -6.156 -1.030 1.00 0.00 H new ATOM 0 HE2 PHE A1638 -6.417 -2.488 1.071 1.00 0.00 H new ATOM 0 HZ PHE A1638 -7.829 -3.972 -0.295 1.00 0.00 H new ATOM 1965 N SER A1639 -0.910 -7.967 1.903 1.00 0.00 N ATOM 1966 CA SER A1639 0.432 -8.428 2.077 1.00 0.00 C ATOM 1967 C SER A1639 1.150 -8.541 0.736 1.00 0.00 C ATOM 1968 O SER A1639 0.650 -9.162 -0.197 1.00 0.00 O ATOM 1969 CB SER A1639 0.403 -9.769 2.792 1.00 0.00 C ATOM 1970 OG SER A1639 -0.450 -10.698 2.116 1.00 0.00 O ATOM 0 H SER A1639 -1.487 -8.565 1.312 1.00 0.00 H new ATOM 0 HA SER A1639 0.985 -7.708 2.680 1.00 0.00 H new ATOM 0 HB2 SER A1639 1.413 -10.175 2.850 1.00 0.00 H new ATOM 0 HB3 SER A1639 0.055 -9.631 3.816 1.00 0.00 H new ATOM 0 HG SER A1639 -1.324 -10.284 1.958 1.00 0.00 H new ATOM 1976 N TRP A1640 2.288 -7.942 0.646 1.00 0.00 N ATOM 1977 CA TRP A1640 3.090 -7.974 -0.542 1.00 0.00 C ATOM 1978 C TRP A1640 4.398 -8.633 -0.138 1.00 0.00 C ATOM 1979 O TRP A1640 4.792 -8.535 1.015 1.00 0.00 O ATOM 1980 CB TRP A1640 3.319 -6.528 -1.015 1.00 0.00 C ATOM 1981 CG TRP A1640 3.954 -6.362 -2.375 1.00 0.00 C ATOM 1982 CD1 TRP A1640 5.236 -6.657 -2.734 1.00 0.00 C ATOM 1983 CD2 TRP A1640 3.341 -5.791 -3.536 1.00 0.00 C ATOM 1984 NE1 TRP A1640 5.446 -6.339 -4.048 1.00 0.00 N ATOM 1985 CE2 TRP A1640 4.299 -5.801 -4.564 1.00 0.00 C ATOM 1986 CE3 TRP A1640 2.070 -5.285 -3.809 1.00 0.00 C ATOM 1987 CZ2 TRP A1640 4.026 -5.321 -5.841 1.00 0.00 C ATOM 1988 CZ3 TRP A1640 1.803 -4.809 -5.076 1.00 0.00 C ATOM 1989 CH2 TRP A1640 2.776 -4.832 -6.077 1.00 0.00 C ATOM 0 H TRP A1640 2.700 -7.404 1.408 1.00 0.00 H new ATOM 0 HA TRP A1640 2.622 -8.523 -1.359 1.00 0.00 H new ATOM 0 HB2 TRP A1640 2.358 -6.014 -1.021 1.00 0.00 H new ATOM 0 HB3 TRP A1640 3.946 -6.023 -0.280 1.00 0.00 H new ATOM 0 HD1 TRP A1640 5.979 -7.081 -2.075 1.00 0.00 H new ATOM 0 HE1 TRP A1640 6.317 -6.480 -4.560 1.00 0.00 H new ATOM 0 HE3 TRP A1640 1.309 -5.266 -3.043 1.00 0.00 H new ATOM 0 HZ2 TRP A1640 4.777 -5.335 -6.617 1.00 0.00 H new ATOM 0 HZ3 TRP A1640 0.824 -4.411 -5.298 1.00 0.00 H new ATOM 0 HH2 TRP A1640 2.533 -4.454 -7.059 1.00 0.00 H new ATOM 2000 N HIS A1641 5.022 -9.353 -1.021 1.00 0.00 N ATOM 2001 CA HIS A1641 6.285 -9.993 -0.709 1.00 0.00 C ATOM 2002 C HIS A1641 7.372 -9.467 -1.623 1.00 0.00 C ATOM 2003 O HIS A1641 7.336 -9.682 -2.828 1.00 0.00 O ATOM 2004 CB HIS A1641 6.164 -11.525 -0.781 1.00 0.00 C ATOM 2005 CG HIS A1641 5.271 -12.106 0.288 1.00 0.00 C ATOM 2006 ND1 HIS A1641 5.750 -12.761 1.392 1.00 0.00 N ATOM 2007 CD2 HIS A1641 3.918 -12.120 0.415 1.00 0.00 C ATOM 2008 CE1 HIS A1641 4.745 -13.151 2.145 1.00 0.00 C ATOM 2009 NE2 HIS A1641 3.626 -12.775 1.578 1.00 0.00 N ATOM 0 H HIS A1641 4.684 -9.518 -1.969 1.00 0.00 H new ATOM 0 HA HIS A1641 6.560 -9.748 0.317 1.00 0.00 H new ATOM 0 HB2 HIS A1641 5.776 -11.806 -1.760 1.00 0.00 H new ATOM 0 HB3 HIS A1641 7.157 -11.965 -0.693 1.00 0.00 H new ATOM 0 HD2 HIS A1641 3.206 -11.693 -0.275 1.00 0.00 H new ATOM 0 HE1 HIS A1641 4.829 -13.692 3.076 1.00 0.00 H new ATOM 0 HE2 HIS A1641 2.689 -12.944 1.945 1.00 0.00 H new ATOM 2018 N THR A1642 8.321 -8.760 -1.054 1.00 0.00 N ATOM 2019 CA THR A1642 9.354 -8.116 -1.834 1.00 0.00 C ATOM 2020 C THR A1642 10.712 -8.237 -1.114 1.00 0.00 C ATOM 2021 O THR A1642 10.773 -8.296 0.119 1.00 0.00 O ATOM 2022 CB THR A1642 8.989 -6.603 -2.070 1.00 0.00 C ATOM 2023 OG1 THR A1642 9.936 -5.983 -2.938 1.00 0.00 O ATOM 2024 CG2 THR A1642 8.937 -5.827 -0.763 1.00 0.00 C ATOM 0 H THR A1642 8.399 -8.615 -0.047 1.00 0.00 H new ATOM 0 HA THR A1642 9.428 -8.610 -2.803 1.00 0.00 H new ATOM 0 HB THR A1642 8.001 -6.584 -2.530 1.00 0.00 H new ATOM 0 HG1 THR A1642 9.463 -5.512 -3.655 1.00 0.00 H new ATOM 0 HG21 THR A1642 8.682 -4.787 -0.967 1.00 0.00 H new ATOM 0 HG22 THR A1642 8.182 -6.264 -0.110 1.00 0.00 H new ATOM 0 HG23 THR A1642 9.910 -5.873 -0.274 1.00 0.00 H new ATOM 2032 N PRO A1643 11.816 -8.341 -1.882 1.00 0.00 N ATOM 2033 CA PRO A1643 13.183 -8.390 -1.333 1.00 0.00 C ATOM 2034 C PRO A1643 13.683 -7.001 -0.904 1.00 0.00 C ATOM 2035 O PRO A1643 14.768 -6.858 -0.339 1.00 0.00 O ATOM 2036 CB PRO A1643 14.005 -8.911 -2.516 1.00 0.00 C ATOM 2037 CG PRO A1643 13.276 -8.429 -3.720 1.00 0.00 C ATOM 2038 CD PRO A1643 11.819 -8.478 -3.364 1.00 0.00 C ATOM 0 HA PRO A1643 13.251 -9.007 -0.437 1.00 0.00 H new ATOM 0 HB2 PRO A1643 15.025 -8.527 -2.490 1.00 0.00 H new ATOM 0 HB3 PRO A1643 14.073 -9.999 -2.503 1.00 0.00 H new ATOM 0 HG2 PRO A1643 13.581 -7.416 -3.982 1.00 0.00 H new ATOM 0 HG3 PRO A1643 13.489 -9.059 -4.584 1.00 0.00 H new ATOM 0 HD2 PRO A1643 11.262 -7.672 -3.842 1.00 0.00 H new ATOM 0 HD3 PRO A1643 11.360 -9.414 -3.681 1.00 0.00 H new ATOM 2046 N LEU A1644 12.872 -5.995 -1.169 1.00 0.00 N ATOM 2047 CA LEU A1644 13.179 -4.605 -0.824 1.00 0.00 C ATOM 2048 C LEU A1644 12.938 -4.335 0.656 1.00 0.00 C ATOM 2049 O LEU A1644 13.275 -3.279 1.164 1.00 0.00 O ATOM 2050 CB LEU A1644 12.311 -3.670 -1.666 1.00 0.00 C ATOM 2051 CG LEU A1644 12.573 -3.687 -3.171 1.00 0.00 C ATOM 2052 CD1 LEU A1644 11.448 -2.986 -3.900 1.00 0.00 C ATOM 2053 CD2 LEU A1644 13.888 -2.990 -3.481 1.00 0.00 C ATOM 0 H LEU A1644 11.972 -6.112 -1.634 1.00 0.00 H new ATOM 0 HA LEU A1644 14.234 -4.425 -1.033 1.00 0.00 H new ATOM 0 HB2 LEU A1644 11.265 -3.926 -1.496 1.00 0.00 H new ATOM 0 HB3 LEU A1644 12.452 -2.652 -1.304 1.00 0.00 H new ATOM 0 HG LEU A1644 12.629 -4.724 -3.504 1.00 0.00 H new ATOM 0 HD11 LEU A1644 11.643 -3.003 -4.972 1.00 0.00 H new ATOM 0 HD12 LEU A1644 10.507 -3.497 -3.694 1.00 0.00 H new ATOM 0 HD13 LEU A1644 11.382 -1.953 -3.559 1.00 0.00 H new ATOM 0 HD21 LEU A1644 14.065 -3.008 -4.556 1.00 0.00 H new ATOM 0 HD22 LEU A1644 13.842 -1.956 -3.138 1.00 0.00 H new ATOM 0 HD23 LEU A1644 14.702 -3.505 -2.971 1.00 0.00 H new ATOM 2065 N ALA A1645 12.360 -5.306 1.341 1.00 0.00 N ATOM 2066 CA ALA A1645 12.037 -5.153 2.744 1.00 0.00 C ATOM 2067 C ALA A1645 13.161 -5.677 3.651 1.00 0.00 C ATOM 2068 O ALA A1645 12.964 -5.898 4.830 1.00 0.00 O ATOM 2069 CB ALA A1645 10.702 -5.811 3.058 1.00 0.00 C ATOM 0 H ALA A1645 12.105 -6.211 0.945 1.00 0.00 H new ATOM 0 HA ALA A1645 11.944 -4.087 2.953 1.00 0.00 H new ATOM 0 HB1 ALA A1645 10.475 -5.686 4.117 1.00 0.00 H new ATOM 0 HB2 ALA A1645 9.918 -5.345 2.461 1.00 0.00 H new ATOM 0 HB3 ALA A1645 10.755 -6.874 2.821 1.00 0.00 H new ATOM 2075 N CYS A1646 14.310 -5.892 3.080 1.00 0.00 N ATOM 2076 CA CYS A1646 15.497 -6.266 3.829 1.00 0.00 C ATOM 2077 C CYS A1646 16.625 -5.389 3.384 1.00 0.00 C ATOM 2078 O CYS A1646 16.573 -4.826 2.277 1.00 0.00 O ATOM 2079 CB CYS A1646 15.875 -7.741 3.611 1.00 0.00 C ATOM 2080 SG CYS A1646 14.793 -8.953 4.438 1.00 0.00 S ATOM 0 H CYS A1646 14.462 -5.815 2.074 1.00 0.00 H new ATOM 0 HA CYS A1646 15.294 -6.137 4.892 1.00 0.00 H new ATOM 0 HB2 CYS A1646 15.870 -7.946 2.540 1.00 0.00 H new ATOM 0 HB3 CYS A1646 16.896 -7.893 3.960 1.00 0.00 H new