USER MOD reduce.3.24.130724 H: found=0, std=0, add=870, rem=0, adj=31 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: A1639 SER OG : rot -120:sc= 0.795 USER MOD Set 1.2: A1641 HIS : no HE2:sc= 0.677 K(o=1.5,f=-0.62) USER MOD Set 2.1: A1633 THR OG1 : rot -53:sc= 1.18 USER MOD Set 2.2: A1635 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A1573 SER OG : rot 25:sc= 0.565 USER MOD Set 3.2: A1596 SER OG : rot -150:sc= 0.47 USER MOD Set 4.1: A1520 ASN : amide:sc= 1.64 K(o=3.6,f=0.18) USER MOD Set 4.2: A1522 SER OG : rot 96:sc= 1 USER MOD Set 4.3: A1523 THR OG1 : rot 180:sc= 0 USER MOD Set 4.4: A1525 HIS : no HD1:sc= -0.005 X(o=3.6,f=3.7) USER MOD Set 4.5: A1583 TYR OH : rot 58:sc= 1 USER MOD Set 5.1: A1517 GLN :FLIP amide:sc= -0.025 F(o=-1.3!,f=-0.061) USER MOD Set 5.2: A1530 SER OG : rot 167:sc= -0.0362 USER MOD Single : A1519 THR OG1 : rot 180:sc= 0 USER MOD Single : A1531 SER OG : rot 180:sc= 0.0936 USER MOD Single : A1533 SER OG : rot 32:sc= 1.17 USER MOD Single : A1539 THR OG1 : rot -101:sc= 0.0155 USER MOD Single : A1542 TYR OH : rot 180:sc= -0.531 USER MOD Single : A1549 TYR OH : rot 180:sc= 0 USER MOD Single : A1550 MET CE :methyl 139:sc= -0.154 (180deg=-0.594) USER MOD Single : A1551 SER OG : rot 148:sc= 0.498 USER MOD Single : A1556 ASN : amide:sc= -2.2! C(o=-2.2!,f=-3!) USER MOD Single : A1558 ASN : amide:sc= -0.201 K(o=-0.2,f=-5.5!) USER MOD Single : A1569 GLN : amide:sc= 0 X(o=0,f=-0.26) 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 : A1578 ASN : amide:sc= 0.403 K(o=0.4,f=-4.1!) USER MOD Single : A1579 LYS NZ :NH3+ 168:sc=-0.00609 (180deg=-0.129) USER MOD Single : A1586 GLN : amide:sc=-0.00292 X(o=-0.0029,f=-0.45) USER MOD Single : A1589 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1592 TYR OH : rot -126:sc= 2.1 USER MOD Single : A1593 LYS NZ :NH3+ -147:sc= 1.28 (180deg=0.99) USER MOD Single : A1605 SER OG : rot -130:sc= 0.87 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 95:sc= 0.0597 USER MOD Single : A1611 SER OG : rot 180:sc= 0 USER MOD Single : A1625 MET CE :methyl -169:sc= -0.0102 (180deg=-0.174) 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 :FLIP amide:sc= 0 F(o=-0.71,f=0) USER MOD Single : A1642 THR OG1 : rot 170:sc= 0.0656 USER MOD ----------------------------------------------------------------- ATOM 124 N CYS A1516 8.910 7.552 -1.099 1.00 0.00 N ATOM 125 CA CYS A1516 8.768 6.162 -0.676 1.00 0.00 C ATOM 126 C CYS A1516 10.082 5.436 -0.713 1.00 0.00 C ATOM 127 O CYS A1516 10.229 4.335 -1.280 1.00 0.00 O ATOM 128 CB CYS A1516 7.681 5.449 -1.437 1.00 0.00 C ATOM 129 SG CYS A1516 6.087 6.273 -1.247 1.00 0.00 S ATOM 0 HA CYS A1516 8.449 6.168 0.366 1.00 0.00 H new ATOM 0 HB2 CYS A1516 7.945 5.405 -2.494 1.00 0.00 H new ATOM 0 HB3 CYS A1516 7.604 4.420 -1.084 1.00 0.00 H new ATOM 134 N GLN A1517 11.027 6.076 -0.117 1.00 0.00 N ATOM 135 CA GLN A1517 12.326 5.572 0.068 1.00 0.00 C ATOM 136 C GLN A1517 12.807 6.110 1.387 1.00 0.00 C ATOM 137 O GLN A1517 12.690 7.306 1.652 1.00 0.00 O ATOM 138 CB GLN A1517 13.239 5.976 -1.101 1.00 0.00 C ATOM 139 CG GLN A1517 13.383 7.477 -1.338 1.00 0.00 C ATOM 140 CD GLN A1517 14.185 7.795 -2.584 1.00 0.00 C ATOM 141 OE1 GLN A1517 14.055 6.976 -3.600 1.00 0.00 O flip ATOM 142 NE2 GLN A1517 14.887 8.812 -2.647 1.00 0.00 N flip ATOM 0 H GLN A1517 10.899 7.011 0.271 1.00 0.00 H new ATOM 0 HA GLN A1517 12.338 4.482 0.084 1.00 0.00 H new ATOM 0 HB2 GLN A1517 14.230 5.557 -0.926 1.00 0.00 H new ATOM 0 HB3 GLN A1517 12.856 5.518 -2.013 1.00 0.00 H new ATOM 0 HG2 GLN A1517 12.393 7.924 -1.424 1.00 0.00 H new ATOM 0 HG3 GLN A1517 13.865 7.933 -0.473 1.00 0.00 H new ATOM 0 HE21 GLN A1517 14.966 9.428 -1.838 1.00 0.00 H new ATOM 0 HE22 GLN A1517 15.386 9.034 -3.508 1.00 0.00 H new ATOM 151 N VAL A1518 13.279 5.254 2.228 1.00 0.00 N ATOM 152 CA VAL A1518 13.691 5.669 3.541 1.00 0.00 C ATOM 153 C VAL A1518 15.112 5.228 3.776 1.00 0.00 C ATOM 154 O VAL A1518 15.477 4.078 3.484 1.00 0.00 O ATOM 155 CB VAL A1518 12.770 5.089 4.661 1.00 0.00 C ATOM 156 CG1 VAL A1518 13.129 5.681 6.014 1.00 0.00 C ATOM 157 CG2 VAL A1518 11.297 5.338 4.357 1.00 0.00 C ATOM 0 H VAL A1518 13.392 4.259 2.037 1.00 0.00 H new ATOM 0 HA VAL A1518 13.615 6.755 3.587 1.00 0.00 H new ATOM 0 HB VAL A1518 12.933 4.012 4.692 1.00 0.00 H new ATOM 0 HG11 VAL A1518 12.475 5.263 6.779 1.00 0.00 H new ATOM 0 HG12 VAL A1518 14.165 5.442 6.252 1.00 0.00 H new ATOM 0 HG13 VAL A1518 13.005 6.763 5.982 1.00 0.00 H new ATOM 0 HG21 VAL A1518 10.685 4.921 5.157 1.00 0.00 H new ATOM 0 HG22 VAL A1518 11.117 6.410 4.283 1.00 0.00 H new ATOM 0 HG23 VAL A1518 11.035 4.860 3.413 1.00 0.00 H new ATOM 167 N THR A1519 15.911 6.125 4.265 1.00 0.00 N ATOM 168 CA THR A1519 17.276 5.829 4.537 1.00 0.00 C ATOM 169 C THR A1519 17.389 5.264 5.945 1.00 0.00 C ATOM 170 O THR A1519 16.925 5.879 6.909 1.00 0.00 O ATOM 171 CB THR A1519 18.144 7.092 4.397 1.00 0.00 C ATOM 172 OG1 THR A1519 17.883 7.692 3.110 1.00 0.00 O ATOM 173 CG2 THR A1519 19.620 6.735 4.489 1.00 0.00 C ATOM 0 H THR A1519 15.632 7.081 4.485 1.00 0.00 H new ATOM 0 HA THR A1519 17.635 5.094 3.817 1.00 0.00 H new ATOM 0 HB THR A1519 17.899 7.787 5.200 1.00 0.00 H new ATOM 0 HG1 THR A1519 18.429 8.499 3.009 1.00 0.00 H new ATOM 0 HG21 THR A1519 20.220 7.639 4.388 1.00 0.00 H new ATOM 0 HG22 THR A1519 19.823 6.271 5.454 1.00 0.00 H new ATOM 0 HG23 THR A1519 19.876 6.039 3.691 1.00 0.00 H new ATOM 181 N ASN A1520 17.932 4.080 6.048 1.00 0.00 N ATOM 182 CA ASN A1520 18.136 3.455 7.329 1.00 0.00 C ATOM 183 C ASN A1520 19.559 3.731 7.789 1.00 0.00 C ATOM 184 O ASN A1520 20.511 3.121 7.274 1.00 0.00 O ATOM 185 CB ASN A1520 17.898 1.948 7.229 1.00 0.00 C ATOM 186 CG ASN A1520 18.071 1.234 8.559 1.00 0.00 C ATOM 187 OD1 ASN A1520 17.852 1.809 9.625 1.00 0.00 O ATOM 188 ND2 ASN A1520 18.458 -0.009 8.508 1.00 0.00 N ATOM 0 H ASN A1520 18.244 3.524 5.252 1.00 0.00 H new ATOM 0 HA ASN A1520 17.430 3.865 8.051 1.00 0.00 H new ATOM 0 HB2 ASN A1520 16.890 1.768 6.854 1.00 0.00 H new ATOM 0 HB3 ASN A1520 18.590 1.523 6.501 1.00 0.00 H new ATOM 0 HD21 ASN A1520 18.589 -0.538 9.370 1.00 0.00 H new ATOM 0 HD22 ASN A1520 18.630 -0.453 7.606 1.00 0.00 H new ATOM 195 N PRO A1521 19.737 4.637 8.776 1.00 0.00 N ATOM 196 CA PRO A1521 21.064 5.063 9.256 1.00 0.00 C ATOM 197 C PRO A1521 21.793 3.984 10.047 1.00 0.00 C ATOM 198 O PRO A1521 22.929 4.173 10.464 1.00 0.00 O ATOM 199 CB PRO A1521 20.763 6.266 10.168 1.00 0.00 C ATOM 200 CG PRO A1521 19.334 6.609 9.918 1.00 0.00 C ATOM 201 CD PRO A1521 18.668 5.338 9.507 1.00 0.00 C ATOM 0 HA PRO A1521 21.722 5.293 8.418 1.00 0.00 H new ATOM 0 HB2 PRO A1521 20.929 6.015 11.216 1.00 0.00 H new ATOM 0 HB3 PRO A1521 21.415 7.108 9.935 1.00 0.00 H new ATOM 0 HG2 PRO A1521 18.869 7.020 10.814 1.00 0.00 H new ATOM 0 HG3 PRO A1521 19.246 7.365 9.138 1.00 0.00 H new ATOM 0 HD2 PRO A1521 18.322 4.765 10.367 1.00 0.00 H new ATOM 0 HD3 PRO A1521 17.798 5.522 8.876 1.00 0.00 H new ATOM 209 N SER A1522 21.134 2.879 10.267 1.00 0.00 N ATOM 210 CA SER A1522 21.723 1.773 10.958 1.00 0.00 C ATOM 211 C SER A1522 22.821 1.144 10.088 1.00 0.00 C ATOM 212 O SER A1522 23.962 0.958 10.530 1.00 0.00 O ATOM 213 CB SER A1522 20.637 0.749 11.257 1.00 0.00 C ATOM 214 OG SER A1522 19.509 1.382 11.854 1.00 0.00 O ATOM 0 H SER A1522 20.171 2.723 9.970 1.00 0.00 H new ATOM 0 HA SER A1522 22.172 2.112 11.892 1.00 0.00 H new ATOM 0 HB2 SER A1522 20.336 0.249 10.336 1.00 0.00 H new ATOM 0 HB3 SER A1522 21.027 -0.019 11.925 1.00 0.00 H new ATOM 0 HG SER A1522 18.845 1.588 11.163 1.00 0.00 H new ATOM 220 N THR A1523 22.483 0.871 8.843 1.00 0.00 N ATOM 221 CA THR A1523 23.381 0.188 7.946 1.00 0.00 C ATOM 222 C THR A1523 23.744 0.996 6.691 1.00 0.00 C ATOM 223 O THR A1523 24.654 0.612 5.931 1.00 0.00 O ATOM 224 CB THR A1523 22.749 -1.132 7.537 1.00 0.00 C ATOM 225 OG1 THR A1523 21.366 -0.897 7.180 1.00 0.00 O ATOM 226 CG2 THR A1523 22.828 -2.144 8.671 1.00 0.00 C ATOM 0 H THR A1523 21.583 1.117 8.431 1.00 0.00 H new ATOM 0 HA THR A1523 24.315 0.035 8.486 1.00 0.00 H new ATOM 0 HB THR A1523 23.291 -1.539 6.683 1.00 0.00 H new ATOM 0 HG1 THR A1523 20.949 -1.743 6.913 1.00 0.00 H new ATOM 0 HG21 THR A1523 22.369 -3.081 8.355 1.00 0.00 H new ATOM 0 HG22 THR A1523 23.872 -2.320 8.929 1.00 0.00 H new ATOM 0 HG23 THR A1523 22.299 -1.757 9.542 1.00 0.00 H new ATOM 234 N GLY A1524 23.039 2.094 6.467 1.00 0.00 N ATOM 235 CA GLY A1524 23.300 2.913 5.305 1.00 0.00 C ATOM 236 C GLY A1524 22.591 2.389 4.076 1.00 0.00 C ATOM 237 O GLY A1524 23.054 2.563 2.958 1.00 0.00 O ATOM 0 H GLY A1524 22.290 2.432 7.071 1.00 0.00 H new ATOM 0 HA2 GLY A1524 22.978 3.936 5.502 1.00 0.00 H new ATOM 0 HA3 GLY A1524 24.373 2.947 5.118 1.00 0.00 H new ATOM 241 N HIS A1525 21.482 1.721 4.282 1.00 0.00 N ATOM 242 CA HIS A1525 20.699 1.202 3.176 1.00 0.00 C ATOM 243 C HIS A1525 19.468 2.048 2.930 1.00 0.00 C ATOM 244 O HIS A1525 18.792 2.476 3.875 1.00 0.00 O ATOM 245 CB HIS A1525 20.311 -0.275 3.372 1.00 0.00 C ATOM 246 CG HIS A1525 21.407 -1.260 3.057 1.00 0.00 C ATOM 247 ND1 HIS A1525 21.836 -2.231 3.935 1.00 0.00 N ATOM 248 CD2 HIS A1525 22.106 -1.468 1.917 1.00 0.00 C ATOM 249 CE1 HIS A1525 22.740 -2.982 3.350 1.00 0.00 C ATOM 250 NE2 HIS A1525 22.918 -2.545 2.132 1.00 0.00 N ATOM 0 H HIS A1525 21.097 1.521 5.205 1.00 0.00 H new ATOM 0 HA HIS A1525 21.337 1.254 2.294 1.00 0.00 H new ATOM 0 HB2 HIS A1525 19.997 -0.420 4.406 1.00 0.00 H new ATOM 0 HB3 HIS A1525 19.449 -0.497 2.742 1.00 0.00 H new ATOM 0 HD2 HIS A1525 22.035 -0.890 1.007 1.00 0.00 H new ATOM 0 HE1 HIS A1525 23.251 -3.820 3.800 1.00 0.00 H new ATOM 0 HE2 HIS A1525 23.562 -2.945 1.449 1.00 0.00 H new ATOM 259 N LEU A1526 19.203 2.306 1.677 1.00 0.00 N ATOM 260 CA LEU A1526 18.063 3.078 1.258 1.00 0.00 C ATOM 261 C LEU A1526 16.965 2.135 0.793 1.00 0.00 C ATOM 262 O LEU A1526 17.058 1.545 -0.287 1.00 0.00 O ATOM 263 CB LEU A1526 18.470 4.026 0.118 1.00 0.00 C ATOM 264 CG LEU A1526 17.355 4.865 -0.522 1.00 0.00 C ATOM 265 CD1 LEU A1526 16.729 5.799 0.484 1.00 0.00 C ATOM 266 CD2 LEU A1526 17.889 5.645 -1.705 1.00 0.00 C ATOM 0 H LEU A1526 19.784 1.980 0.905 1.00 0.00 H new ATOM 0 HA LEU A1526 17.694 3.674 2.093 1.00 0.00 H new ATOM 0 HB2 LEU A1526 19.230 4.708 0.499 1.00 0.00 H new ATOM 0 HB3 LEU A1526 18.939 3.431 -0.666 1.00 0.00 H new ATOM 0 HG LEU A1526 16.582 4.181 -0.874 1.00 0.00 H new ATOM 0 HD11 LEU A1526 15.943 6.380 0.001 1.00 0.00 H new ATOM 0 HD12 LEU A1526 16.301 5.219 1.302 1.00 0.00 H new ATOM 0 HD13 LEU A1526 17.490 6.474 0.877 1.00 0.00 H new ATOM 0 HD21 LEU A1526 17.084 6.234 -2.146 1.00 0.00 H new ATOM 0 HD22 LEU A1526 18.685 6.311 -1.372 1.00 0.00 H new ATOM 0 HD23 LEU A1526 18.282 4.953 -2.450 1.00 0.00 H new ATOM 278 N PHE A1527 15.948 1.981 1.602 1.00 0.00 N ATOM 279 CA PHE A1527 14.840 1.116 1.258 1.00 0.00 C ATOM 280 C PHE A1527 13.868 1.879 0.408 1.00 0.00 C ATOM 281 O PHE A1527 13.168 2.763 0.905 1.00 0.00 O ATOM 282 CB PHE A1527 14.121 0.602 2.509 1.00 0.00 C ATOM 283 CG PHE A1527 14.960 -0.261 3.390 1.00 0.00 C ATOM 284 CD1 PHE A1527 15.113 -1.606 3.110 1.00 0.00 C ATOM 285 CD2 PHE A1527 15.593 0.265 4.502 1.00 0.00 C ATOM 286 CE1 PHE A1527 15.880 -2.406 3.921 1.00 0.00 C ATOM 287 CE2 PHE A1527 16.361 -0.535 5.313 1.00 0.00 C ATOM 288 CZ PHE A1527 16.506 -1.866 5.024 1.00 0.00 C ATOM 0 H PHE A1527 15.861 2.443 2.507 1.00 0.00 H new ATOM 0 HA PHE A1527 15.232 0.257 0.714 1.00 0.00 H new ATOM 0 HB2 PHE A1527 13.768 1.456 3.087 1.00 0.00 H new ATOM 0 HB3 PHE A1527 13.240 0.039 2.201 1.00 0.00 H new ATOM 0 HD1 PHE A1527 14.625 -2.032 2.246 1.00 0.00 H new ATOM 0 HD2 PHE A1527 15.482 1.314 4.735 1.00 0.00 H new ATOM 0 HE1 PHE A1527 15.992 -3.456 3.695 1.00 0.00 H new ATOM 0 HE2 PHE A1527 16.851 -0.114 6.179 1.00 0.00 H new ATOM 0 HZ PHE A1527 17.112 -2.493 5.661 1.00 0.00 H new ATOM 298 N ASP A1528 13.832 1.577 -0.860 1.00 0.00 N ATOM 299 CA ASP A1528 12.926 2.259 -1.749 1.00 0.00 C ATOM 300 C ASP A1528 11.943 1.294 -2.353 1.00 0.00 C ATOM 301 O ASP A1528 12.259 0.118 -2.607 1.00 0.00 O ATOM 302 CB ASP A1528 13.647 3.054 -2.872 1.00 0.00 C ATOM 303 CG ASP A1528 14.228 2.207 -3.985 1.00 0.00 C ATOM 304 OD1 ASP A1528 13.519 1.939 -4.981 1.00 0.00 O ATOM 305 OD2 ASP A1528 15.406 1.804 -3.901 1.00 0.00 O1- ATOM 0 H ASP A1528 14.416 0.867 -1.302 1.00 0.00 H new ATOM 0 HA ASP A1528 12.395 2.987 -1.136 1.00 0.00 H new ATOM 0 HB2 ASP A1528 12.941 3.762 -3.306 1.00 0.00 H new ATOM 0 HB3 ASP A1528 14.450 3.639 -2.424 1.00 0.00 H new ATOM 310 N LEU A1529 10.751 1.778 -2.530 1.00 0.00 N ATOM 311 CA LEU A1529 9.684 1.062 -3.197 1.00 0.00 C ATOM 312 C LEU A1529 9.257 1.892 -4.375 1.00 0.00 C ATOM 313 O LEU A1529 8.157 1.744 -4.919 1.00 0.00 O ATOM 314 CB LEU A1529 8.499 0.844 -2.250 1.00 0.00 C ATOM 315 CG LEU A1529 8.734 -0.111 -1.078 1.00 0.00 C ATOM 316 CD1 LEU A1529 7.533 -0.112 -0.159 1.00 0.00 C ATOM 317 CD2 LEU A1529 9.001 -1.523 -1.586 1.00 0.00 C ATOM 0 H LEU A1529 10.477 2.707 -2.209 1.00 0.00 H new ATOM 0 HA LEU A1529 10.032 0.080 -3.517 1.00 0.00 H new ATOM 0 HB2 LEU A1529 8.200 1.812 -1.848 1.00 0.00 H new ATOM 0 HB3 LEU A1529 7.659 0.468 -2.834 1.00 0.00 H new ATOM 0 HG LEU A1529 9.607 0.231 -0.522 1.00 0.00 H new ATOM 0 HD11 LEU A1529 7.711 -0.795 0.672 1.00 0.00 H new ATOM 0 HD12 LEU A1529 7.370 0.894 0.227 1.00 0.00 H new ATOM 0 HD13 LEU A1529 6.652 -0.436 -0.712 1.00 0.00 H new ATOM 0 HD21 LEU A1529 9.166 -2.189 -0.739 1.00 0.00 H new ATOM 0 HD22 LEU A1529 8.142 -1.872 -2.160 1.00 0.00 H new ATOM 0 HD23 LEU A1529 9.886 -1.519 -2.223 1.00 0.00 H new ATOM 329 N SER A1530 10.165 2.746 -4.785 1.00 0.00 N ATOM 330 CA SER A1530 9.930 3.705 -5.832 1.00 0.00 C ATOM 331 C SER A1530 9.782 2.994 -7.193 1.00 0.00 C ATOM 332 O SER A1530 9.078 3.467 -8.096 1.00 0.00 O ATOM 333 CB SER A1530 11.090 4.706 -5.830 1.00 0.00 C ATOM 334 OG SER A1530 11.296 5.229 -4.509 1.00 0.00 O ATOM 0 H SER A1530 11.105 2.792 -4.391 1.00 0.00 H new ATOM 0 HA SER A1530 8.997 4.241 -5.658 1.00 0.00 H new ATOM 0 HB2 SER A1530 12.000 4.219 -6.181 1.00 0.00 H new ATOM 0 HB3 SER A1530 10.877 5.521 -6.522 1.00 0.00 H new ATOM 0 HG SER A1530 12.157 5.695 -4.472 1.00 0.00 H new ATOM 340 N SER A1531 10.394 1.834 -7.301 1.00 0.00 N ATOM 341 CA SER A1531 10.340 1.025 -8.491 1.00 0.00 C ATOM 342 C SER A1531 8.966 0.365 -8.664 1.00 0.00 C ATOM 343 O SER A1531 8.539 0.076 -9.788 1.00 0.00 O ATOM 344 CB SER A1531 11.448 -0.011 -8.403 1.00 0.00 C ATOM 345 OG SER A1531 11.491 -0.557 -7.085 1.00 0.00 O ATOM 0 H SER A1531 10.950 1.424 -6.551 1.00 0.00 H new ATOM 0 HA SER A1531 10.487 1.652 -9.370 1.00 0.00 H new ATOM 0 HB2 SER A1531 11.276 -0.804 -9.130 1.00 0.00 H new ATOM 0 HB3 SER A1531 12.407 0.445 -8.650 1.00 0.00 H new ATOM 0 HG SER A1531 12.205 -1.226 -7.031 1.00 0.00 H new ATOM 351 N LEU A1532 8.265 0.161 -7.555 1.00 0.00 N ATOM 352 CA LEU A1532 6.953 -0.482 -7.576 1.00 0.00 C ATOM 353 C LEU A1532 5.848 0.553 -7.647 1.00 0.00 C ATOM 354 O LEU A1532 4.668 0.208 -7.717 1.00 0.00 O ATOM 355 CB LEU A1532 6.741 -1.348 -6.322 1.00 0.00 C ATOM 356 CG LEU A1532 7.693 -2.529 -6.115 1.00 0.00 C ATOM 357 CD1 LEU A1532 7.342 -3.258 -4.829 1.00 0.00 C ATOM 358 CD2 LEU A1532 7.629 -3.486 -7.290 1.00 0.00 C ATOM 0 H LEU A1532 8.584 0.432 -6.625 1.00 0.00 H new ATOM 0 HA LEU A1532 6.918 -1.116 -8.462 1.00 0.00 H new ATOM 0 HB2 LEU A1532 6.813 -0.700 -5.449 1.00 0.00 H new ATOM 0 HB3 LEU A1532 5.723 -1.736 -6.348 1.00 0.00 H new ATOM 0 HG LEU A1532 8.710 -2.143 -6.043 1.00 0.00 H new ATOM 0 HD11 LEU A1532 8.024 -4.097 -4.689 1.00 0.00 H new ATOM 0 HD12 LEU A1532 7.432 -2.573 -3.986 1.00 0.00 H new ATOM 0 HD13 LEU A1532 6.318 -3.628 -4.888 1.00 0.00 H new ATOM 0 HD21 LEU A1532 8.314 -4.317 -7.120 1.00 0.00 H new ATOM 0 HD22 LEU A1532 6.613 -3.868 -7.393 1.00 0.00 H new ATOM 0 HD23 LEU A1532 7.914 -2.962 -8.202 1.00 0.00 H new ATOM 370 N SER A1533 6.226 1.813 -7.638 1.00 0.00 N ATOM 371 CA SER A1533 5.265 2.892 -7.625 1.00 0.00 C ATOM 372 C SER A1533 4.461 2.925 -8.932 1.00 0.00 C ATOM 373 O SER A1533 4.989 2.642 -10.019 1.00 0.00 O ATOM 374 CB SER A1533 5.967 4.237 -7.368 1.00 0.00 C ATOM 375 OG SER A1533 5.024 5.281 -7.151 1.00 0.00 O ATOM 0 H SER A1533 7.200 2.116 -7.639 1.00 0.00 H new ATOM 0 HA SER A1533 4.563 2.717 -6.810 1.00 0.00 H new ATOM 0 HB2 SER A1533 6.620 4.148 -6.500 1.00 0.00 H new ATOM 0 HB3 SER A1533 6.600 4.487 -8.219 1.00 0.00 H new ATOM 0 HG SER A1533 4.227 4.916 -6.713 1.00 0.00 H new ATOM 381 N GLY A1534 3.196 3.225 -8.810 1.00 0.00 N ATOM 382 CA GLY A1534 2.322 3.308 -9.941 1.00 0.00 C ATOM 383 C GLY A1534 1.003 3.887 -9.525 1.00 0.00 C ATOM 384 O GLY A1534 0.472 3.501 -8.475 1.00 0.00 O ATOM 0 H GLY A1534 2.744 3.419 -7.917 1.00 0.00 H new ATOM 0 HA2 GLY A1534 2.773 3.928 -10.716 1.00 0.00 H new ATOM 0 HA3 GLY A1534 2.175 2.317 -10.371 1.00 0.00 H new ATOM 388 N ARG A1535 0.484 4.823 -10.310 1.00 0.00 N ATOM 389 CA ARG A1535 -0.772 5.493 -9.994 1.00 0.00 C ATOM 390 C ARG A1535 -1.963 4.703 -10.459 1.00 0.00 C ATOM 391 O ARG A1535 -3.086 4.943 -10.018 1.00 0.00 O ATOM 392 CB ARG A1535 -0.850 6.916 -10.543 1.00 0.00 C ATOM 393 CG ARG A1535 0.167 7.853 -9.961 1.00 0.00 C ATOM 394 CD ARG A1535 -0.251 9.301 -10.123 1.00 0.00 C ATOM 395 NE ARG A1535 -0.317 9.761 -11.507 1.00 0.00 N ATOM 396 CZ ARG A1535 -0.900 10.913 -11.892 1.00 0.00 C ATOM 397 NH1 ARG A1535 -1.532 11.684 -10.995 1.00 0.00 N1+ ATOM 398 NH2 ARG A1535 -0.845 11.295 -13.162 1.00 0.00 N ATOM 0 H ARG A1535 0.918 5.138 -11.178 1.00 0.00 H new ATOM 0 HA ARG A1535 -0.794 5.559 -8.906 1.00 0.00 H new ATOM 0 HB2 ARG A1535 -0.722 6.884 -11.625 1.00 0.00 H new ATOM 0 HB3 ARG A1535 -1.847 7.314 -10.352 1.00 0.00 H new ATOM 0 HG2 ARG A1535 0.305 7.630 -8.903 1.00 0.00 H new ATOM 0 HG3 ARG A1535 1.129 7.695 -10.448 1.00 0.00 H new ATOM 0 HD2 ARG A1535 -1.229 9.438 -9.661 1.00 0.00 H new ATOM 0 HD3 ARG A1535 0.450 9.932 -9.577 1.00 0.00 H new ATOM 0 HE ARG A1535 0.104 9.174 -12.227 1.00 0.00 H new ATOM 0 HH11 ARG A1535 -1.573 11.399 -10.016 1.00 0.00 H new ATOM 0 HH12 ARG A1535 -1.972 12.555 -11.291 1.00 0.00 H new ATOM 0 HH21 ARG A1535 -0.361 10.716 -13.848 1.00 0.00 H new ATOM 0 HH22 ARG A1535 -1.287 12.167 -13.452 1.00 0.00 H new ATOM 412 N ALA A1536 -1.752 3.815 -11.388 1.00 0.00 N ATOM 413 CA ALA A1536 -2.810 2.931 -11.779 1.00 0.00 C ATOM 414 C ALA A1536 -2.780 1.745 -10.848 1.00 0.00 C ATOM 415 O ALA A1536 -3.810 1.197 -10.465 1.00 0.00 O ATOM 416 CB ALA A1536 -2.691 2.505 -13.237 1.00 0.00 C ATOM 0 H ALA A1536 -0.869 3.685 -11.883 1.00 0.00 H new ATOM 0 HA ALA A1536 -3.768 3.446 -11.703 1.00 0.00 H new ATOM 0 HB1 ALA A1536 -3.514 1.836 -13.489 1.00 0.00 H new ATOM 0 HB2 ALA A1536 -2.731 3.386 -13.878 1.00 0.00 H new ATOM 0 HB3 ALA A1536 -1.743 1.988 -13.389 1.00 0.00 H new ATOM 422 N GLY A1537 -1.565 1.400 -10.457 1.00 0.00 N ATOM 423 CA GLY A1537 -1.315 0.353 -9.515 1.00 0.00 C ATOM 424 C GLY A1537 -1.683 -1.000 -10.043 1.00 0.00 C ATOM 425 O GLY A1537 -1.296 -1.371 -11.165 1.00 0.00 O ATOM 0 H GLY A1537 -0.718 1.855 -10.798 1.00 0.00 H new ATOM 0 HA2 GLY A1537 -0.259 0.358 -9.244 1.00 0.00 H new ATOM 0 HA3 GLY A1537 -1.879 0.548 -8.603 1.00 0.00 H new ATOM 429 N PHE A1538 -2.414 -1.731 -9.253 1.00 0.00 N ATOM 430 CA PHE A1538 -2.878 -3.048 -9.595 1.00 0.00 C ATOM 431 C PHE A1538 -4.298 -3.188 -9.104 1.00 0.00 C ATOM 432 O PHE A1538 -4.624 -2.724 -7.997 1.00 0.00 O ATOM 433 CB PHE A1538 -1.978 -4.141 -8.965 1.00 0.00 C ATOM 434 CG PHE A1538 -0.574 -4.179 -9.513 1.00 0.00 C ATOM 435 CD1 PHE A1538 -0.319 -4.772 -10.735 1.00 0.00 C ATOM 436 CD2 PHE A1538 0.481 -3.618 -8.815 1.00 0.00 C ATOM 437 CE1 PHE A1538 0.962 -4.809 -11.255 1.00 0.00 C ATOM 438 CE2 PHE A1538 1.765 -3.652 -9.329 1.00 0.00 C ATOM 439 CZ PHE A1538 2.005 -4.248 -10.549 1.00 0.00 C ATOM 0 H PHE A1538 -2.713 -1.421 -8.328 1.00 0.00 H new ATOM 0 HA PHE A1538 -2.836 -3.180 -10.676 1.00 0.00 H new ATOM 0 HB2 PHE A1538 -1.931 -3.980 -7.888 1.00 0.00 H new ATOM 0 HB3 PHE A1538 -2.444 -5.114 -9.122 1.00 0.00 H new ATOM 0 HD1 PHE A1538 -1.132 -5.213 -11.292 1.00 0.00 H new ATOM 0 HD2 PHE A1538 0.300 -3.149 -7.859 1.00 0.00 H new ATOM 0 HE1 PHE A1538 1.145 -5.276 -12.211 1.00 0.00 H new ATOM 0 HE2 PHE A1538 2.580 -3.211 -8.774 1.00 0.00 H new ATOM 0 HZ PHE A1538 3.007 -4.275 -10.950 1.00 0.00 H new ATOM 449 N THR A1539 -5.148 -3.754 -9.922 1.00 0.00 N ATOM 450 CA THR A1539 -6.511 -3.975 -9.552 1.00 0.00 C ATOM 451 C THR A1539 -6.610 -5.324 -8.853 1.00 0.00 C ATOM 452 O THR A1539 -6.435 -6.376 -9.482 1.00 0.00 O ATOM 453 CB THR A1539 -7.418 -3.982 -10.809 1.00 0.00 C ATOM 454 OG1 THR A1539 -7.195 -2.787 -11.555 1.00 0.00 O ATOM 455 CG2 THR A1539 -8.892 -4.050 -10.429 1.00 0.00 C ATOM 0 H THR A1539 -4.909 -4.072 -10.861 1.00 0.00 H new ATOM 0 HA THR A1539 -6.841 -3.175 -8.889 1.00 0.00 H new ATOM 0 HB THR A1539 -7.169 -4.862 -11.402 1.00 0.00 H new ATOM 0 HG1 THR A1539 -7.918 -2.150 -11.376 1.00 0.00 H new ATOM 0 HG21 THR A1539 -9.501 -4.053 -11.333 1.00 0.00 H new ATOM 0 HG22 THR A1539 -9.080 -4.962 -9.862 1.00 0.00 H new ATOM 0 HG23 THR A1539 -9.151 -3.184 -9.820 1.00 0.00 H new ATOM 463 N ALA A1540 -6.816 -5.313 -7.564 1.00 0.00 N ATOM 464 CA ALA A1540 -6.983 -6.550 -6.853 1.00 0.00 C ATOM 465 C ALA A1540 -8.441 -6.941 -6.895 1.00 0.00 C ATOM 466 O ALA A1540 -9.305 -6.220 -6.383 1.00 0.00 O ATOM 467 CB ALA A1540 -6.450 -6.472 -5.429 1.00 0.00 C ATOM 0 H ALA A1540 -6.872 -4.471 -6.990 1.00 0.00 H new ATOM 0 HA ALA A1540 -6.392 -7.324 -7.342 1.00 0.00 H new ATOM 0 HB1 ALA A1540 -6.599 -7.431 -4.932 1.00 0.00 H new ATOM 0 HB2 ALA A1540 -5.386 -6.236 -5.451 1.00 0.00 H new ATOM 0 HB3 ALA A1540 -6.983 -5.694 -4.883 1.00 0.00 H new ATOM 473 N ALA A1541 -8.721 -8.027 -7.551 1.00 0.00 N ATOM 474 CA ALA A1541 -10.069 -8.482 -7.728 1.00 0.00 C ATOM 475 C ALA A1541 -10.246 -9.819 -7.063 1.00 0.00 C ATOM 476 O ALA A1541 -9.581 -10.791 -7.421 1.00 0.00 O ATOM 477 CB ALA A1541 -10.409 -8.572 -9.212 1.00 0.00 C ATOM 0 H ALA A1541 -8.017 -8.627 -7.981 1.00 0.00 H new ATOM 0 HA ALA A1541 -10.749 -7.766 -7.266 1.00 0.00 H new ATOM 0 HB1 ALA A1541 -11.436 -8.919 -9.330 1.00 0.00 H new ATOM 0 HB2 ALA A1541 -10.304 -7.588 -9.670 1.00 0.00 H new ATOM 0 HB3 ALA A1541 -9.731 -9.273 -9.699 1.00 0.00 H new ATOM 483 N TYR A1542 -11.116 -9.877 -6.107 1.00 0.00 N ATOM 484 CA TYR A1542 -11.350 -11.090 -5.376 1.00 0.00 C ATOM 485 C TYR A1542 -12.838 -11.378 -5.264 1.00 0.00 C ATOM 486 O TYR A1542 -13.639 -10.510 -5.608 1.00 0.00 O ATOM 487 CB TYR A1542 -10.630 -11.057 -4.008 1.00 0.00 C ATOM 488 CG TYR A1542 -10.883 -9.813 -3.173 1.00 0.00 C ATOM 489 CD1 TYR A1542 -11.986 -9.711 -2.346 1.00 0.00 C ATOM 490 CD2 TYR A1542 -9.996 -8.741 -3.215 1.00 0.00 C ATOM 491 CE1 TYR A1542 -12.207 -8.584 -1.588 1.00 0.00 C ATOM 492 CE2 TYR A1542 -10.210 -7.611 -2.460 1.00 0.00 C ATOM 493 CZ TYR A1542 -11.319 -7.539 -1.648 1.00 0.00 C ATOM 494 OH TYR A1542 -11.540 -6.414 -0.890 1.00 0.00 O ATOM 0 H TYR A1542 -11.687 -9.087 -5.807 1.00 0.00 H new ATOM 0 HA TYR A1542 -10.918 -11.924 -5.929 1.00 0.00 H new ATOM 0 HB2 TYR A1542 -10.938 -11.930 -3.432 1.00 0.00 H new ATOM 0 HB3 TYR A1542 -9.557 -11.149 -4.178 1.00 0.00 H new ATOM 0 HD1 TYR A1542 -12.687 -10.531 -2.294 1.00 0.00 H new ATOM 0 HD2 TYR A1542 -9.125 -8.797 -3.851 1.00 0.00 H new ATOM 0 HE1 TYR A1542 -13.075 -8.522 -0.949 1.00 0.00 H new ATOM 0 HE2 TYR A1542 -9.513 -6.787 -2.504 1.00 0.00 H new ATOM 0 HH TYR A1542 -10.820 -5.768 -1.046 1.00 0.00 H new ATOM 567 N GLY A1547 -12.308 -5.634 -7.369 1.00 0.00 N ATOM 568 CA GLY A1547 -11.783 -4.378 -7.809 1.00 0.00 C ATOM 569 C GLY A1547 -11.405 -3.441 -6.698 1.00 0.00 C ATOM 570 O GLY A1547 -12.232 -2.679 -6.200 1.00 0.00 O ATOM 0 HA2 GLY A1547 -10.905 -4.562 -8.428 1.00 0.00 H new ATOM 0 HA3 GLY A1547 -12.523 -3.890 -8.443 1.00 0.00 H new ATOM 574 N VAL A1548 -10.178 -3.522 -6.280 1.00 0.00 N ATOM 575 CA VAL A1548 -9.608 -2.552 -5.392 1.00 0.00 C ATOM 576 C VAL A1548 -8.419 -1.974 -6.119 1.00 0.00 C ATOM 577 O VAL A1548 -7.484 -2.704 -6.469 1.00 0.00 O ATOM 578 CB VAL A1548 -9.130 -3.153 -4.040 1.00 0.00 C ATOM 579 CG1 VAL A1548 -8.706 -2.056 -3.066 1.00 0.00 C ATOM 580 CG2 VAL A1548 -10.185 -4.051 -3.423 1.00 0.00 C ATOM 0 H VAL A1548 -9.538 -4.270 -6.548 1.00 0.00 H new ATOM 0 HA VAL A1548 -10.367 -1.812 -5.140 1.00 0.00 H new ATOM 0 HB VAL A1548 -8.257 -3.770 -4.251 1.00 0.00 H new ATOM 0 HG11 VAL A1548 -8.377 -2.508 -2.130 1.00 0.00 H new ATOM 0 HG12 VAL A1548 -7.887 -1.481 -3.499 1.00 0.00 H new ATOM 0 HG13 VAL A1548 -9.551 -1.395 -2.873 1.00 0.00 H new ATOM 0 HG21 VAL A1548 -9.815 -4.452 -2.480 1.00 0.00 H new ATOM 0 HG22 VAL A1548 -11.092 -3.475 -3.241 1.00 0.00 H new ATOM 0 HG23 VAL A1548 -10.407 -4.872 -4.104 1.00 0.00 H new ATOM 590 N TYR A1549 -8.482 -0.717 -6.400 1.00 0.00 N ATOM 591 CA TYR A1549 -7.446 -0.029 -7.107 1.00 0.00 C ATOM 592 C TYR A1549 -6.492 0.527 -6.094 1.00 0.00 C ATOM 593 O TYR A1549 -6.830 1.448 -5.373 1.00 0.00 O ATOM 594 CB TYR A1549 -8.033 1.123 -7.932 1.00 0.00 C ATOM 595 CG TYR A1549 -9.078 0.705 -8.939 1.00 0.00 C ATOM 596 CD1 TYR A1549 -8.708 0.263 -10.191 1.00 0.00 C ATOM 597 CD2 TYR A1549 -10.436 0.759 -8.636 1.00 0.00 C ATOM 598 CE1 TYR A1549 -9.650 -0.114 -11.120 1.00 0.00 C ATOM 599 CE2 TYR A1549 -11.389 0.381 -9.567 1.00 0.00 C ATOM 600 CZ TYR A1549 -10.983 -0.054 -10.809 1.00 0.00 C ATOM 601 OH TYR A1549 -11.920 -0.437 -11.753 1.00 0.00 O ATOM 0 H TYR A1549 -9.270 -0.123 -6.141 1.00 0.00 H new ATOM 0 HA TYR A1549 -6.941 -0.717 -7.785 1.00 0.00 H new ATOM 0 HB2 TYR A1549 -8.473 1.852 -7.252 1.00 0.00 H new ATOM 0 HB3 TYR A1549 -7.222 1.627 -8.457 1.00 0.00 H new ATOM 0 HD1 TYR A1549 -7.660 0.212 -10.447 1.00 0.00 H new ATOM 0 HD2 TYR A1549 -10.751 1.101 -7.661 1.00 0.00 H new ATOM 0 HE1 TYR A1549 -9.338 -0.458 -12.095 1.00 0.00 H new ATOM 0 HE2 TYR A1549 -12.440 0.427 -9.322 1.00 0.00 H new ATOM 0 HH TYR A1549 -12.820 -0.338 -11.379 1.00 0.00 H new ATOM 611 N MET A1550 -5.339 -0.035 -6.008 1.00 0.00 N ATOM 612 CA MET A1550 -4.373 0.430 -5.044 1.00 0.00 C ATOM 613 C MET A1550 -3.200 1.070 -5.750 1.00 0.00 C ATOM 614 O MET A1550 -2.644 0.496 -6.692 1.00 0.00 O ATOM 615 CB MET A1550 -3.911 -0.720 -4.120 1.00 0.00 C ATOM 616 CG MET A1550 -3.260 -1.901 -4.842 1.00 0.00 C ATOM 617 SD MET A1550 -2.779 -3.246 -3.734 1.00 0.00 S ATOM 618 CE MET A1550 -4.369 -3.735 -3.060 1.00 0.00 C ATOM 0 H MET A1550 -5.030 -0.816 -6.586 1.00 0.00 H new ATOM 0 HA MET A1550 -4.847 1.183 -4.414 1.00 0.00 H new ATOM 0 HB2 MET A1550 -3.203 -0.321 -3.394 1.00 0.00 H new ATOM 0 HB3 MET A1550 -4.772 -1.085 -3.559 1.00 0.00 H new ATOM 0 HG2 MET A1550 -3.953 -2.287 -5.589 1.00 0.00 H new ATOM 0 HG3 MET A1550 -2.378 -1.548 -5.377 1.00 0.00 H new ATOM 0 HE1 MET A1550 -4.420 -4.822 -3.000 1.00 0.00 H new ATOM 0 HE2 MET A1550 -4.488 -3.311 -2.063 1.00 0.00 H new ATOM 0 HE3 MET A1550 -5.166 -3.369 -3.707 1.00 0.00 H new ATOM 628 N SER A1551 -2.887 2.275 -5.361 1.00 0.00 N ATOM 629 CA SER A1551 -1.755 2.970 -5.891 1.00 0.00 C ATOM 630 C SER A1551 -0.580 2.620 -5.019 1.00 0.00 C ATOM 631 O SER A1551 -0.735 2.418 -3.811 1.00 0.00 O ATOM 632 CB SER A1551 -2.003 4.493 -5.852 1.00 0.00 C ATOM 633 OG SER A1551 -0.952 5.240 -6.470 1.00 0.00 O ATOM 0 H SER A1551 -3.414 2.802 -4.665 1.00 0.00 H new ATOM 0 HA SER A1551 -1.573 2.685 -6.927 1.00 0.00 H new ATOM 0 HB2 SER A1551 -2.945 4.716 -6.353 1.00 0.00 H new ATOM 0 HB3 SER A1551 -2.110 4.813 -4.816 1.00 0.00 H new ATOM 0 HG SER A1551 -1.323 6.048 -6.882 1.00 0.00 H new ATOM 639 N ILE A1552 0.563 2.485 -5.596 1.00 0.00 N ATOM 640 CA ILE A1552 1.723 2.236 -4.810 1.00 0.00 C ATOM 641 C ILE A1552 2.494 3.523 -4.722 1.00 0.00 C ATOM 642 O ILE A1552 3.068 3.979 -5.727 1.00 0.00 O ATOM 643 CB ILE A1552 2.649 1.075 -5.341 1.00 0.00 C ATOM 644 CG1 ILE A1552 1.937 -0.304 -5.352 1.00 0.00 C ATOM 645 CG2 ILE A1552 3.917 0.974 -4.488 1.00 0.00 C ATOM 646 CD1 ILE A1552 0.852 -0.482 -6.397 1.00 0.00 C ATOM 0 H ILE A1552 0.721 2.542 -6.602 1.00 0.00 H new ATOM 0 HA ILE A1552 1.388 1.889 -3.833 1.00 0.00 H new ATOM 0 HB ILE A1552 2.902 1.329 -6.370 1.00 0.00 H new ATOM 0 HG12 ILE A1552 2.689 -1.078 -5.502 1.00 0.00 H new ATOM 0 HG13 ILE A1552 1.498 -0.472 -4.369 1.00 0.00 H new ATOM 0 HG21 ILE A1552 4.547 0.169 -4.866 1.00 0.00 H new ATOM 0 HG22 ILE A1552 4.464 1.916 -4.537 1.00 0.00 H new ATOM 0 HG23 ILE A1552 3.644 0.766 -3.453 1.00 0.00 H new ATOM 0 HD11 ILE A1552 0.425 -1.481 -6.312 1.00 0.00 H new ATOM 0 HD12 ILE A1552 0.070 0.261 -6.240 1.00 0.00 H new ATOM 0 HD13 ILE A1552 1.280 -0.354 -7.391 1.00 0.00 H new ATOM 658 N CYS A1553 2.429 4.143 -3.555 1.00 0.00 N ATOM 659 CA CYS A1553 3.138 5.372 -3.251 1.00 0.00 C ATOM 660 C CYS A1553 2.525 6.553 -3.979 1.00 0.00 C ATOM 661 O CYS A1553 2.987 6.945 -5.059 1.00 0.00 O ATOM 662 CB CYS A1553 4.632 5.253 -3.581 1.00 0.00 C ATOM 663 SG CYS A1553 5.593 6.711 -3.135 1.00 0.00 S ATOM 0 H CYS A1553 1.869 3.797 -2.776 1.00 0.00 H new ATOM 0 HA CYS A1553 3.042 5.545 -2.179 1.00 0.00 H new ATOM 0 HB2 CYS A1553 5.041 4.386 -3.062 1.00 0.00 H new ATOM 0 HB3 CYS A1553 4.745 5.067 -4.649 1.00 0.00 H new ATOM 668 N GLY A1554 1.469 7.091 -3.431 1.00 0.00 N ATOM 669 CA GLY A1554 0.865 8.250 -4.020 1.00 0.00 C ATOM 670 C GLY A1554 -0.612 8.089 -4.202 1.00 0.00 C ATOM 671 O GLY A1554 -1.253 7.353 -3.452 1.00 0.00 O ATOM 0 H GLY A1554 1.014 6.748 -2.585 1.00 0.00 H new ATOM 0 HA2 GLY A1554 1.059 9.118 -3.390 1.00 0.00 H new ATOM 0 HA3 GLY A1554 1.329 8.447 -4.986 1.00 0.00 H new ATOM 675 N GLU A1555 -1.143 8.779 -5.176 1.00 0.00 N ATOM 676 CA GLU A1555 -2.556 8.761 -5.487 1.00 0.00 C ATOM 677 C GLU A1555 -2.830 7.954 -6.731 1.00 0.00 C ATOM 678 O GLU A1555 -1.925 7.700 -7.526 1.00 0.00 O ATOM 679 CB GLU A1555 -3.128 10.204 -5.631 1.00 0.00 C ATOM 680 CG GLU A1555 -2.118 11.316 -5.965 1.00 0.00 C ATOM 681 CD GLU A1555 -1.346 11.120 -7.249 1.00 0.00 C ATOM 682 OE1 GLU A1555 -1.843 11.512 -8.324 1.00 0.00 O ATOM 683 OE2 GLU A1555 -0.189 10.611 -7.186 1.00 0.00 O1- ATOM 0 H GLU A1555 -0.598 9.383 -5.791 1.00 0.00 H new ATOM 0 HA GLU A1555 -3.065 8.281 -4.651 1.00 0.00 H new ATOM 0 HB2 GLU A1555 -3.891 10.192 -6.409 1.00 0.00 H new ATOM 0 HB3 GLU A1555 -3.628 10.467 -4.699 1.00 0.00 H new ATOM 0 HG2 GLU A1555 -2.652 12.264 -6.022 1.00 0.00 H new ATOM 0 HG3 GLU A1555 -1.408 11.399 -5.142 1.00 0.00 H new ATOM 690 N ASN A1556 -4.046 7.490 -6.858 1.00 0.00 N ATOM 691 CA ASN A1556 -4.477 6.789 -8.052 1.00 0.00 C ATOM 692 C ASN A1556 -4.920 7.789 -9.066 1.00 0.00 C ATOM 693 O ASN A1556 -5.737 8.664 -8.773 1.00 0.00 O ATOM 694 CB ASN A1556 -5.627 5.796 -7.792 1.00 0.00 C ATOM 695 CG ASN A1556 -5.212 4.534 -7.083 1.00 0.00 C ATOM 696 OD1 ASN A1556 -5.248 4.451 -5.875 1.00 0.00 O ATOM 697 ND2 ASN A1556 -4.803 3.540 -7.834 1.00 0.00 N ATOM 0 H ASN A1556 -4.767 7.584 -6.143 1.00 0.00 H new ATOM 0 HA ASN A1556 -3.626 6.208 -8.408 1.00 0.00 H new ATOM 0 HB2 ASN A1556 -6.395 6.295 -7.200 1.00 0.00 H new ATOM 0 HB3 ASN A1556 -6.083 5.529 -8.746 1.00 0.00 H new ATOM 0 HD21 ASN A1556 -4.503 2.665 -7.403 1.00 0.00 H new ATOM 0 HD22 ASN A1556 -4.785 3.642 -8.849 1.00 0.00 H new ATOM 704 N GLU A1557 -4.401 7.663 -10.270 1.00 0.00 N ATOM 705 CA GLU A1557 -4.700 8.604 -11.336 1.00 0.00 C ATOM 706 C GLU A1557 -6.110 8.405 -11.869 1.00 0.00 C ATOM 707 O GLU A1557 -6.665 9.275 -12.539 1.00 0.00 O ATOM 708 CB GLU A1557 -3.654 8.533 -12.462 1.00 0.00 C ATOM 709 CG GLU A1557 -3.484 7.162 -13.105 1.00 0.00 C ATOM 710 CD GLU A1557 -2.422 7.166 -14.181 1.00 0.00 C ATOM 711 OE1 GLU A1557 -2.743 7.449 -15.352 1.00 0.00 O ATOM 712 OE2 GLU A1557 -1.254 6.903 -13.882 1.00 0.00 O1- ATOM 0 H GLU A1557 -3.765 6.912 -10.539 1.00 0.00 H new ATOM 0 HA GLU A1557 -4.649 9.607 -10.912 1.00 0.00 H new ATOM 0 HB2 GLU A1557 -3.929 9.248 -13.237 1.00 0.00 H new ATOM 0 HB3 GLU A1557 -2.691 8.851 -12.062 1.00 0.00 H new ATOM 0 HG2 GLU A1557 -3.220 6.433 -12.339 1.00 0.00 H new ATOM 0 HG3 GLU A1557 -4.434 6.843 -13.535 1.00 0.00 H new ATOM 719 N ASN A1558 -6.697 7.277 -11.548 1.00 0.00 N ATOM 720 CA ASN A1558 -8.053 6.972 -11.966 1.00 0.00 C ATOM 721 C ASN A1558 -9.024 7.187 -10.818 1.00 0.00 C ATOM 722 O ASN A1558 -10.165 6.729 -10.845 1.00 0.00 O ATOM 723 CB ASN A1558 -8.175 5.544 -12.520 1.00 0.00 C ATOM 724 CG ASN A1558 -7.905 4.440 -11.506 1.00 0.00 C ATOM 725 OD1 ASN A1558 -7.126 4.601 -10.568 1.00 0.00 O ATOM 726 ND2 ASN A1558 -8.534 3.308 -11.702 1.00 0.00 N ATOM 0 H ASN A1558 -6.255 6.545 -10.992 1.00 0.00 H new ATOM 0 HA ASN A1558 -8.308 7.656 -12.775 1.00 0.00 H new ATOM 0 HB2 ASN A1558 -9.179 5.410 -12.923 1.00 0.00 H new ATOM 0 HB3 ASN A1558 -7.480 5.432 -13.352 1.00 0.00 H new ATOM 0 HD21 ASN A1558 -8.385 2.525 -11.066 1.00 0.00 H new ATOM 0 HD22 ASN A1558 -9.173 3.210 -12.491 1.00 0.00 H new ATOM 733 N CYS A1559 -8.563 7.880 -9.827 1.00 0.00 N ATOM 734 CA CYS A1559 -9.350 8.240 -8.674 1.00 0.00 C ATOM 735 C CYS A1559 -9.195 9.731 -8.420 1.00 0.00 C ATOM 736 O CYS A1559 -8.326 10.363 -9.045 1.00 0.00 O ATOM 737 CB CYS A1559 -8.888 7.453 -7.445 1.00 0.00 C ATOM 738 SG CYS A1559 -9.258 5.670 -7.478 1.00 0.00 S ATOM 0 H CYS A1559 -7.604 8.224 -9.789 1.00 0.00 H new ATOM 0 HA CYS A1559 -10.397 8.001 -8.862 1.00 0.00 H new ATOM 0 HB2 CYS A1559 -7.811 7.582 -7.335 1.00 0.00 H new ATOM 0 HB3 CYS A1559 -9.353 7.887 -6.560 1.00 0.00 H new ATOM 743 N PRO A1560 -10.072 10.344 -7.589 1.00 0.00 N ATOM 744 CA PRO A1560 -9.923 11.745 -7.178 1.00 0.00 C ATOM 745 C PRO A1560 -8.497 12.030 -6.663 1.00 0.00 C ATOM 746 O PRO A1560 -7.949 11.235 -5.871 1.00 0.00 O ATOM 747 CB PRO A1560 -10.927 11.870 -6.031 1.00 0.00 C ATOM 748 CG PRO A1560 -12.001 10.907 -6.377 1.00 0.00 C ATOM 749 CD PRO A1560 -11.318 9.747 -7.039 1.00 0.00 C ATOM 0 HA PRO A1560 -10.092 12.445 -7.996 1.00 0.00 H new ATOM 0 HB2 PRO A1560 -10.468 11.627 -5.073 1.00 0.00 H new ATOM 0 HB3 PRO A1560 -11.314 12.886 -5.950 1.00 0.00 H new ATOM 0 HG2 PRO A1560 -12.539 10.586 -5.485 1.00 0.00 H new ATOM 0 HG3 PRO A1560 -12.733 11.362 -7.045 1.00 0.00 H new ATOM 0 HD2 PRO A1560 -11.101 8.950 -6.328 1.00 0.00 H new ATOM 0 HD3 PRO A1560 -11.936 9.313 -7.825 1.00 0.00 H new ATOM 757 N PRO A1561 -7.855 13.128 -7.148 1.00 0.00 N ATOM 758 CA PRO A1561 -6.502 13.520 -6.728 1.00 0.00 C ATOM 759 C PRO A1561 -6.411 13.671 -5.214 1.00 0.00 C ATOM 760 O PRO A1561 -6.849 14.680 -4.637 1.00 0.00 O ATOM 761 CB PRO A1561 -6.284 14.873 -7.417 1.00 0.00 C ATOM 762 CG PRO A1561 -7.202 14.854 -8.586 1.00 0.00 C ATOM 763 CD PRO A1561 -8.403 14.061 -8.156 1.00 0.00 C ATOM 0 HA PRO A1561 -5.753 12.775 -6.997 1.00 0.00 H new ATOM 0 HB2 PRO A1561 -6.514 15.701 -6.746 1.00 0.00 H new ATOM 0 HB3 PRO A1561 -5.247 14.995 -7.730 1.00 0.00 H new ATOM 0 HG2 PRO A1561 -7.486 15.866 -8.876 1.00 0.00 H new ATOM 0 HG3 PRO A1561 -6.722 14.397 -9.452 1.00 0.00 H new ATOM 0 HD2 PRO A1561 -9.177 14.701 -7.732 1.00 0.00 H new ATOM 0 HD3 PRO A1561 -8.854 13.528 -8.993 1.00 0.00 H new ATOM 771 N GLY A1562 -5.890 12.657 -4.576 1.00 0.00 N ATOM 772 CA GLY A1562 -5.783 12.653 -3.150 1.00 0.00 C ATOM 773 C GLY A1562 -6.081 11.287 -2.582 1.00 0.00 C ATOM 774 O GLY A1562 -5.725 10.999 -1.455 1.00 0.00 O ATOM 0 H GLY A1562 -5.531 11.818 -5.031 1.00 0.00 H new ATOM 0 HA2 GLY A1562 -4.779 12.960 -2.858 1.00 0.00 H new ATOM 0 HA3 GLY A1562 -6.474 13.383 -2.729 1.00 0.00 H new ATOM 778 N VAL A1563 -6.754 10.454 -3.356 1.00 0.00 N ATOM 779 CA VAL A1563 -7.060 9.089 -2.938 1.00 0.00 C ATOM 780 C VAL A1563 -5.911 8.155 -3.339 1.00 0.00 C ATOM 781 O VAL A1563 -5.441 8.208 -4.475 1.00 0.00 O ATOM 782 CB VAL A1563 -8.383 8.581 -3.568 1.00 0.00 C ATOM 783 CG1 VAL A1563 -8.728 7.204 -3.056 1.00 0.00 C ATOM 784 CG2 VAL A1563 -9.521 9.536 -3.278 1.00 0.00 C ATOM 0 H VAL A1563 -7.103 10.697 -4.283 1.00 0.00 H new ATOM 0 HA VAL A1563 -7.180 9.091 -1.855 1.00 0.00 H new ATOM 0 HB VAL A1563 -8.236 8.528 -4.647 1.00 0.00 H new ATOM 0 HG11 VAL A1563 -9.660 6.869 -3.512 1.00 0.00 H new ATOM 0 HG12 VAL A1563 -7.928 6.509 -3.313 1.00 0.00 H new ATOM 0 HG13 VAL A1563 -8.846 7.237 -1.973 1.00 0.00 H new ATOM 0 HG21 VAL A1563 -10.438 9.158 -3.730 1.00 0.00 H new ATOM 0 HG22 VAL A1563 -9.657 9.623 -2.200 1.00 0.00 H new ATOM 0 HG23 VAL A1563 -9.289 10.516 -3.695 1.00 0.00 H new ATOM 794 N GLY A1564 -5.472 7.315 -2.413 1.00 0.00 N ATOM 795 CA GLY A1564 -4.349 6.425 -2.675 1.00 0.00 C ATOM 796 C GLY A1564 -4.775 4.993 -2.870 1.00 0.00 C ATOM 797 O GLY A1564 -3.955 4.131 -3.217 1.00 0.00 O ATOM 0 H GLY A1564 -5.873 7.231 -1.479 1.00 0.00 H new ATOM 0 HA2 GLY A1564 -3.820 6.767 -3.565 1.00 0.00 H new ATOM 0 HA3 GLY A1564 -3.645 6.481 -1.844 1.00 0.00 H new ATOM 801 N ALA A1565 -6.041 4.728 -2.626 1.00 0.00 N ATOM 802 CA ALA A1565 -6.601 3.412 -2.813 1.00 0.00 C ATOM 803 C ALA A1565 -8.115 3.516 -2.931 1.00 0.00 C ATOM 804 O ALA A1565 -8.773 4.155 -2.096 1.00 0.00 O ATOM 805 CB ALA A1565 -6.204 2.490 -1.661 1.00 0.00 C ATOM 0 H ALA A1565 -6.710 5.422 -2.292 1.00 0.00 H new ATOM 0 HA ALA A1565 -6.205 2.981 -3.733 1.00 0.00 H new ATOM 0 HB1 ALA A1565 -6.636 1.502 -1.820 1.00 0.00 H new ATOM 0 HB2 ALA A1565 -5.118 2.408 -1.618 1.00 0.00 H new ATOM 0 HB3 ALA A1565 -6.574 2.901 -0.722 1.00 0.00 H new ATOM 811 N CYS A1566 -8.660 2.912 -3.945 1.00 0.00 N ATOM 812 CA CYS A1566 -10.083 2.942 -4.190 1.00 0.00 C ATOM 813 C CYS A1566 -10.674 1.547 -4.158 1.00 0.00 C ATOM 814 O CYS A1566 -10.148 0.626 -4.763 1.00 0.00 O ATOM 815 CB CYS A1566 -10.382 3.603 -5.533 1.00 0.00 C ATOM 816 SG CYS A1566 -9.974 5.366 -5.608 1.00 0.00 S ATOM 0 H CYS A1566 -8.131 2.379 -4.635 1.00 0.00 H new ATOM 0 HA CYS A1566 -10.544 3.528 -3.395 1.00 0.00 H new ATOM 0 HB2 CYS A1566 -9.827 3.081 -6.312 1.00 0.00 H new ATOM 0 HB3 CYS A1566 -11.441 3.478 -5.758 1.00 0.00 H new ATOM 821 N PHE A1567 -11.759 1.407 -3.467 1.00 0.00 N ATOM 822 CA PHE A1567 -12.446 0.154 -3.333 1.00 0.00 C ATOM 823 C PHE A1567 -13.730 0.196 -4.150 1.00 0.00 C ATOM 824 O PHE A1567 -14.497 1.166 -4.069 1.00 0.00 O ATOM 825 CB PHE A1567 -12.766 -0.093 -1.840 1.00 0.00 C ATOM 826 CG PHE A1567 -13.456 -1.403 -1.532 1.00 0.00 C ATOM 827 CD1 PHE A1567 -12.719 -2.554 -1.346 1.00 0.00 C ATOM 828 CD2 PHE A1567 -14.839 -1.475 -1.422 1.00 0.00 C ATOM 829 CE1 PHE A1567 -13.340 -3.752 -1.060 1.00 0.00 C ATOM 830 CE2 PHE A1567 -15.464 -2.678 -1.135 1.00 0.00 C ATOM 831 CZ PHE A1567 -14.713 -3.813 -0.954 1.00 0.00 C ATOM 0 H PHE A1567 -12.206 2.176 -2.967 1.00 0.00 H new ATOM 0 HA PHE A1567 -11.819 -0.658 -3.701 1.00 0.00 H new ATOM 0 HB2 PHE A1567 -11.835 -0.051 -1.275 1.00 0.00 H new ATOM 0 HB3 PHE A1567 -13.394 0.722 -1.481 1.00 0.00 H new ATOM 0 HD1 PHE A1567 -11.643 -2.517 -1.425 1.00 0.00 H new ATOM 0 HD2 PHE A1567 -15.433 -0.584 -1.562 1.00 0.00 H new ATOM 0 HE1 PHE A1567 -12.749 -4.645 -0.919 1.00 0.00 H new ATOM 0 HE2 PHE A1567 -16.540 -2.723 -1.054 1.00 0.00 H new ATOM 0 HZ PHE A1567 -15.197 -4.752 -0.729 1.00 0.00 H new ATOM 841 N GLY A1568 -13.927 -0.796 -4.971 1.00 0.00 N ATOM 842 CA GLY A1568 -15.157 -0.919 -5.683 1.00 0.00 C ATOM 843 C GLY A1568 -15.157 -0.213 -7.013 1.00 0.00 C ATOM 844 O GLY A1568 -14.202 0.491 -7.370 1.00 0.00 O ATOM 0 H GLY A1568 -13.246 -1.531 -5.161 1.00 0.00 H new ATOM 0 HA2 GLY A1568 -15.371 -1.976 -5.842 1.00 0.00 H new ATOM 0 HA3 GLY A1568 -15.964 -0.519 -5.069 1.00 0.00 H new ATOM 848 N GLN A1569 -16.253 -0.357 -7.717 1.00 0.00 N ATOM 849 CA GLN A1569 -16.421 0.191 -9.052 1.00 0.00 C ATOM 850 C GLN A1569 -16.699 1.692 -8.995 1.00 0.00 C ATOM 851 O GLN A1569 -16.429 2.425 -9.949 1.00 0.00 O ATOM 852 CB GLN A1569 -17.554 -0.547 -9.777 1.00 0.00 C ATOM 853 CG GLN A1569 -18.920 -0.396 -9.116 1.00 0.00 C ATOM 854 CD GLN A1569 -19.997 -1.237 -9.762 1.00 0.00 C ATOM 855 OE1 GLN A1569 -19.954 -1.525 -10.965 1.00 0.00 O ATOM 856 NE2 GLN A1569 -20.960 -1.641 -8.978 1.00 0.00 N ATOM 0 H GLN A1569 -17.070 -0.865 -7.378 1.00 0.00 H new ATOM 0 HA GLN A1569 -15.495 0.048 -9.609 1.00 0.00 H new ATOM 0 HB2 GLN A1569 -17.615 -0.179 -10.801 1.00 0.00 H new ATOM 0 HB3 GLN A1569 -17.305 -1.607 -9.833 1.00 0.00 H new ATOM 0 HG2 GLN A1569 -18.838 -0.669 -8.064 1.00 0.00 H new ATOM 0 HG3 GLN A1569 -19.218 0.652 -9.151 1.00 0.00 H new ATOM 0 HE21 GLN A1569 -20.958 -1.381 -7.992 1.00 0.00 H new ATOM 0 HE22 GLN A1569 -21.715 -2.217 -9.352 1.00 0.00 H new ATOM 865 N THR A1570 -17.222 2.148 -7.869 1.00 0.00 N ATOM 866 CA THR A1570 -17.516 3.547 -7.678 1.00 0.00 C ATOM 867 C THR A1570 -16.247 4.294 -7.245 1.00 0.00 C ATOM 868 O THR A1570 -16.163 5.537 -7.293 1.00 0.00 O ATOM 869 CB THR A1570 -18.650 3.711 -6.642 1.00 0.00 C ATOM 870 OG1 THR A1570 -19.748 2.868 -7.046 1.00 0.00 O ATOM 871 CG2 THR A1570 -19.144 5.150 -6.568 1.00 0.00 C ATOM 0 H THR A1570 -17.451 1.558 -7.069 1.00 0.00 H new ATOM 0 HA THR A1570 -17.856 3.980 -8.619 1.00 0.00 H new ATOM 0 HB THR A1570 -18.267 3.435 -5.660 1.00 0.00 H new ATOM 0 HG1 THR A1570 -20.481 2.954 -6.401 1.00 0.00 H new ATOM 0 HG21 THR A1570 -19.941 5.223 -5.828 1.00 0.00 H new ATOM 0 HG22 THR A1570 -18.320 5.803 -6.280 1.00 0.00 H new ATOM 0 HG23 THR A1570 -19.525 5.455 -7.543 1.00 0.00 H new ATOM 879 N ARG A1571 -15.230 3.478 -6.892 1.00 0.00 N ATOM 880 CA ARG A1571 -13.920 3.935 -6.491 1.00 0.00 C ATOM 881 C ARG A1571 -13.979 4.662 -5.163 1.00 0.00 C ATOM 882 O ARG A1571 -13.568 5.810 -5.043 1.00 0.00 O ATOM 883 CB ARG A1571 -13.267 4.771 -7.609 1.00 0.00 C ATOM 884 CG ARG A1571 -12.925 3.948 -8.845 1.00 0.00 C ATOM 885 CD ARG A1571 -12.596 4.824 -10.038 1.00 0.00 C ATOM 886 NE ARG A1571 -13.795 5.498 -10.582 1.00 0.00 N ATOM 887 CZ ARG A1571 -13.779 6.515 -11.459 1.00 0.00 C ATOM 888 NH1 ARG A1571 -12.643 7.104 -11.779 1.00 0.00 N1+ ATOM 889 NH2 ARG A1571 -14.918 6.956 -11.987 1.00 0.00 N ATOM 0 H ARG A1571 -15.319 2.462 -6.884 1.00 0.00 H new ATOM 0 HA ARG A1571 -13.278 3.068 -6.335 1.00 0.00 H new ATOM 0 HB2 ARG A1571 -13.942 5.579 -7.892 1.00 0.00 H new ATOM 0 HB3 ARG A1571 -12.358 5.235 -7.225 1.00 0.00 H new ATOM 0 HG2 ARG A1571 -12.076 3.300 -8.626 1.00 0.00 H new ATOM 0 HG3 ARG A1571 -13.765 3.299 -9.092 1.00 0.00 H new ATOM 0 HD2 ARG A1571 -11.861 5.574 -9.745 1.00 0.00 H new ATOM 0 HD3 ARG A1571 -12.137 4.216 -10.818 1.00 0.00 H new ATOM 0 HE ARG A1571 -14.706 5.164 -10.266 1.00 0.00 H new ATOM 0 HH11 ARG A1571 -11.769 6.788 -11.360 1.00 0.00 H new ATOM 0 HH12 ARG A1571 -12.639 7.876 -12.446 1.00 0.00 H new ATOM 0 HH21 ARG A1571 -15.803 6.522 -11.726 1.00 0.00 H new ATOM 0 HH22 ARG A1571 -14.906 7.728 -12.653 1.00 0.00 H new ATOM 903 N ILE A1572 -14.493 3.964 -4.166 1.00 0.00 N ATOM 904 CA ILE A1572 -14.651 4.495 -2.827 1.00 0.00 C ATOM 905 C ILE A1572 -13.289 4.602 -2.174 1.00 0.00 C ATOM 906 O ILE A1572 -12.501 3.663 -2.221 1.00 0.00 O ATOM 907 CB ILE A1572 -15.583 3.588 -1.975 1.00 0.00 C ATOM 908 CG1 ILE A1572 -16.973 3.514 -2.625 1.00 0.00 C ATOM 909 CG2 ILE A1572 -15.682 4.092 -0.528 1.00 0.00 C ATOM 910 CD1 ILE A1572 -17.942 2.614 -1.899 1.00 0.00 C ATOM 0 H ILE A1572 -14.816 3.002 -4.266 1.00 0.00 H new ATOM 0 HA ILE A1572 -15.110 5.482 -2.889 1.00 0.00 H new ATOM 0 HB ILE A1572 -15.154 2.586 -1.942 1.00 0.00 H new ATOM 0 HG12 ILE A1572 -17.393 4.518 -2.675 1.00 0.00 H new ATOM 0 HG13 ILE A1572 -16.865 3.162 -3.651 1.00 0.00 H new ATOM 0 HG21 ILE A1572 -16.341 3.436 0.041 1.00 0.00 H new ATOM 0 HG22 ILE A1572 -14.691 4.093 -0.074 1.00 0.00 H new ATOM 0 HG23 ILE A1572 -16.085 5.105 -0.522 1.00 0.00 H new ATOM 0 HD11 ILE A1572 -18.900 2.615 -2.420 1.00 0.00 H new ATOM 0 HD12 ILE A1572 -17.545 1.599 -1.872 1.00 0.00 H new ATOM 0 HD13 ILE A1572 -18.082 2.976 -0.881 1.00 0.00 H new ATOM 922 N SER A1573 -13.009 5.734 -1.597 1.00 0.00 N ATOM 923 CA SER A1573 -11.726 5.986 -1.015 1.00 0.00 C ATOM 924 C SER A1573 -11.464 5.134 0.234 1.00 0.00 C ATOM 925 O SER A1573 -12.064 5.350 1.294 1.00 0.00 O ATOM 926 CB SER A1573 -11.611 7.471 -0.711 1.00 0.00 C ATOM 927 OG SER A1573 -12.764 7.935 0.000 1.00 0.00 O ATOM 0 H SER A1573 -13.667 6.510 -1.517 1.00 0.00 H new ATOM 0 HA SER A1573 -10.958 5.696 -1.732 1.00 0.00 H new ATOM 0 HB2 SER A1573 -10.714 7.657 -0.120 1.00 0.00 H new ATOM 0 HB3 SER A1573 -11.502 8.030 -1.641 1.00 0.00 H new ATOM 0 HG SER A1573 -13.176 7.186 0.480 1.00 0.00 H new ATOM 933 N VAL A1574 -10.552 4.199 0.105 1.00 0.00 N ATOM 934 CA VAL A1574 -10.163 3.343 1.203 1.00 0.00 C ATOM 935 C VAL A1574 -8.767 3.798 1.690 1.00 0.00 C ATOM 936 O VAL A1574 -7.921 3.020 2.138 1.00 0.00 O ATOM 937 CB VAL A1574 -10.240 1.805 0.804 1.00 0.00 C ATOM 938 CG1 VAL A1574 -9.294 1.431 -0.312 1.00 0.00 C ATOM 939 CG2 VAL A1574 -10.070 0.870 1.998 1.00 0.00 C ATOM 0 H VAL A1574 -10.057 4.009 -0.766 1.00 0.00 H new ATOM 0 HA VAL A1574 -10.862 3.439 2.034 1.00 0.00 H new ATOM 0 HB VAL A1574 -11.253 1.668 0.425 1.00 0.00 H new ATOM 0 HG11 VAL A1574 -9.397 0.369 -0.535 1.00 0.00 H new ATOM 0 HG12 VAL A1574 -9.533 2.014 -1.202 1.00 0.00 H new ATOM 0 HG13 VAL A1574 -8.269 1.640 -0.006 1.00 0.00 H new ATOM 0 HG21 VAL A1574 -10.132 -0.165 1.661 1.00 0.00 H new ATOM 0 HG22 VAL A1574 -9.098 1.043 2.461 1.00 0.00 H new ATOM 0 HG23 VAL A1574 -10.858 1.063 2.726 1.00 0.00 H new ATOM 949 N GLY A1575 -8.549 5.099 1.552 1.00 0.00 N ATOM 950 CA GLY A1575 -7.347 5.710 2.017 1.00 0.00 C ATOM 951 C GLY A1575 -6.878 6.843 1.126 1.00 0.00 C ATOM 952 O GLY A1575 -7.034 6.796 -0.101 1.00 0.00 O ATOM 0 H GLY A1575 -9.207 5.744 1.114 1.00 0.00 H new ATOM 0 HA2 GLY A1575 -7.506 6.090 3.026 1.00 0.00 H new ATOM 0 HA3 GLY A1575 -6.563 4.956 2.080 1.00 0.00 H new ATOM 956 N LYS A1576 -6.333 7.868 1.739 1.00 0.00 N ATOM 957 CA LYS A1576 -5.764 9.003 1.027 1.00 0.00 C ATOM 958 C LYS A1576 -4.361 8.650 0.590 1.00 0.00 C ATOM 959 O LYS A1576 -3.744 7.741 1.153 1.00 0.00 O ATOM 960 CB LYS A1576 -5.681 10.246 1.925 1.00 0.00 C ATOM 961 CG LYS A1576 -7.002 10.823 2.393 1.00 0.00 C ATOM 962 CD LYS A1576 -7.854 11.368 1.253 1.00 0.00 C ATOM 963 CE LYS A1576 -9.098 12.038 1.808 1.00 0.00 C ATOM 964 NZ LYS A1576 -9.991 12.533 0.750 1.00 0.00 N1+ ATOM 0 H LYS A1576 -6.269 7.944 2.754 1.00 0.00 H new ATOM 0 HA LYS A1576 -6.406 9.224 0.175 1.00 0.00 H new ATOM 0 HB2 LYS A1576 -5.086 9.995 2.803 1.00 0.00 H new ATOM 0 HB3 LYS A1576 -5.140 11.023 1.385 1.00 0.00 H new ATOM 0 HG2 LYS A1576 -7.562 10.051 2.920 1.00 0.00 H new ATOM 0 HG3 LYS A1576 -6.809 11.622 3.109 1.00 0.00 H new ATOM 0 HD2 LYS A1576 -7.277 12.083 0.667 1.00 0.00 H new ATOM 0 HD3 LYS A1576 -8.137 10.558 0.580 1.00 0.00 H new ATOM 0 HE2 LYS A1576 -9.640 11.329 2.434 1.00 0.00 H new ATOM 0 HE3 LYS A1576 -8.804 12.869 2.449 1.00 0.00 H new ATOM 0 HZ1 LYS A1576 -10.825 12.981 1.181 1.00 0.00 H new ATOM 0 HZ2 LYS A1576 -9.485 13.230 0.167 1.00 0.00 H new ATOM 0 HZ3 LYS A1576 -10.296 11.738 0.153 1.00 0.00 H new ATOM 978 N ALA A1577 -3.887 9.358 -0.405 1.00 0.00 N ATOM 979 CA ALA A1577 -2.551 9.214 -0.937 1.00 0.00 C ATOM 980 C ALA A1577 -1.541 9.436 0.162 1.00 0.00 C ATOM 981 O ALA A1577 -1.641 10.418 0.920 1.00 0.00 O ATOM 982 CB ALA A1577 -2.345 10.221 -2.044 1.00 0.00 C ATOM 0 H ALA A1577 -4.436 10.073 -0.883 1.00 0.00 H new ATOM 0 HA ALA A1577 -2.420 8.209 -1.337 1.00 0.00 H new ATOM 0 HB1 ALA A1577 -1.338 10.116 -2.449 1.00 0.00 H new ATOM 0 HB2 ALA A1577 -3.074 10.046 -2.835 1.00 0.00 H new ATOM 0 HB3 ALA A1577 -2.474 11.228 -1.648 1.00 0.00 H new ATOM 988 N ASN A1578 -0.601 8.548 0.270 1.00 0.00 N ATOM 989 CA ASN A1578 0.373 8.608 1.327 1.00 0.00 C ATOM 990 C ASN A1578 1.697 8.086 0.819 1.00 0.00 C ATOM 991 O ASN A1578 1.723 7.185 -0.029 1.00 0.00 O ATOM 992 CB ASN A1578 -0.118 7.771 2.519 1.00 0.00 C ATOM 993 CG ASN A1578 0.765 7.876 3.743 1.00 0.00 C ATOM 994 OD1 ASN A1578 1.427 8.884 3.961 1.00 0.00 O ATOM 995 ND2 ASN A1578 0.747 6.867 4.568 1.00 0.00 N ATOM 0 H ASN A1578 -0.484 7.761 -0.368 1.00 0.00 H new ATOM 0 HA ASN A1578 0.506 9.639 1.654 1.00 0.00 H new ATOM 0 HB2 ASN A1578 -1.127 8.088 2.782 1.00 0.00 H new ATOM 0 HB3 ASN A1578 -0.181 6.726 2.216 1.00 0.00 H new ATOM 0 HD21 ASN A1578 1.296 6.901 5.427 1.00 0.00 H new ATOM 0 HD22 ASN A1578 0.184 6.044 4.354 1.00 0.00 H new ATOM 1002 N LYS A1579 2.776 8.681 1.284 1.00 0.00 N ATOM 1003 CA LYS A1579 4.121 8.276 0.908 1.00 0.00 C ATOM 1004 C LYS A1579 4.941 8.014 2.167 1.00 0.00 C ATOM 1005 O LYS A1579 6.178 7.955 2.132 1.00 0.00 O ATOM 1006 CB LYS A1579 4.813 9.367 0.073 1.00 0.00 C ATOM 1007 CG LYS A1579 4.035 9.830 -1.147 1.00 0.00 C ATOM 1008 CD LYS A1579 4.857 10.800 -1.972 1.00 0.00 C ATOM 1009 CE LYS A1579 4.042 11.417 -3.094 1.00 0.00 C ATOM 1010 NZ LYS A1579 2.986 12.335 -2.591 1.00 0.00 N1+ ATOM 0 H LYS A1579 2.748 9.464 1.937 1.00 0.00 H new ATOM 0 HA LYS A1579 4.052 7.370 0.307 1.00 0.00 H new ATOM 0 HB2 LYS A1579 5.002 10.229 0.713 1.00 0.00 H new ATOM 0 HB3 LYS A1579 5.783 8.993 -0.254 1.00 0.00 H new ATOM 0 HG2 LYS A1579 3.760 8.969 -1.757 1.00 0.00 H new ATOM 0 HG3 LYS A1579 3.107 10.308 -0.833 1.00 0.00 H new ATOM 0 HD2 LYS A1579 5.243 11.589 -1.327 1.00 0.00 H new ATOM 0 HD3 LYS A1579 5.719 10.281 -2.392 1.00 0.00 H new ATOM 0 HE2 LYS A1579 4.706 11.964 -3.763 1.00 0.00 H new ATOM 0 HE3 LYS A1579 3.580 10.624 -3.682 1.00 0.00 H new ATOM 0 HZ1 LYS A1579 2.595 12.882 -3.384 1.00 0.00 H new ATOM 0 HZ2 LYS A1579 2.227 11.780 -2.146 1.00 0.00 H new ATOM 0 HZ3 LYS A1579 3.396 12.985 -1.891 1.00 0.00 H new ATOM 1024 N ARG A1580 4.251 7.890 3.284 1.00 0.00 N ATOM 1025 CA ARG A1580 4.887 7.633 4.557 1.00 0.00 C ATOM 1026 C ARG A1580 5.211 6.151 4.662 1.00 0.00 C ATOM 1027 O ARG A1580 4.398 5.347 5.119 1.00 0.00 O ATOM 1028 CB ARG A1580 3.958 8.108 5.698 1.00 0.00 C ATOM 1029 CG ARG A1580 4.490 7.983 7.135 1.00 0.00 C ATOM 1030 CD ARG A1580 5.864 8.614 7.301 1.00 0.00 C ATOM 1031 NE ARG A1580 5.978 9.906 6.627 1.00 0.00 N ATOM 1032 CZ ARG A1580 7.132 10.404 6.202 1.00 0.00 C ATOM 1033 NH1 ARG A1580 8.270 9.982 6.733 1.00 0.00 N1+ ATOM 1034 NH2 ARG A1580 7.156 11.375 5.319 1.00 0.00 N ATOM 0 H ARG A1580 3.235 7.965 3.332 1.00 0.00 H new ATOM 0 HA ARG A1580 5.822 8.186 4.640 1.00 0.00 H new ATOM 0 HB2 ARG A1580 3.711 9.154 5.519 1.00 0.00 H new ATOM 0 HB3 ARG A1580 3.027 7.545 5.632 1.00 0.00 H new ATOM 0 HG2 ARG A1580 3.789 8.458 7.822 1.00 0.00 H new ATOM 0 HG3 ARG A1580 4.541 6.930 7.410 1.00 0.00 H new ATOM 0 HD2 ARG A1580 6.074 8.743 8.363 1.00 0.00 H new ATOM 0 HD3 ARG A1580 6.621 7.936 6.907 1.00 0.00 H new ATOM 0 HE ARG A1580 5.129 10.451 6.476 1.00 0.00 H new ATOM 0 HH11 ARG A1580 8.259 9.275 7.468 1.00 0.00 H new ATOM 0 HH12 ARG A1580 9.158 10.364 6.407 1.00 0.00 H new ATOM 0 HH21 ARG A1580 6.282 11.753 4.953 1.00 0.00 H new ATOM 0 HH22 ARG A1580 8.048 11.751 4.999 1.00 0.00 H new ATOM 1048 N LEU A1581 6.396 5.806 4.234 1.00 0.00 N ATOM 1049 CA LEU A1581 6.848 4.440 4.228 1.00 0.00 C ATOM 1050 C LEU A1581 7.489 4.185 5.574 1.00 0.00 C ATOM 1051 O LEU A1581 8.340 4.961 6.017 1.00 0.00 O ATOM 1052 CB LEU A1581 7.877 4.253 3.087 1.00 0.00 C ATOM 1053 CG LEU A1581 8.100 2.824 2.518 1.00 0.00 C ATOM 1054 CD1 LEU A1581 9.177 2.836 1.460 1.00 0.00 C ATOM 1055 CD2 LEU A1581 8.446 1.807 3.582 1.00 0.00 C ATOM 0 H LEU A1581 7.081 6.471 3.876 1.00 0.00 H new ATOM 0 HA LEU A1581 6.028 3.741 4.062 1.00 0.00 H new ATOM 0 HB2 LEU A1581 7.576 4.896 2.260 1.00 0.00 H new ATOM 0 HB3 LEU A1581 8.839 4.622 3.444 1.00 0.00 H new ATOM 0 HG LEU A1581 7.150 2.521 2.079 1.00 0.00 H new ATOM 0 HD11 LEU A1581 9.319 1.827 1.074 1.00 0.00 H new ATOM 0 HD12 LEU A1581 8.880 3.498 0.646 1.00 0.00 H new ATOM 0 HD13 LEU A1581 10.111 3.192 1.895 1.00 0.00 H new ATOM 0 HD21 LEU A1581 8.589 0.831 3.119 1.00 0.00 H new ATOM 0 HD22 LEU A1581 9.364 2.107 4.087 1.00 0.00 H new ATOM 0 HD23 LEU A1581 7.635 1.749 4.308 1.00 0.00 H new ATOM 1067 N ARG A1582 7.049 3.163 6.251 1.00 0.00 N ATOM 1068 CA ARG A1582 7.593 2.821 7.550 1.00 0.00 C ATOM 1069 C ARG A1582 8.259 1.468 7.477 1.00 0.00 C ATOM 1070 O ARG A1582 7.710 0.545 6.872 1.00 0.00 O ATOM 1071 CB ARG A1582 6.478 2.784 8.609 1.00 0.00 C ATOM 1072 CG ARG A1582 5.704 4.096 8.814 1.00 0.00 C ATOM 1073 CD ARG A1582 6.549 5.212 9.436 1.00 0.00 C ATOM 1074 NE ARG A1582 7.651 5.667 8.565 1.00 0.00 N ATOM 1075 CZ ARG A1582 8.666 6.448 8.940 1.00 0.00 C ATOM 1076 NH1 ARG A1582 8.755 6.875 10.189 1.00 0.00 N1+ ATOM 1077 NH2 ARG A1582 9.607 6.774 8.053 1.00 0.00 N ATOM 0 H ARG A1582 6.308 2.542 5.927 1.00 0.00 H new ATOM 0 HA ARG A1582 8.323 3.579 7.834 1.00 0.00 H new ATOM 0 HB2 ARG A1582 5.767 2.005 8.334 1.00 0.00 H new ATOM 0 HB3 ARG A1582 6.918 2.492 9.562 1.00 0.00 H new ATOM 0 HG2 ARG A1582 5.319 4.436 7.853 1.00 0.00 H new ATOM 0 HG3 ARG A1582 4.842 3.904 9.453 1.00 0.00 H new ATOM 0 HD2 ARG A1582 5.904 6.060 9.667 1.00 0.00 H new ATOM 0 HD3 ARG A1582 6.964 4.860 10.381 1.00 0.00 H new ATOM 0 HE ARG A1582 7.635 5.358 7.593 1.00 0.00 H new ATOM 0 HH11 ARG A1582 8.046 6.607 10.871 1.00 0.00 H new ATOM 0 HH12 ARG A1582 9.533 7.472 10.470 1.00 0.00 H new ATOM 0 HH21 ARG A1582 9.548 6.427 7.096 1.00 0.00 H new ATOM 0 HH22 ARG A1582 10.386 7.371 8.332 1.00 0.00 H new ATOM 1091 N TYR A1583 9.431 1.350 8.053 1.00 0.00 N ATOM 1092 CA TYR A1583 10.100 0.072 8.115 1.00 0.00 C ATOM 1093 C TYR A1583 10.015 -0.441 9.545 1.00 0.00 C ATOM 1094 O TYR A1583 10.703 0.051 10.448 1.00 0.00 O ATOM 1095 CB TYR A1583 11.575 0.094 7.519 1.00 0.00 C ATOM 1096 CG TYR A1583 12.622 0.998 8.177 1.00 0.00 C ATOM 1097 CD1 TYR A1583 13.383 0.542 9.247 1.00 0.00 C ATOM 1098 CD2 TYR A1583 12.872 2.283 7.705 1.00 0.00 C ATOM 1099 CE1 TYR A1583 14.343 1.334 9.836 1.00 0.00 C ATOM 1100 CE2 TYR A1583 13.842 3.079 8.292 1.00 0.00 C ATOM 1101 CZ TYR A1583 14.570 2.599 9.356 1.00 0.00 C ATOM 1102 OH TYR A1583 15.540 3.388 9.940 1.00 0.00 O ATOM 0 H TYR A1583 9.941 2.121 8.485 1.00 0.00 H new ATOM 0 HA TYR A1583 9.588 -0.633 7.460 1.00 0.00 H new ATOM 0 HB2 TYR A1583 11.957 -0.927 7.545 1.00 0.00 H new ATOM 0 HB3 TYR A1583 11.503 0.381 6.470 1.00 0.00 H new ATOM 0 HD1 TYR A1583 13.218 -0.456 9.625 1.00 0.00 H new ATOM 0 HD2 TYR A1583 12.303 2.665 6.870 1.00 0.00 H new ATOM 0 HE1 TYR A1583 14.915 0.961 10.673 1.00 0.00 H new ATOM 0 HE2 TYR A1583 14.026 4.074 7.915 1.00 0.00 H new ATOM 0 HH TYR A1583 16.406 2.932 9.890 1.00 0.00 H new ATOM 1112 N VAL A1584 9.100 -1.355 9.778 1.00 0.00 N ATOM 1113 CA VAL A1584 8.862 -1.873 11.109 1.00 0.00 C ATOM 1114 C VAL A1584 8.914 -3.390 11.121 1.00 0.00 C ATOM 1115 O VAL A1584 8.289 -4.043 10.288 1.00 0.00 O ATOM 1116 CB VAL A1584 7.508 -1.365 11.723 1.00 0.00 C ATOM 1117 CG1 VAL A1584 7.570 0.128 12.018 1.00 0.00 C ATOM 1118 CG2 VAL A1584 6.325 -1.657 10.794 1.00 0.00 C ATOM 0 H VAL A1584 8.503 -1.759 9.056 1.00 0.00 H new ATOM 0 HA VAL A1584 9.664 -1.488 11.739 1.00 0.00 H new ATOM 0 HB VAL A1584 7.356 -1.907 12.657 1.00 0.00 H new ATOM 0 HG11 VAL A1584 6.621 0.455 12.442 1.00 0.00 H new ATOM 0 HG12 VAL A1584 8.372 0.325 12.729 1.00 0.00 H new ATOM 0 HG13 VAL A1584 7.762 0.674 11.094 1.00 0.00 H new ATOM 0 HG21 VAL A1584 5.405 -1.292 11.251 1.00 0.00 H new ATOM 0 HG22 VAL A1584 6.480 -1.155 9.839 1.00 0.00 H new ATOM 0 HG23 VAL A1584 6.247 -2.732 10.631 1.00 0.00 H new ATOM 1128 N ASP A1585 9.703 -3.934 12.038 1.00 0.00 N ATOM 1129 CA ASP A1585 9.868 -5.393 12.229 1.00 0.00 C ATOM 1130 C ASP A1585 10.312 -6.063 10.910 1.00 0.00 C ATOM 1131 O ASP A1585 9.791 -7.092 10.486 1.00 0.00 O ATOM 1132 CB ASP A1585 8.560 -6.006 12.788 1.00 0.00 C ATOM 1133 CG ASP A1585 8.693 -7.437 13.261 1.00 0.00 C ATOM 1134 OD1 ASP A1585 9.451 -7.690 14.215 1.00 0.00 O1- ATOM 1135 OD2 ASP A1585 8.004 -8.341 12.715 1.00 0.00 O ATOM 0 H ASP A1585 10.260 -3.377 12.686 1.00 0.00 H new ATOM 0 HA ASP A1585 10.655 -5.576 12.961 1.00 0.00 H new ATOM 0 HB2 ASP A1585 8.212 -5.392 13.619 1.00 0.00 H new ATOM 0 HB3 ASP A1585 7.793 -5.961 12.015 1.00 0.00 H new ATOM 1140 N GLN A1586 11.260 -5.401 10.258 1.00 0.00 N ATOM 1141 CA GLN A1586 11.850 -5.814 8.976 1.00 0.00 C ATOM 1142 C GLN A1586 10.858 -5.898 7.810 1.00 0.00 C ATOM 1143 O GLN A1586 11.147 -6.529 6.793 1.00 0.00 O ATOM 1144 CB GLN A1586 12.724 -7.091 9.069 1.00 0.00 C ATOM 1145 CG GLN A1586 14.112 -6.881 9.690 1.00 0.00 C ATOM 1146 CD GLN A1586 14.111 -6.611 11.183 1.00 0.00 C ATOM 1147 OE1 GLN A1586 13.262 -7.105 11.928 1.00 0.00 O ATOM 1148 NE2 GLN A1586 15.047 -5.817 11.631 1.00 0.00 N ATOM 0 H GLN A1586 11.657 -4.531 10.613 1.00 0.00 H new ATOM 0 HA GLN A1586 12.520 -4.988 8.739 1.00 0.00 H new ATOM 0 HB2 GLN A1586 12.189 -7.838 9.656 1.00 0.00 H new ATOM 0 HB3 GLN A1586 12.849 -7.502 8.067 1.00 0.00 H new ATOM 0 HG2 GLN A1586 14.718 -7.766 9.496 1.00 0.00 H new ATOM 0 HG3 GLN A1586 14.597 -6.046 9.185 1.00 0.00 H new ATOM 0 HE21 GLN A1586 15.734 -5.425 10.987 1.00 0.00 H new ATOM 0 HE22 GLN A1586 15.090 -5.589 12.624 1.00 0.00 H new ATOM 1157 N VAL A1587 9.701 -5.287 7.940 1.00 0.00 N ATOM 1158 CA VAL A1587 8.776 -5.230 6.829 1.00 0.00 C ATOM 1159 C VAL A1587 8.495 -3.782 6.501 1.00 0.00 C ATOM 1160 O VAL A1587 8.575 -2.902 7.379 1.00 0.00 O ATOM 1161 CB VAL A1587 7.428 -6.008 7.067 1.00 0.00 C ATOM 1162 CG1 VAL A1587 7.672 -7.450 7.463 1.00 0.00 C ATOM 1163 CG2 VAL A1587 6.512 -5.317 8.065 1.00 0.00 C ATOM 0 H VAL A1587 9.381 -4.828 8.793 1.00 0.00 H new ATOM 0 HA VAL A1587 9.256 -5.737 5.992 1.00 0.00 H new ATOM 0 HB VAL A1587 6.909 -6.004 6.108 1.00 0.00 H new ATOM 0 HG11 VAL A1587 6.717 -7.951 7.618 1.00 0.00 H new ATOM 0 HG12 VAL A1587 8.223 -7.957 6.671 1.00 0.00 H new ATOM 0 HG13 VAL A1587 8.252 -7.481 8.386 1.00 0.00 H new ATOM 0 HG21 VAL A1587 5.600 -5.901 8.187 1.00 0.00 H new ATOM 0 HG22 VAL A1587 7.019 -5.232 9.026 1.00 0.00 H new ATOM 0 HG23 VAL A1587 6.260 -4.322 7.699 1.00 0.00 H new ATOM 1173 N LEU A1588 8.203 -3.526 5.267 1.00 0.00 N ATOM 1174 CA LEU A1588 7.917 -2.195 4.821 1.00 0.00 C ATOM 1175 C LEU A1588 6.420 -2.023 4.774 1.00 0.00 C ATOM 1176 O LEU A1588 5.720 -2.861 4.231 1.00 0.00 O ATOM 1177 CB LEU A1588 8.546 -1.939 3.444 1.00 0.00 C ATOM 1178 CG LEU A1588 10.080 -2.003 3.366 1.00 0.00 C ATOM 1179 CD1 LEU A1588 10.555 -1.719 1.959 1.00 0.00 C ATOM 1180 CD2 LEU A1588 10.724 -1.035 4.338 1.00 0.00 C ATOM 0 H LEU A1588 8.155 -4.235 4.535 1.00 0.00 H new ATOM 0 HA LEU A1588 8.347 -1.469 5.511 1.00 0.00 H new ATOM 0 HB2 LEU A1588 8.138 -2.667 2.743 1.00 0.00 H new ATOM 0 HB3 LEU A1588 8.228 -0.954 3.102 1.00 0.00 H new ATOM 0 HG LEU A1588 10.381 -3.013 3.643 1.00 0.00 H new ATOM 0 HD11 LEU A1588 11.643 -1.769 1.925 1.00 0.00 H new ATOM 0 HD12 LEU A1588 10.136 -2.459 1.277 1.00 0.00 H new ATOM 0 HD13 LEU A1588 10.228 -0.723 1.659 1.00 0.00 H new ATOM 0 HD21 LEU A1588 11.809 -1.106 4.257 1.00 0.00 H new ATOM 0 HD22 LEU A1588 10.408 -0.019 4.102 1.00 0.00 H new ATOM 0 HD23 LEU A1588 10.419 -1.283 5.355 1.00 0.00 H new ATOM 1192 N GLN A1589 5.923 -0.987 5.367 1.00 0.00 N ATOM 1193 CA GLN A1589 4.502 -0.797 5.421 1.00 0.00 C ATOM 1194 C GLN A1589 4.077 0.527 4.814 1.00 0.00 C ATOM 1195 O GLN A1589 4.677 1.584 5.097 1.00 0.00 O ATOM 1196 CB GLN A1589 4.010 -0.888 6.870 1.00 0.00 C ATOM 1197 CG GLN A1589 2.501 -0.759 7.020 1.00 0.00 C ATOM 1198 CD GLN A1589 2.056 -0.749 8.460 1.00 0.00 C ATOM 1199 OE1 GLN A1589 1.963 0.307 9.084 1.00 0.00 O ATOM 1200 NE2 GLN A1589 1.764 -1.904 8.995 1.00 0.00 N ATOM 0 H GLN A1589 6.474 -0.259 5.821 1.00 0.00 H new ATOM 0 HA GLN A1589 4.048 -1.591 4.829 1.00 0.00 H new ATOM 0 HB2 GLN A1589 4.327 -1.842 7.291 1.00 0.00 H new ATOM 0 HB3 GLN A1589 4.491 -0.105 7.456 1.00 0.00 H new ATOM 0 HG2 GLN A1589 2.170 0.159 6.536 1.00 0.00 H new ATOM 0 HG3 GLN A1589 2.017 -1.586 6.501 1.00 0.00 H new ATOM 0 HE21 GLN A1589 1.854 -2.758 8.445 1.00 0.00 H new ATOM 0 HE22 GLN A1589 1.446 -1.952 9.963 1.00 0.00 H new ATOM 1209 N LEU A1590 3.067 0.459 3.976 1.00 0.00 N ATOM 1210 CA LEU A1590 2.400 1.622 3.443 1.00 0.00 C ATOM 1211 C LEU A1590 0.949 1.551 3.858 1.00 0.00 C ATOM 1212 O LEU A1590 0.264 0.556 3.594 1.00 0.00 O ATOM 1213 CB LEU A1590 2.499 1.704 1.904 1.00 0.00 C ATOM 1214 CG LEU A1590 3.865 2.075 1.308 1.00 0.00 C ATOM 1215 CD1 LEU A1590 3.803 2.045 -0.213 1.00 0.00 C ATOM 1216 CD2 LEU A1590 4.285 3.462 1.774 1.00 0.00 C ATOM 0 H LEU A1590 2.680 -0.423 3.641 1.00 0.00 H new ATOM 0 HA LEU A1590 2.885 2.515 3.837 1.00 0.00 H new ATOM 0 HB2 LEU A1590 2.203 0.738 1.494 1.00 0.00 H new ATOM 0 HB3 LEU A1590 1.769 2.435 1.557 1.00 0.00 H new ATOM 0 HG LEU A1590 4.599 1.346 1.650 1.00 0.00 H new ATOM 0 HD11 LEU A1590 4.778 2.310 -0.622 1.00 0.00 H new ATOM 0 HD12 LEU A1590 3.529 1.044 -0.546 1.00 0.00 H new ATOM 0 HD13 LEU A1590 3.057 2.760 -0.561 1.00 0.00 H new ATOM 0 HD21 LEU A1590 5.255 3.712 1.344 1.00 0.00 H new ATOM 0 HD22 LEU A1590 3.545 4.194 1.451 1.00 0.00 H new ATOM 0 HD23 LEU A1590 4.356 3.474 2.862 1.00 0.00 H new ATOM 1228 N VAL A1591 0.490 2.559 4.529 1.00 0.00 N ATOM 1229 CA VAL A1591 -0.876 2.605 4.962 1.00 0.00 C ATOM 1230 C VAL A1591 -1.583 3.756 4.283 1.00 0.00 C ATOM 1231 O VAL A1591 -1.020 4.840 4.124 1.00 0.00 O ATOM 1232 CB VAL A1591 -1.005 2.713 6.530 1.00 0.00 C ATOM 1233 CG1 VAL A1591 -0.357 3.983 7.076 1.00 0.00 C ATOM 1234 CG2 VAL A1591 -2.464 2.633 6.974 1.00 0.00 C ATOM 0 H VAL A1591 1.046 3.372 4.793 1.00 0.00 H new ATOM 0 HA VAL A1591 -1.351 1.666 4.676 1.00 0.00 H new ATOM 0 HB VAL A1591 -0.467 1.861 6.945 1.00 0.00 H new ATOM 0 HG11 VAL A1591 -0.471 4.013 8.160 1.00 0.00 H new ATOM 0 HG12 VAL A1591 0.703 3.988 6.823 1.00 0.00 H new ATOM 0 HG13 VAL A1591 -0.840 4.856 6.636 1.00 0.00 H new ATOM 0 HG21 VAL A1591 -2.519 2.710 8.060 1.00 0.00 H new ATOM 0 HG22 VAL A1591 -3.027 3.450 6.523 1.00 0.00 H new ATOM 0 HG23 VAL A1591 -2.889 1.681 6.656 1.00 0.00 H new ATOM 1244 N TYR A1592 -2.762 3.510 3.824 1.00 0.00 N ATOM 1245 CA TYR A1592 -3.563 4.536 3.252 1.00 0.00 C ATOM 1246 C TYR A1592 -4.718 4.799 4.181 1.00 0.00 C ATOM 1247 O TYR A1592 -5.695 4.072 4.199 1.00 0.00 O ATOM 1248 CB TYR A1592 -4.018 4.175 1.831 1.00 0.00 C ATOM 1249 CG TYR A1592 -2.860 4.016 0.869 1.00 0.00 C ATOM 1250 CD1 TYR A1592 -2.176 5.128 0.392 1.00 0.00 C ATOM 1251 CD2 TYR A1592 -2.438 2.763 0.455 1.00 0.00 C ATOM 1252 CE1 TYR A1592 -1.109 4.997 -0.471 1.00 0.00 C ATOM 1253 CE2 TYR A1592 -1.369 2.626 -0.406 1.00 0.00 C ATOM 1254 CZ TYR A1592 -0.711 3.745 -0.868 1.00 0.00 C ATOM 1255 OH TYR A1592 0.353 3.603 -1.731 1.00 0.00 O ATOM 0 H TYR A1592 -3.199 2.588 3.835 1.00 0.00 H new ATOM 0 HA TYR A1592 -2.979 5.450 3.142 1.00 0.00 H new ATOM 0 HB2 TYR A1592 -4.589 3.247 1.862 1.00 0.00 H new ATOM 0 HB3 TYR A1592 -4.689 4.950 1.461 1.00 0.00 H new ATOM 0 HD1 TYR A1592 -2.487 6.114 0.704 1.00 0.00 H new ATOM 0 HD2 TYR A1592 -2.952 1.883 0.811 1.00 0.00 H new ATOM 0 HE1 TYR A1592 -0.590 5.873 -0.832 1.00 0.00 H new ATOM 0 HE2 TYR A1592 -1.048 1.643 -0.718 1.00 0.00 H new ATOM 0 HH TYR A1592 0.078 3.066 -2.503 1.00 0.00 H new ATOM 1265 N LYS A1593 -4.546 5.799 4.997 1.00 0.00 N ATOM 1266 CA LYS A1593 -5.509 6.191 6.009 1.00 0.00 C ATOM 1267 C LYS A1593 -6.297 7.426 5.558 1.00 0.00 C ATOM 1268 O LYS A1593 -6.034 7.960 4.470 1.00 0.00 O ATOM 1269 CB LYS A1593 -4.758 6.450 7.343 1.00 0.00 C ATOM 1270 CG LYS A1593 -3.532 7.363 7.204 1.00 0.00 C ATOM 1271 CD LYS A1593 -2.744 7.517 8.513 1.00 0.00 C ATOM 1272 CE LYS A1593 -3.436 8.422 9.536 1.00 0.00 C ATOM 1273 NZ LYS A1593 -3.487 9.835 9.091 1.00 0.00 N1+ ATOM 0 H LYS A1593 -3.712 6.386 4.984 1.00 0.00 H new ATOM 0 HA LYS A1593 -6.232 5.389 6.160 1.00 0.00 H new ATOM 0 HB2 LYS A1593 -5.451 6.896 8.057 1.00 0.00 H new ATOM 0 HB3 LYS A1593 -4.441 5.494 7.761 1.00 0.00 H new ATOM 0 HG2 LYS A1593 -2.872 6.961 6.435 1.00 0.00 H new ATOM 0 HG3 LYS A1593 -3.856 8.347 6.864 1.00 0.00 H new ATOM 0 HD2 LYS A1593 -2.591 6.532 8.955 1.00 0.00 H new ATOM 0 HD3 LYS A1593 -1.757 7.922 8.289 1.00 0.00 H new ATOM 0 HE2 LYS A1593 -4.450 8.061 9.710 1.00 0.00 H new ATOM 0 HE3 LYS A1593 -2.908 8.362 10.488 1.00 0.00 H new ATOM 0 HZ1 LYS A1593 -3.419 10.462 9.918 1.00 0.00 H new ATOM 0 HZ2 LYS A1593 -2.693 10.025 8.446 1.00 0.00 H new ATOM 0 HZ3 LYS A1593 -4.385 10.011 8.596 1.00 0.00 H new ATOM 1287 N ASP A1594 -7.262 7.843 6.381 1.00 0.00 N ATOM 1288 CA ASP A1594 -8.098 9.050 6.155 1.00 0.00 C ATOM 1289 C ASP A1594 -9.062 8.887 4.990 1.00 0.00 C ATOM 1290 O ASP A1594 -9.327 9.841 4.248 1.00 0.00 O ATOM 1291 CB ASP A1594 -7.260 10.339 5.982 1.00 0.00 C ATOM 1292 CG ASP A1594 -6.464 10.706 7.199 1.00 0.00 C ATOM 1293 OD1 ASP A1594 -7.057 11.164 8.194 1.00 0.00 O1- ATOM 1294 OD2 ASP A1594 -5.214 10.547 7.189 1.00 0.00 O ATOM 0 H ASP A1594 -7.498 7.350 7.242 1.00 0.00 H new ATOM 0 HA ASP A1594 -8.688 9.159 7.065 1.00 0.00 H new ATOM 0 HB2 ASP A1594 -6.581 10.210 5.139 1.00 0.00 H new ATOM 0 HB3 ASP A1594 -7.926 11.165 5.731 1.00 0.00 H new ATOM 1299 N GLY A1595 -9.616 7.710 4.860 1.00 0.00 N ATOM 1300 CA GLY A1595 -10.521 7.427 3.776 1.00 0.00 C ATOM 1301 C GLY A1595 -11.952 7.754 4.141 1.00 0.00 C ATOM 1302 O GLY A1595 -12.223 8.755 4.837 1.00 0.00 O ATOM 0 H GLY A1595 -9.455 6.928 5.495 1.00 0.00 H new ATOM 0 HA2 GLY A1595 -10.229 8.003 2.898 1.00 0.00 H new ATOM 0 HA3 GLY A1595 -10.446 6.374 3.505 1.00 0.00 H new ATOM 1306 N SER A1596 -12.870 6.955 3.668 1.00 0.00 N ATOM 1307 CA SER A1596 -14.270 7.132 3.968 1.00 0.00 C ATOM 1308 C SER A1596 -14.562 6.698 5.424 1.00 0.00 C ATOM 1309 O SER A1596 -14.189 5.603 5.826 1.00 0.00 O ATOM 1310 CB SER A1596 -15.076 6.323 2.963 1.00 0.00 C ATOM 1311 OG SER A1596 -14.759 6.753 1.638 1.00 0.00 O ATOM 0 H SER A1596 -12.670 6.160 3.062 1.00 0.00 H new ATOM 0 HA SER A1596 -14.553 8.182 3.887 1.00 0.00 H new ATOM 0 HB2 SER A1596 -14.855 5.261 3.074 1.00 0.00 H new ATOM 0 HB3 SER A1596 -16.142 6.448 3.152 1.00 0.00 H new ATOM 0 HG SER A1596 -15.538 6.625 1.057 1.00 0.00 H new ATOM 1317 N PRO A1597 -15.185 7.579 6.239 1.00 0.00 N ATOM 1318 CA PRO A1597 -15.460 7.302 7.660 1.00 0.00 C ATOM 1319 C PRO A1597 -16.489 6.177 7.895 1.00 0.00 C ATOM 1320 O PRO A1597 -17.386 5.927 7.069 1.00 0.00 O ATOM 1321 CB PRO A1597 -16.003 8.633 8.196 1.00 0.00 C ATOM 1322 CG PRO A1597 -15.648 9.645 7.166 1.00 0.00 C ATOM 1323 CD PRO A1597 -15.653 8.924 5.861 1.00 0.00 C ATOM 0 HA PRO A1597 -14.558 6.949 8.160 1.00 0.00 H new ATOM 0 HB2 PRO A1597 -17.082 8.586 8.346 1.00 0.00 H new ATOM 0 HB3 PRO A1597 -15.558 8.880 9.160 1.00 0.00 H new ATOM 0 HG2 PRO A1597 -16.366 10.465 7.161 1.00 0.00 H new ATOM 0 HG3 PRO A1597 -14.669 10.080 7.368 1.00 0.00 H new ATOM 0 HD2 PRO A1597 -16.648 8.897 5.416 1.00 0.00 H new ATOM 0 HD3 PRO A1597 -14.991 9.395 5.134 1.00 0.00 H new ATOM 1331 N CYS A1598 -16.369 5.544 9.038 1.00 0.00 N ATOM 1332 CA CYS A1598 -17.214 4.430 9.434 1.00 0.00 C ATOM 1333 C CYS A1598 -17.928 4.789 10.741 1.00 0.00 C ATOM 1334 O CYS A1598 -17.401 5.557 11.548 1.00 0.00 O ATOM 1335 CB CYS A1598 -16.334 3.197 9.664 1.00 0.00 C ATOM 1336 SG CYS A1598 -15.347 2.709 8.220 1.00 0.00 S ATOM 0 H CYS A1598 -15.668 5.790 9.737 1.00 0.00 H new ATOM 0 HA CYS A1598 -17.948 4.221 8.656 1.00 0.00 H new ATOM 0 HB2 CYS A1598 -15.662 3.394 10.500 1.00 0.00 H new ATOM 0 HB3 CYS A1598 -16.969 2.360 9.956 1.00 0.00 H new ATOM 1406 N LEU A1604 -12.627 5.658 12.601 1.00 0.00 N ATOM 1407 CA LEU A1604 -13.539 5.911 11.521 1.00 0.00 C ATOM 1408 C LEU A1604 -12.832 6.289 10.220 1.00 0.00 C ATOM 1409 O LEU A1604 -12.680 7.453 9.880 1.00 0.00 O ATOM 1410 CB LEU A1604 -14.676 6.901 11.930 1.00 0.00 C ATOM 1411 CG LEU A1604 -14.353 8.102 12.873 1.00 0.00 C ATOM 1412 CD1 LEU A1604 -13.400 9.111 12.260 1.00 0.00 C ATOM 1413 CD2 LEU A1604 -15.639 8.792 13.292 1.00 0.00 C ATOM 0 HA LEU A1604 -14.035 4.965 11.303 1.00 0.00 H new ATOM 0 HB2 LEU A1604 -15.096 7.312 11.012 1.00 0.00 H new ATOM 0 HB3 LEU A1604 -15.462 6.315 12.406 1.00 0.00 H new ATOM 0 HG LEU A1604 -13.847 7.686 13.744 1.00 0.00 H new ATOM 0 HD11 LEU A1604 -13.219 9.919 12.969 1.00 0.00 H new ATOM 0 HD12 LEU A1604 -12.456 8.621 12.020 1.00 0.00 H new ATOM 0 HD13 LEU A1604 -13.839 9.519 11.350 1.00 0.00 H new ATOM 0 HD21 LEU A1604 -15.405 9.629 13.950 1.00 0.00 H new ATOM 0 HD22 LEU A1604 -16.159 9.160 12.408 1.00 0.00 H new ATOM 0 HD23 LEU A1604 -16.277 8.083 13.820 1.00 0.00 H new ATOM 1425 N SER A1605 -12.482 5.277 9.467 1.00 0.00 N ATOM 1426 CA SER A1605 -11.819 5.433 8.207 1.00 0.00 C ATOM 1427 C SER A1605 -11.610 4.096 7.561 1.00 0.00 C ATOM 1428 O SER A1605 -11.051 3.190 8.176 1.00 0.00 O ATOM 1429 CB SER A1605 -10.436 6.111 8.385 1.00 0.00 C ATOM 1430 OG SER A1605 -9.707 6.168 7.154 1.00 0.00 O ATOM 0 H SER A1605 -12.655 4.305 9.722 1.00 0.00 H new ATOM 0 HA SER A1605 -12.452 6.060 7.579 1.00 0.00 H new ATOM 0 HB2 SER A1605 -10.574 7.120 8.772 1.00 0.00 H new ATOM 0 HB3 SER A1605 -9.855 5.562 9.126 1.00 0.00 H new ATOM 0 HG SER A1605 -8.800 5.823 7.294 1.00 0.00 H new ATOM 1436 N TYR A1606 -12.107 3.959 6.362 1.00 0.00 N ATOM 1437 CA TYR A1606 -11.726 2.869 5.518 1.00 0.00 C ATOM 1438 C TYR A1606 -10.275 3.077 5.179 1.00 0.00 C ATOM 1439 O TYR A1606 -9.901 4.146 4.677 1.00 0.00 O ATOM 1440 CB TYR A1606 -12.574 2.822 4.240 1.00 0.00 C ATOM 1441 CG TYR A1606 -13.902 2.122 4.400 1.00 0.00 C ATOM 1442 CD1 TYR A1606 -13.969 0.742 4.317 1.00 0.00 C ATOM 1443 CD2 TYR A1606 -15.078 2.824 4.621 1.00 0.00 C ATOM 1444 CE1 TYR A1606 -15.161 0.077 4.453 1.00 0.00 C ATOM 1445 CE2 TYR A1606 -16.286 2.163 4.758 1.00 0.00 C ATOM 1446 CZ TYR A1606 -16.318 0.786 4.673 1.00 0.00 C ATOM 1447 OH TYR A1606 -17.516 0.109 4.817 1.00 0.00 O ATOM 0 H TYR A1606 -12.784 4.599 5.947 1.00 0.00 H new ATOM 0 HA TYR A1606 -11.885 1.919 6.029 1.00 0.00 H new ATOM 0 HB2 TYR A1606 -12.753 3.842 3.899 1.00 0.00 H new ATOM 0 HB3 TYR A1606 -12.004 2.320 3.458 1.00 0.00 H new ATOM 0 HD1 TYR A1606 -13.065 0.178 4.142 1.00 0.00 H new ATOM 0 HD2 TYR A1606 -15.050 3.902 4.687 1.00 0.00 H new ATOM 0 HE1 TYR A1606 -15.190 -1.001 4.387 1.00 0.00 H new ATOM 0 HE2 TYR A1606 -17.195 2.720 4.930 1.00 0.00 H new ATOM 0 HH TYR A1606 -18.239 0.753 4.968 1.00 0.00 H new ATOM 1457 N LYS A1607 -9.460 2.136 5.537 1.00 0.00 N ATOM 1458 CA LYS A1607 -8.051 2.254 5.318 1.00 0.00 C ATOM 1459 C LYS A1607 -7.460 0.933 4.881 1.00 0.00 C ATOM 1460 O LYS A1607 -7.928 -0.149 5.282 1.00 0.00 O ATOM 1461 CB LYS A1607 -7.366 2.775 6.589 1.00 0.00 C ATOM 1462 CG LYS A1607 -7.600 1.913 7.819 1.00 0.00 C ATOM 1463 CD LYS A1607 -6.957 2.497 9.064 1.00 0.00 C ATOM 1464 CE LYS A1607 -7.549 3.853 9.425 1.00 0.00 C ATOM 1465 NZ LYS A1607 -7.001 4.371 10.687 1.00 0.00 N1+ ATOM 0 H LYS A1607 -9.749 1.268 5.987 1.00 0.00 H new ATOM 0 HA LYS A1607 -7.880 2.970 4.514 1.00 0.00 H new ATOM 0 HB2 LYS A1607 -6.294 2.846 6.407 1.00 0.00 H new ATOM 0 HB3 LYS A1607 -7.723 3.785 6.793 1.00 0.00 H new ATOM 0 HG2 LYS A1607 -8.672 1.803 7.984 1.00 0.00 H new ATOM 0 HG3 LYS A1607 -7.201 0.914 7.641 1.00 0.00 H new ATOM 0 HD2 LYS A1607 -7.090 1.809 9.899 1.00 0.00 H new ATOM 0 HD3 LYS A1607 -5.884 2.600 8.904 1.00 0.00 H new ATOM 0 HE2 LYS A1607 -7.347 4.563 8.623 1.00 0.00 H new ATOM 0 HE3 LYS A1607 -8.632 3.766 9.508 1.00 0.00 H new ATOM 0 HZ1 LYS A1607 -7.429 5.295 10.898 1.00 0.00 H new ATOM 0 HZ2 LYS A1607 -7.216 3.706 11.457 1.00 0.00 H new ATOM 0 HZ3 LYS A1607 -5.970 4.478 10.600 1.00 0.00 H new ATOM 1479 N SER A1608 -6.466 1.010 4.063 1.00 0.00 N ATOM 1480 CA SER A1608 -5.810 -0.151 3.573 1.00 0.00 C ATOM 1481 C SER A1608 -4.373 -0.153 4.065 1.00 0.00 C ATOM 1482 O SER A1608 -3.704 0.894 4.075 1.00 0.00 O ATOM 1483 CB SER A1608 -5.883 -0.191 2.036 1.00 0.00 C ATOM 1484 OG SER A1608 -5.376 -1.411 1.519 1.00 0.00 O ATOM 0 H SER A1608 -6.084 1.889 3.713 1.00 0.00 H new ATOM 0 HA SER A1608 -6.306 -1.047 3.947 1.00 0.00 H new ATOM 0 HB2 SER A1608 -6.917 -0.062 1.717 1.00 0.00 H new ATOM 0 HB3 SER A1608 -5.316 0.643 1.623 1.00 0.00 H new ATOM 0 HG SER A1608 -6.115 -2.038 1.376 1.00 0.00 H new ATOM 1490 N VAL A1609 -3.925 -1.294 4.514 1.00 0.00 N ATOM 1491 CA VAL A1609 -2.583 -1.457 4.997 1.00 0.00 C ATOM 1492 C VAL A1609 -1.871 -2.443 4.097 1.00 0.00 C ATOM 1493 O VAL A1609 -2.201 -3.634 4.092 1.00 0.00 O ATOM 1494 CB VAL A1609 -2.555 -1.994 6.461 1.00 0.00 C ATOM 1495 CG1 VAL A1609 -1.123 -2.146 6.959 1.00 0.00 C ATOM 1496 CG2 VAL A1609 -3.335 -1.087 7.397 1.00 0.00 C ATOM 0 H VAL A1609 -4.488 -2.144 4.555 1.00 0.00 H new ATOM 0 HA VAL A1609 -2.091 -0.484 4.989 1.00 0.00 H new ATOM 0 HB VAL A1609 -3.031 -2.975 6.456 1.00 0.00 H new ATOM 0 HG11 VAL A1609 -1.132 -2.522 7.982 1.00 0.00 H new ATOM 0 HG12 VAL A1609 -0.588 -2.848 6.319 1.00 0.00 H new ATOM 0 HG13 VAL A1609 -0.624 -1.177 6.932 1.00 0.00 H new ATOM 0 HG21 VAL A1609 -3.296 -1.489 8.409 1.00 0.00 H new ATOM 0 HG22 VAL A1609 -2.897 -0.089 7.386 1.00 0.00 H new ATOM 0 HG23 VAL A1609 -4.373 -1.031 7.068 1.00 0.00 H new ATOM 1506 N ILE A1610 -0.945 -1.962 3.318 1.00 0.00 N ATOM 1507 CA ILE A1610 -0.178 -2.819 2.462 1.00 0.00 C ATOM 1508 C ILE A1610 1.139 -3.118 3.153 1.00 0.00 C ATOM 1509 O ILE A1610 1.961 -2.215 3.381 1.00 0.00 O ATOM 1510 CB ILE A1610 0.073 -2.187 1.067 1.00 0.00 C ATOM 1511 CG1 ILE A1610 -1.269 -1.838 0.397 1.00 0.00 C ATOM 1512 CG2 ILE A1610 0.879 -3.149 0.185 1.00 0.00 C ATOM 1513 CD1 ILE A1610 -1.133 -1.186 -0.963 1.00 0.00 C ATOM 0 H ILE A1610 -0.702 -0.973 3.258 1.00 0.00 H new ATOM 0 HA ILE A1610 -0.740 -3.736 2.287 1.00 0.00 H new ATOM 0 HB ILE A1610 0.649 -1.270 1.193 1.00 0.00 H new ATOM 0 HG12 ILE A1610 -1.858 -2.749 0.293 1.00 0.00 H new ATOM 0 HG13 ILE A1610 -1.827 -1.170 1.053 1.00 0.00 H new ATOM 0 HG21 ILE A1610 1.048 -2.693 -0.791 1.00 0.00 H new ATOM 0 HG22 ILE A1610 1.838 -3.359 0.658 1.00 0.00 H new ATOM 0 HG23 ILE A1610 0.324 -4.079 0.060 1.00 0.00 H new ATOM 0 HD11 ILE A1610 -2.123 -0.973 -1.365 1.00 0.00 H new ATOM 0 HD12 ILE A1610 -0.573 -0.256 -0.866 1.00 0.00 H new ATOM 0 HD13 ILE A1610 -0.605 -1.859 -1.638 1.00 0.00 H new ATOM 1525 N SER A1611 1.312 -4.347 3.539 1.00 0.00 N ATOM 1526 CA SER A1611 2.487 -4.756 4.244 1.00 0.00 C ATOM 1527 C SER A1611 3.408 -5.548 3.320 1.00 0.00 C ATOM 1528 O SER A1611 3.051 -6.630 2.836 1.00 0.00 O ATOM 1529 CB SER A1611 2.061 -5.579 5.448 1.00 0.00 C ATOM 1530 OG SER A1611 1.093 -4.856 6.205 1.00 0.00 O ATOM 0 H SER A1611 0.639 -5.095 3.373 1.00 0.00 H new ATOM 0 HA SER A1611 3.047 -3.886 4.588 1.00 0.00 H new ATOM 0 HB2 SER A1611 1.644 -6.531 5.121 1.00 0.00 H new ATOM 0 HB3 SER A1611 2.927 -5.807 6.070 1.00 0.00 H new ATOM 0 HG SER A1611 0.819 -5.390 6.980 1.00 0.00 H new ATOM 1536 N PHE A1612 4.559 -4.993 3.055 1.00 0.00 N ATOM 1537 CA PHE A1612 5.541 -5.603 2.200 1.00 0.00 C ATOM 1538 C PHE A1612 6.471 -6.439 3.057 1.00 0.00 C ATOM 1539 O PHE A1612 7.376 -5.911 3.720 1.00 0.00 O ATOM 1540 CB PHE A1612 6.352 -4.535 1.443 1.00 0.00 C ATOM 1541 CG PHE A1612 5.532 -3.586 0.601 1.00 0.00 C ATOM 1542 CD1 PHE A1612 5.042 -2.401 1.139 1.00 0.00 C ATOM 1543 CD2 PHE A1612 5.256 -3.874 -0.722 1.00 0.00 C ATOM 1544 CE1 PHE A1612 4.295 -1.535 0.371 1.00 0.00 C ATOM 1545 CE2 PHE A1612 4.508 -3.008 -1.495 1.00 0.00 C ATOM 1546 CZ PHE A1612 4.028 -1.838 -0.950 1.00 0.00 C ATOM 0 H PHE A1612 4.846 -4.090 3.433 1.00 0.00 H new ATOM 0 HA PHE A1612 5.037 -6.228 1.463 1.00 0.00 H new ATOM 0 HB2 PHE A1612 6.923 -3.953 2.167 1.00 0.00 H new ATOM 0 HB3 PHE A1612 7.073 -5.038 0.798 1.00 0.00 H new ATOM 0 HD1 PHE A1612 5.249 -2.157 2.170 1.00 0.00 H new ATOM 0 HD2 PHE A1612 5.630 -4.789 -1.157 1.00 0.00 H new ATOM 0 HE1 PHE A1612 3.918 -0.619 0.802 1.00 0.00 H new ATOM 0 HE2 PHE A1612 4.299 -3.248 -2.527 1.00 0.00 H new ATOM 0 HZ PHE A1612 3.444 -1.159 -1.554 1.00 0.00 H new ATOM 1556 N VAL A1613 6.230 -7.717 3.068 1.00 0.00 N ATOM 1557 CA VAL A1613 7.009 -8.649 3.839 1.00 0.00 C ATOM 1558 C VAL A1613 8.115 -9.160 2.938 1.00 0.00 C ATOM 1559 O VAL A1613 7.881 -9.415 1.748 1.00 0.00 O ATOM 1560 CB VAL A1613 6.142 -9.846 4.323 1.00 0.00 C ATOM 1561 CG1 VAL A1613 6.917 -10.730 5.280 1.00 0.00 C ATOM 1562 CG2 VAL A1613 4.859 -9.364 4.974 1.00 0.00 C ATOM 0 H VAL A1613 5.476 -8.151 2.535 1.00 0.00 H new ATOM 0 HA VAL A1613 7.408 -8.153 4.724 1.00 0.00 H new ATOM 0 HB VAL A1613 5.881 -10.437 3.445 1.00 0.00 H new ATOM 0 HG11 VAL A1613 6.286 -11.558 5.602 1.00 0.00 H new ATOM 0 HG12 VAL A1613 7.802 -11.121 4.778 1.00 0.00 H new ATOM 0 HG13 VAL A1613 7.221 -10.147 6.149 1.00 0.00 H new ATOM 0 HG21 VAL A1613 4.273 -10.222 5.303 1.00 0.00 H new ATOM 0 HG22 VAL A1613 5.100 -8.739 5.834 1.00 0.00 H new ATOM 0 HG23 VAL A1613 4.281 -8.784 4.254 1.00 0.00 H new ATOM 1572 N CYS A1614 9.294 -9.302 3.468 1.00 0.00 N ATOM 1573 CA CYS A1614 10.404 -9.697 2.659 1.00 0.00 C ATOM 1574 C CYS A1614 10.445 -11.190 2.445 1.00 0.00 C ATOM 1575 O CYS A1614 10.216 -11.980 3.370 1.00 0.00 O ATOM 1576 CB CYS A1614 11.716 -9.240 3.246 1.00 0.00 C ATOM 1577 SG CYS A1614 13.121 -9.565 2.149 1.00 0.00 S ATOM 0 H CYS A1614 9.509 -9.150 4.453 1.00 0.00 H new ATOM 0 HA CYS A1614 10.261 -9.210 1.694 1.00 0.00 H new ATOM 0 HB2 CYS A1614 11.663 -8.172 3.456 1.00 0.00 H new ATOM 0 HB3 CYS A1614 11.879 -9.744 4.198 1.00 0.00 H new ATOM 1582 N ARG A1615 10.715 -11.561 1.220 1.00 0.00 N ATOM 1583 CA ARG A1615 10.890 -12.931 0.821 1.00 0.00 C ATOM 1584 C ARG A1615 12.021 -13.029 -0.185 1.00 0.00 C ATOM 1585 O ARG A1615 11.816 -12.769 -1.360 1.00 0.00 O ATOM 1586 CB ARG A1615 9.604 -13.514 0.204 1.00 0.00 C ATOM 1587 CG ARG A1615 8.518 -13.894 1.197 1.00 0.00 C ATOM 1588 CD ARG A1615 8.905 -15.127 2.007 1.00 0.00 C ATOM 1589 NE ARG A1615 9.070 -16.317 1.155 1.00 0.00 N ATOM 1590 CZ ARG A1615 9.331 -17.553 1.592 1.00 0.00 C ATOM 1591 NH1 ARG A1615 9.415 -17.799 2.894 1.00 0.00 N1+ ATOM 1592 NH2 ARG A1615 9.496 -18.542 0.718 1.00 0.00 N ATOM 0 H ARG A1615 10.822 -10.898 0.452 1.00 0.00 H new ATOM 0 HA ARG A1615 11.129 -13.510 1.713 1.00 0.00 H new ATOM 0 HB2 ARG A1615 9.194 -12.785 -0.495 1.00 0.00 H new ATOM 0 HB3 ARG A1615 9.868 -14.398 -0.376 1.00 0.00 H new ATOM 0 HG2 ARG A1615 8.332 -13.058 1.872 1.00 0.00 H new ATOM 0 HG3 ARG A1615 7.587 -14.086 0.663 1.00 0.00 H new ATOM 0 HD2 ARG A1615 9.835 -14.932 2.542 1.00 0.00 H new ATOM 0 HD3 ARG A1615 8.140 -15.322 2.758 1.00 0.00 H new ATOM 0 HE ARG A1615 8.977 -16.187 0.148 1.00 0.00 H new ATOM 0 HH11 ARG A1615 9.280 -17.043 3.566 1.00 0.00 H new ATOM 0 HH12 ARG A1615 9.614 -18.744 3.223 1.00 0.00 H new ATOM 0 HH21 ARG A1615 9.423 -18.356 -0.282 1.00 0.00 H new ATOM 0 HH22 ARG A1615 9.695 -19.486 1.048 1.00 0.00 H new ATOM 1606 N PRO A1616 13.255 -13.307 0.269 1.00 0.00 N ATOM 1607 CA PRO A1616 14.371 -13.610 -0.637 1.00 0.00 C ATOM 1608 C PRO A1616 14.053 -14.862 -1.466 1.00 0.00 C ATOM 1609 O PRO A1616 14.491 -15.003 -2.607 1.00 0.00 O ATOM 1610 CB PRO A1616 15.544 -13.876 0.312 1.00 0.00 C ATOM 1611 CG PRO A1616 15.182 -13.155 1.563 1.00 0.00 C ATOM 1612 CD PRO A1616 13.692 -13.263 1.678 1.00 0.00 C ATOM 0 HA PRO A1616 14.577 -12.810 -1.348 1.00 0.00 H new ATOM 0 HB2 PRO A1616 15.675 -14.943 0.492 1.00 0.00 H new ATOM 0 HB3 PRO A1616 16.482 -13.506 -0.102 1.00 0.00 H new ATOM 0 HG2 PRO A1616 15.674 -13.600 2.428 1.00 0.00 H new ATOM 0 HG3 PRO A1616 15.497 -12.112 1.519 1.00 0.00 H new ATOM 0 HD2 PRO A1616 13.393 -14.159 2.222 1.00 0.00 H new ATOM 0 HD3 PRO A1616 13.265 -12.411 2.207 1.00 0.00 H new ATOM 1694 N ARG A1623 2.513 -10.655 -5.155 1.00 0.00 N ATOM 1695 CA ARG A1623 1.295 -10.047 -5.588 1.00 0.00 C ATOM 1696 C ARG A1623 0.527 -9.698 -4.333 1.00 0.00 C ATOM 1697 O ARG A1623 0.549 -10.482 -3.378 1.00 0.00 O ATOM 1698 CB ARG A1623 0.486 -11.058 -6.397 1.00 0.00 C ATOM 1699 CG ARG A1623 1.186 -11.613 -7.626 1.00 0.00 C ATOM 1700 CD ARG A1623 0.335 -12.676 -8.287 1.00 0.00 C ATOM 1701 NE ARG A1623 0.049 -13.791 -7.369 1.00 0.00 N ATOM 1702 CZ ARG A1623 -1.080 -14.507 -7.368 1.00 0.00 C ATOM 1703 NH1 ARG A1623 -2.015 -14.279 -8.293 1.00 0.00 N1+ ATOM 1704 NH2 ARG A1623 -1.262 -15.453 -6.447 1.00 0.00 N ATOM 0 HA ARG A1623 1.485 -9.169 -6.206 1.00 0.00 H new ATOM 0 HB2 ARG A1623 0.218 -11.889 -5.745 1.00 0.00 H new ATOM 0 HB3 ARG A1623 -0.445 -10.586 -6.711 1.00 0.00 H new ATOM 0 HG2 ARG A1623 1.386 -10.807 -8.333 1.00 0.00 H new ATOM 0 HG3 ARG A1623 2.150 -12.035 -7.343 1.00 0.00 H new ATOM 0 HD2 ARG A1623 -0.602 -12.234 -8.626 1.00 0.00 H new ATOM 0 HD3 ARG A1623 0.847 -13.055 -9.172 1.00 0.00 H new ATOM 0 HE ARG A1623 0.764 -14.035 -6.684 1.00 0.00 H new ATOM 0 HH11 ARG A1623 -1.868 -13.559 -9.000 1.00 0.00 H new ATOM 0 HH12 ARG A1623 -2.877 -14.825 -8.293 1.00 0.00 H new ATOM 0 HH21 ARG A1623 -0.541 -15.628 -5.747 1.00 0.00 H new ATOM 0 HH22 ARG A1623 -2.122 -16.002 -6.442 1.00 0.00 H new ATOM 1718 N PRO A1624 -0.124 -8.529 -4.286 1.00 0.00 N ATOM 1719 CA PRO A1624 -0.882 -8.116 -3.109 1.00 0.00 C ATOM 1720 C PRO A1624 -2.112 -9.003 -2.897 1.00 0.00 C ATOM 1721 O PRO A1624 -2.987 -9.122 -3.781 1.00 0.00 O ATOM 1722 CB PRO A1624 -1.304 -6.676 -3.433 1.00 0.00 C ATOM 1723 CG PRO A1624 -1.263 -6.588 -4.922 1.00 0.00 C ATOM 1724 CD PRO A1624 -0.171 -7.519 -5.364 1.00 0.00 C ATOM 0 HA PRO A1624 -0.299 -8.195 -2.192 1.00 0.00 H new ATOM 0 HB2 PRO A1624 -2.303 -6.462 -3.052 1.00 0.00 H new ATOM 0 HB3 PRO A1624 -0.627 -5.954 -2.976 1.00 0.00 H new ATOM 0 HG2 PRO A1624 -2.220 -6.876 -5.356 1.00 0.00 H new ATOM 0 HG3 PRO A1624 -1.060 -5.567 -5.247 1.00 0.00 H new ATOM 0 HD2 PRO A1624 -0.396 -7.972 -6.330 1.00 0.00 H new ATOM 0 HD3 PRO A1624 0.781 -7.000 -5.470 1.00 0.00 H new ATOM 1732 N MET A1625 -2.179 -9.624 -1.751 1.00 0.00 N ATOM 1733 CA MET A1625 -3.286 -10.498 -1.418 1.00 0.00 C ATOM 1734 C MET A1625 -3.857 -10.128 -0.074 1.00 0.00 C ATOM 1735 O MET A1625 -3.134 -9.650 0.813 1.00 0.00 O ATOM 1736 CB MET A1625 -2.867 -11.979 -1.471 1.00 0.00 C ATOM 1737 CG MET A1625 -2.484 -12.434 -2.879 1.00 0.00 C ATOM 1738 SD MET A1625 -2.136 -14.203 -3.036 1.00 0.00 S ATOM 1739 CE MET A1625 -0.718 -14.376 -1.956 1.00 0.00 C ATOM 0 H MET A1625 -1.473 -9.543 -1.019 1.00 0.00 H new ATOM 0 HA MET A1625 -4.068 -10.364 -2.165 1.00 0.00 H new ATOM 0 HB2 MET A1625 -2.023 -12.138 -0.800 1.00 0.00 H new ATOM 0 HB3 MET A1625 -3.686 -12.597 -1.104 1.00 0.00 H new ATOM 0 HG2 MET A1625 -3.293 -12.175 -3.562 1.00 0.00 H new ATOM 0 HG3 MET A1625 -1.605 -11.875 -3.200 1.00 0.00 H new ATOM 0 HE1 MET A1625 -0.271 -15.360 -2.097 1.00 0.00 H new ATOM 0 HE2 MET A1625 0.016 -13.606 -2.193 1.00 0.00 H new ATOM 0 HE3 MET A1625 -1.035 -14.267 -0.919 1.00 0.00 H new ATOM 1749 N LEU A1626 -5.147 -10.321 0.064 1.00 0.00 N ATOM 1750 CA LEU A1626 -5.882 -9.919 1.243 1.00 0.00 C ATOM 1751 C LEU A1626 -5.676 -10.958 2.348 1.00 0.00 C ATOM 1752 O LEU A1626 -6.113 -12.108 2.223 1.00 0.00 O ATOM 1753 CB LEU A1626 -7.372 -9.806 0.873 1.00 0.00 C ATOM 1754 CG LEU A1626 -8.223 -8.771 1.630 1.00 0.00 C ATOM 1755 CD1 LEU A1626 -9.641 -8.798 1.124 1.00 0.00 C ATOM 1756 CD2 LEU A1626 -8.203 -8.991 3.127 1.00 0.00 C ATOM 0 H LEU A1626 -5.725 -10.768 -0.648 1.00 0.00 H new ATOM 0 HA LEU A1626 -5.527 -8.955 1.607 1.00 0.00 H new ATOM 0 HB2 LEU A1626 -7.437 -9.579 -0.191 1.00 0.00 H new ATOM 0 HB3 LEU A1626 -7.828 -10.785 1.018 1.00 0.00 H new ATOM 0 HG LEU A1626 -7.783 -7.792 1.441 1.00 0.00 H new ATOM 0 HD11 LEU A1626 -10.235 -8.062 1.666 1.00 0.00 H new ATOM 0 HD12 LEU A1626 -9.652 -8.561 0.060 1.00 0.00 H new ATOM 0 HD13 LEU A1626 -10.064 -9.791 1.279 1.00 0.00 H new ATOM 0 HD21 LEU A1626 -8.818 -8.235 3.614 1.00 0.00 H new ATOM 0 HD22 LEU A1626 -8.597 -9.981 3.355 1.00 0.00 H new ATOM 0 HD23 LEU A1626 -7.179 -8.916 3.492 1.00 0.00 H new ATOM 1768 N ILE A1627 -5.016 -10.559 3.412 1.00 0.00 N ATOM 1769 CA ILE A1627 -4.726 -11.469 4.508 1.00 0.00 C ATOM 1770 C ILE A1627 -5.739 -11.318 5.633 1.00 0.00 C ATOM 1771 O ILE A1627 -6.241 -12.300 6.160 1.00 0.00 O ATOM 1772 CB ILE A1627 -3.287 -11.267 5.065 1.00 0.00 C ATOM 1773 CG1 ILE A1627 -2.242 -11.508 3.970 1.00 0.00 C ATOM 1774 CG2 ILE A1627 -3.017 -12.174 6.269 1.00 0.00 C ATOM 1775 CD1 ILE A1627 -2.273 -12.897 3.359 1.00 0.00 C ATOM 0 H ILE A1627 -4.668 -9.610 3.546 1.00 0.00 H new ATOM 0 HA ILE A1627 -4.796 -12.478 4.103 1.00 0.00 H new ATOM 0 HB ILE A1627 -3.209 -10.233 5.401 1.00 0.00 H new ATOM 0 HG12 ILE A1627 -2.390 -10.774 3.178 1.00 0.00 H new ATOM 0 HG13 ILE A1627 -1.251 -11.331 4.387 1.00 0.00 H new ATOM 0 HG21 ILE A1627 -2.003 -12.006 6.631 1.00 0.00 H new ATOM 0 HG22 ILE A1627 -3.728 -11.946 7.063 1.00 0.00 H new ATOM 0 HG23 ILE A1627 -3.127 -13.217 5.971 1.00 0.00 H new ATOM 0 HD11 ILE A1627 -1.500 -12.976 2.595 1.00 0.00 H new ATOM 0 HD12 ILE A1627 -2.092 -13.640 4.136 1.00 0.00 H new ATOM 0 HD13 ILE A1627 -3.249 -13.074 2.907 1.00 0.00 H new ATOM 1787 N SER A1628 -6.067 -10.105 5.978 1.00 0.00 N ATOM 1788 CA SER A1628 -6.976 -9.881 7.070 1.00 0.00 C ATOM 1789 C SER A1628 -7.982 -8.801 6.710 1.00 0.00 C ATOM 1790 O SER A1628 -7.613 -7.725 6.213 1.00 0.00 O ATOM 1791 CB SER A1628 -6.197 -9.482 8.324 1.00 0.00 C ATOM 1792 OG SER A1628 -5.186 -10.442 8.643 1.00 0.00 O ATOM 0 H SER A1628 -5.722 -9.260 5.523 1.00 0.00 H new ATOM 0 HA SER A1628 -7.519 -10.805 7.269 1.00 0.00 H new ATOM 0 HB2 SER A1628 -5.737 -8.505 8.172 1.00 0.00 H new ATOM 0 HB3 SER A1628 -6.884 -9.384 9.164 1.00 0.00 H new ATOM 0 HG SER A1628 -4.706 -10.156 9.448 1.00 0.00 H new ATOM 1798 N LEU A1629 -9.235 -9.098 6.931 1.00 0.00 N ATOM 1799 CA LEU A1629 -10.307 -8.186 6.638 1.00 0.00 C ATOM 1800 C LEU A1629 -10.935 -7.805 7.961 1.00 0.00 C ATOM 1801 O LEU A1629 -11.612 -8.630 8.598 1.00 0.00 O ATOM 1802 CB LEU A1629 -11.359 -8.889 5.732 1.00 0.00 C ATOM 1803 CG LEU A1629 -12.401 -8.010 4.967 1.00 0.00 C ATOM 1804 CD1 LEU A1629 -13.227 -7.104 5.873 1.00 0.00 C ATOM 1805 CD2 LEU A1629 -11.732 -7.211 3.880 1.00 0.00 C ATOM 0 H LEU A1629 -9.542 -9.988 7.323 1.00 0.00 H new ATOM 0 HA LEU A1629 -9.942 -7.303 6.113 1.00 0.00 H new ATOM 0 HB2 LEU A1629 -10.817 -9.477 4.992 1.00 0.00 H new ATOM 0 HB3 LEU A1629 -11.913 -9.592 6.354 1.00 0.00 H new ATOM 0 HG LEU A1629 -13.107 -8.708 4.518 1.00 0.00 H new ATOM 0 HD11 LEU A1629 -13.927 -6.526 5.269 1.00 0.00 H new ATOM 0 HD12 LEU A1629 -13.781 -7.712 6.588 1.00 0.00 H new ATOM 0 HD13 LEU A1629 -12.565 -6.425 6.410 1.00 0.00 H new ATOM 0 HD21 LEU A1629 -12.477 -6.607 3.361 1.00 0.00 H new ATOM 0 HD22 LEU A1629 -10.978 -6.558 4.320 1.00 0.00 H new ATOM 0 HD23 LEU A1629 -11.256 -7.888 3.171 1.00 0.00 H new ATOM 1817 N ASP A1630 -10.700 -6.607 8.399 1.00 0.00 N ATOM 1818 CA ASP A1630 -11.301 -6.150 9.620 1.00 0.00 C ATOM 1819 C ASP A1630 -12.408 -5.176 9.287 1.00 0.00 C ATOM 1820 O ASP A1630 -12.153 -4.031 8.903 1.00 0.00 O ATOM 1821 CB ASP A1630 -10.279 -5.502 10.545 1.00 0.00 C ATOM 1822 CG ASP A1630 -10.888 -5.120 11.871 1.00 0.00 C ATOM 1823 OD1 ASP A1630 -11.453 -4.042 11.985 1.00 0.00 O ATOM 1824 OD2 ASP A1630 -10.815 -5.923 12.833 1.00 0.00 O1- ATOM 0 H ASP A1630 -10.099 -5.927 7.933 1.00 0.00 H new ATOM 0 HA ASP A1630 -11.710 -7.010 10.150 1.00 0.00 H new ATOM 0 HB2 ASP A1630 -9.450 -6.190 10.710 1.00 0.00 H new ATOM 0 HB3 ASP A1630 -9.866 -4.615 10.066 1.00 0.00 H new ATOM 1829 N LYS A1631 -13.627 -5.638 9.405 1.00 0.00 N ATOM 1830 CA LYS A1631 -14.796 -4.846 9.072 1.00 0.00 C ATOM 1831 C LYS A1631 -15.063 -3.812 10.164 1.00 0.00 C ATOM 1832 O LYS A1631 -15.504 -2.699 9.883 1.00 0.00 O ATOM 1833 CB LYS A1631 -16.027 -5.769 8.914 1.00 0.00 C ATOM 1834 CG LYS A1631 -17.344 -5.064 8.540 1.00 0.00 C ATOM 1835 CD LYS A1631 -17.365 -4.546 7.097 1.00 0.00 C ATOM 1836 CE LYS A1631 -17.385 -5.691 6.083 1.00 0.00 C ATOM 1837 NZ LYS A1631 -17.452 -5.205 4.692 1.00 0.00 N1+ ATOM 0 H LYS A1631 -13.843 -6.578 9.736 1.00 0.00 H new ATOM 0 HA LYS A1631 -14.612 -4.326 8.132 1.00 0.00 H new ATOM 0 HB2 LYS A1631 -15.805 -6.514 8.150 1.00 0.00 H new ATOM 0 HB3 LYS A1631 -16.177 -6.308 9.850 1.00 0.00 H new ATOM 0 HG2 LYS A1631 -18.173 -5.758 8.682 1.00 0.00 H new ATOM 0 HG3 LYS A1631 -17.507 -4.229 9.221 1.00 0.00 H new ATOM 0 HD2 LYS A1631 -18.241 -3.915 6.950 1.00 0.00 H new ATOM 0 HD3 LYS A1631 -16.489 -3.921 6.922 1.00 0.00 H new ATOM 0 HE2 LYS A1631 -16.491 -6.301 6.210 1.00 0.00 H new ATOM 0 HE3 LYS A1631 -18.241 -6.335 6.282 1.00 0.00 H new ATOM 0 HZ1 LYS A1631 -17.463 -6.016 4.041 1.00 0.00 H new ATOM 0 HZ2 LYS A1631 -18.318 -4.644 4.562 1.00 0.00 H new ATOM 0 HZ3 LYS A1631 -16.622 -4.612 4.491 1.00 0.00 H new ATOM 1851 N GLN A1632 -14.737 -4.171 11.397 1.00 0.00 N ATOM 1852 CA GLN A1632 -15.050 -3.344 12.562 1.00 0.00 C ATOM 1853 C GLN A1632 -14.329 -1.999 12.557 1.00 0.00 C ATOM 1854 O GLN A1632 -14.922 -0.974 12.922 1.00 0.00 O ATOM 1855 CB GLN A1632 -14.809 -4.096 13.869 1.00 0.00 C ATOM 1856 CG GLN A1632 -15.734 -5.292 14.071 1.00 0.00 C ATOM 1857 CD GLN A1632 -15.530 -6.001 15.402 1.00 0.00 C ATOM 1858 OE1 GLN A1632 -14.321 -5.991 15.913 1.00 0.00 O flip ATOM 1859 NE2 GLN A1632 -16.476 -6.570 15.964 1.00 0.00 N flip ATOM 0 H GLN A1632 -14.250 -5.039 11.622 1.00 0.00 H new ATOM 0 HA GLN A1632 -16.115 -3.121 12.491 1.00 0.00 H new ATOM 0 HB2 GLN A1632 -13.775 -4.440 13.894 1.00 0.00 H new ATOM 0 HB3 GLN A1632 -14.936 -3.406 14.703 1.00 0.00 H new ATOM 0 HG2 GLN A1632 -16.769 -4.956 14.002 1.00 0.00 H new ATOM 0 HG3 GLN A1632 -15.576 -6.004 13.261 1.00 0.00 H new ATOM 0 HE21 GLN A1632 -17.403 -6.558 15.539 1.00 0.00 H new ATOM 0 HE22 GLN A1632 -16.328 -7.050 16.852 1.00 0.00 H new ATOM 1868 N THR A1633 -13.075 -1.990 12.170 1.00 0.00 N ATOM 1869 CA THR A1633 -12.334 -0.748 12.076 1.00 0.00 C ATOM 1870 C THR A1633 -12.037 -0.368 10.625 1.00 0.00 C ATOM 1871 O THR A1633 -11.225 0.522 10.355 1.00 0.00 O ATOM 1872 CB THR A1633 -11.038 -0.746 12.939 1.00 0.00 C ATOM 1873 OG1 THR A1633 -10.219 -1.907 12.676 1.00 0.00 O ATOM 1874 CG2 THR A1633 -11.367 -0.684 14.418 1.00 0.00 C ATOM 0 H THR A1633 -12.546 -2.824 11.915 1.00 0.00 H new ATOM 0 HA THR A1633 -12.986 0.020 12.493 1.00 0.00 H new ATOM 0 HB THR A1633 -10.475 0.145 12.660 1.00 0.00 H new ATOM 0 HG1 THR A1633 -10.757 -2.719 12.785 1.00 0.00 H new ATOM 0 HG21 THR A1633 -10.443 -0.684 14.997 1.00 0.00 H new ATOM 0 HG22 THR A1633 -11.927 0.227 14.628 1.00 0.00 H new ATOM 0 HG23 THR A1633 -11.968 -1.551 14.694 1.00 0.00 H new ATOM 1882 N CYS A1634 -12.696 -1.078 9.703 1.00 0.00 N ATOM 1883 CA CYS A1634 -12.626 -0.822 8.254 1.00 0.00 C ATOM 1884 C CYS A1634 -11.184 -0.865 7.730 1.00 0.00 C ATOM 1885 O CYS A1634 -10.744 0.021 6.992 1.00 0.00 O ATOM 1886 CB CYS A1634 -13.268 0.533 7.925 1.00 0.00 C ATOM 1887 SG CYS A1634 -14.988 0.734 8.514 1.00 0.00 S ATOM 0 H CYS A1634 -13.304 -1.861 9.943 1.00 0.00 H new ATOM 0 HA CYS A1634 -13.179 -1.617 7.754 1.00 0.00 H new ATOM 0 HB2 CYS A1634 -12.656 1.324 8.359 1.00 0.00 H new ATOM 0 HB3 CYS A1634 -13.251 0.674 6.844 1.00 0.00 H new ATOM 1892 N THR A1635 -10.455 -1.883 8.098 1.00 0.00 N ATOM 1893 CA THR A1635 -9.085 -1.986 7.696 1.00 0.00 C ATOM 1894 C THR A1635 -8.846 -3.256 6.881 1.00 0.00 C ATOM 1895 O THR A1635 -9.145 -4.376 7.328 1.00 0.00 O ATOM 1896 CB THR A1635 -8.147 -1.941 8.915 1.00 0.00 C ATOM 1897 OG1 THR A1635 -8.437 -0.762 9.690 1.00 0.00 O ATOM 1898 CG2 THR A1635 -6.695 -1.894 8.465 1.00 0.00 C ATOM 0 H THR A1635 -10.791 -2.653 8.677 1.00 0.00 H new ATOM 0 HA THR A1635 -8.861 -1.128 7.062 1.00 0.00 H new ATOM 0 HB THR A1635 -8.304 -2.837 9.516 1.00 0.00 H new ATOM 0 HG1 THR A1635 -7.844 -0.729 10.469 1.00 0.00 H new ATOM 0 HG21 THR A1635 -6.044 -1.862 9.339 1.00 0.00 H new ATOM 0 HG22 THR A1635 -6.468 -2.782 7.875 1.00 0.00 H new ATOM 0 HG23 THR A1635 -6.531 -1.004 7.858 1.00 0.00 H new ATOM 1906 N LEU A1636 -8.342 -3.075 5.685 1.00 0.00 N ATOM 1907 CA LEU A1636 -8.034 -4.182 4.816 1.00 0.00 C ATOM 1908 C LEU A1636 -6.528 -4.382 4.774 1.00 0.00 C ATOM 1909 O LEU A1636 -5.783 -3.495 4.327 1.00 0.00 O ATOM 1910 CB LEU A1636 -8.595 -3.993 3.378 1.00 0.00 C ATOM 1911 CG LEU A1636 -10.136 -3.920 3.191 1.00 0.00 C ATOM 1912 CD1 LEU A1636 -10.734 -2.628 3.738 1.00 0.00 C ATOM 1913 CD2 LEU A1636 -10.510 -4.108 1.725 1.00 0.00 C ATOM 0 H LEU A1636 -8.135 -2.159 5.288 1.00 0.00 H new ATOM 0 HA LEU A1636 -8.520 -5.068 5.224 1.00 0.00 H new ATOM 0 HB2 LEU A1636 -8.167 -3.076 2.972 1.00 0.00 H new ATOM 0 HB3 LEU A1636 -8.225 -4.815 2.766 1.00 0.00 H new ATOM 0 HG LEU A1636 -10.563 -4.736 3.773 1.00 0.00 H new ATOM 0 HD11 LEU A1636 -11.813 -2.631 3.581 1.00 0.00 H new ATOM 0 HD12 LEU A1636 -10.523 -2.553 4.805 1.00 0.00 H new ATOM 0 HD13 LEU A1636 -10.294 -1.776 3.220 1.00 0.00 H new ATOM 0 HD21 LEU A1636 -11.593 -4.053 1.616 1.00 0.00 H new ATOM 0 HD22 LEU A1636 -10.045 -3.324 1.127 1.00 0.00 H new ATOM 0 HD23 LEU A1636 -10.159 -5.081 1.382 1.00 0.00 H new ATOM 1925 N PHE A1637 -6.084 -5.515 5.262 1.00 0.00 N ATOM 1926 CA PHE A1637 -4.672 -5.838 5.304 1.00 0.00 C ATOM 1927 C PHE A1637 -4.276 -6.639 4.078 1.00 0.00 C ATOM 1928 O PHE A1637 -4.747 -7.778 3.881 1.00 0.00 O ATOM 1929 CB PHE A1637 -4.323 -6.649 6.558 1.00 0.00 C ATOM 1930 CG PHE A1637 -4.486 -5.927 7.875 1.00 0.00 C ATOM 1931 CD1 PHE A1637 -5.699 -5.940 8.551 1.00 0.00 C ATOM 1932 CD2 PHE A1637 -3.414 -5.261 8.450 1.00 0.00 C ATOM 1933 CE1 PHE A1637 -5.838 -5.299 9.768 1.00 0.00 C ATOM 1934 CE2 PHE A1637 -3.546 -4.622 9.668 1.00 0.00 C ATOM 1935 CZ PHE A1637 -4.759 -4.641 10.328 1.00 0.00 C ATOM 0 H PHE A1637 -6.690 -6.242 5.643 1.00 0.00 H new ATOM 0 HA PHE A1637 -4.123 -4.896 5.326 1.00 0.00 H new ATOM 0 HB2 PHE A1637 -4.947 -7.542 6.575 1.00 0.00 H new ATOM 0 HB3 PHE A1637 -3.289 -6.984 6.475 1.00 0.00 H new ATOM 0 HD1 PHE A1637 -6.544 -6.457 8.121 1.00 0.00 H new ATOM 0 HD2 PHE A1637 -2.463 -5.242 7.939 1.00 0.00 H new ATOM 0 HE1 PHE A1637 -6.789 -5.312 10.281 1.00 0.00 H new ATOM 0 HE2 PHE A1637 -2.702 -4.108 10.103 1.00 0.00 H new ATOM 0 HZ PHE A1637 -4.864 -4.142 11.280 1.00 0.00 H new ATOM 1945 N PHE A1638 -3.437 -6.061 3.270 1.00 0.00 N ATOM 1946 CA PHE A1638 -2.921 -6.716 2.095 1.00 0.00 C ATOM 1947 C PHE A1638 -1.448 -6.980 2.289 1.00 0.00 C ATOM 1948 O PHE A1638 -0.715 -6.121 2.790 1.00 0.00 O ATOM 1949 CB PHE A1638 -3.138 -5.883 0.817 1.00 0.00 C ATOM 1950 CG PHE A1638 -4.574 -5.706 0.408 1.00 0.00 C ATOM 1951 CD1 PHE A1638 -5.199 -6.649 -0.390 1.00 0.00 C ATOM 1952 CD2 PHE A1638 -5.290 -4.592 0.802 1.00 0.00 C ATOM 1953 CE1 PHE A1638 -6.512 -6.486 -0.783 1.00 0.00 C ATOM 1954 CE2 PHE A1638 -6.604 -4.422 0.415 1.00 0.00 C ATOM 1955 CZ PHE A1638 -7.217 -5.370 -0.380 1.00 0.00 C ATOM 0 H PHE A1638 -3.086 -5.113 3.405 1.00 0.00 H new ATOM 0 HA PHE A1638 -3.465 -7.651 1.964 1.00 0.00 H new ATOM 0 HB2 PHE A1638 -2.694 -4.898 0.964 1.00 0.00 H new ATOM 0 HB3 PHE A1638 -2.598 -6.357 -0.003 1.00 0.00 H new ATOM 0 HD1 PHE A1638 -4.652 -7.524 -0.709 1.00 0.00 H new ATOM 0 HD2 PHE A1638 -4.816 -3.845 1.421 1.00 0.00 H new ATOM 0 HE1 PHE A1638 -6.987 -7.230 -1.405 1.00 0.00 H new ATOM 0 HE2 PHE A1638 -7.152 -3.548 0.734 1.00 0.00 H new ATOM 0 HZ PHE A1638 -8.245 -5.239 -0.685 1.00 0.00 H new ATOM 1965 N SER A1639 -1.021 -8.141 1.923 1.00 0.00 N ATOM 1966 CA SER A1639 0.348 -8.500 2.047 1.00 0.00 C ATOM 1967 C SER A1639 0.957 -8.587 0.667 1.00 0.00 C ATOM 1968 O SER A1639 0.302 -9.036 -0.290 1.00 0.00 O ATOM 1969 CB SER A1639 0.486 -9.834 2.799 1.00 0.00 C ATOM 1970 OG SER A1639 1.844 -10.210 2.985 1.00 0.00 O ATOM 0 H SER A1639 -1.615 -8.870 1.528 1.00 0.00 H new ATOM 0 HA SER A1639 0.879 -7.742 2.623 1.00 0.00 H new ATOM 0 HB2 SER A1639 -0.003 -9.753 3.770 1.00 0.00 H new ATOM 0 HB3 SER A1639 -0.033 -10.616 2.245 1.00 0.00 H new ATOM 0 HG SER A1639 2.007 -11.072 2.549 1.00 0.00 H new ATOM 1976 N TRP A1640 2.159 -8.123 0.563 1.00 0.00 N ATOM 1977 CA TRP A1640 2.922 -8.152 -0.641 1.00 0.00 C ATOM 1978 C TRP A1640 4.261 -8.719 -0.241 1.00 0.00 C ATOM 1979 O TRP A1640 4.858 -8.254 0.721 1.00 0.00 O ATOM 1980 CB TRP A1640 3.095 -6.719 -1.153 1.00 0.00 C ATOM 1981 CG TRP A1640 3.600 -6.577 -2.569 1.00 0.00 C ATOM 1982 CD1 TRP A1640 4.687 -7.181 -3.150 1.00 0.00 C ATOM 1983 CD2 TRP A1640 3.051 -5.714 -3.563 1.00 0.00 C ATOM 1984 NE1 TRP A1640 4.809 -6.768 -4.453 1.00 0.00 N ATOM 1985 CE2 TRP A1640 3.823 -5.863 -4.726 1.00 0.00 C ATOM 1986 CE3 TRP A1640 1.967 -4.833 -3.580 1.00 0.00 C ATOM 1987 CZ2 TRP A1640 3.546 -5.164 -5.894 1.00 0.00 C ATOM 1988 CZ3 TRP A1640 1.695 -4.139 -4.736 1.00 0.00 C ATOM 1989 CH2 TRP A1640 2.482 -4.309 -5.878 1.00 0.00 C ATOM 0 H TRP A1640 2.656 -7.697 1.345 1.00 0.00 H new ATOM 0 HA TRP A1640 2.450 -8.740 -1.428 1.00 0.00 H new ATOM 0 HB2 TRP A1640 2.134 -6.210 -1.078 1.00 0.00 H new ATOM 0 HB3 TRP A1640 3.785 -6.198 -0.489 1.00 0.00 H new ATOM 0 HD1 TRP A1640 5.348 -7.877 -2.655 1.00 0.00 H new ATOM 0 HE1 TRP A1640 5.521 -7.085 -5.111 1.00 0.00 H new ATOM 0 HE3 TRP A1640 1.354 -4.699 -2.701 1.00 0.00 H new ATOM 0 HZ2 TRP A1640 4.149 -5.292 -6.781 1.00 0.00 H new ATOM 0 HZ3 TRP A1640 0.861 -3.453 -4.761 1.00 0.00 H new ATOM 0 HH2 TRP A1640 2.242 -3.750 -6.770 1.00 0.00 H new ATOM 2000 N HIS A1641 4.712 -9.739 -0.901 1.00 0.00 N ATOM 2001 CA HIS A1641 5.974 -10.325 -0.535 1.00 0.00 C ATOM 2002 C HIS A1641 7.033 -9.961 -1.554 1.00 0.00 C ATOM 2003 O HIS A1641 7.012 -10.433 -2.694 1.00 0.00 O ATOM 2004 CB HIS A1641 5.859 -11.845 -0.343 1.00 0.00 C ATOM 2005 CG HIS A1641 4.877 -12.246 0.736 1.00 0.00 C ATOM 2006 ND1 HIS A1641 5.247 -12.747 1.968 1.00 0.00 N ATOM 2007 CD2 HIS A1641 3.518 -12.232 0.744 1.00 0.00 C ATOM 2008 CE1 HIS A1641 4.170 -13.016 2.667 1.00 0.00 C ATOM 2009 NE2 HIS A1641 3.119 -12.714 1.950 1.00 0.00 N ATOM 0 H HIS A1641 4.237 -10.183 -1.687 1.00 0.00 H new ATOM 0 HA HIS A1641 6.277 -9.915 0.428 1.00 0.00 H new ATOM 0 HB2 HIS A1641 5.556 -12.300 -1.286 1.00 0.00 H new ATOM 0 HB3 HIS A1641 6.842 -12.247 -0.096 1.00 0.00 H new ATOM 0 HD1 HIS A1641 6.207 -12.886 2.285 1.00 0.00 H new ATOM 0 HD2 HIS A1641 2.876 -11.900 -0.058 1.00 0.00 H new ATOM 0 HE1 HIS A1641 4.154 -13.420 3.669 1.00 0.00 H new ATOM 2018 N THR A1642 7.932 -9.107 -1.152 1.00 0.00 N ATOM 2019 CA THR A1642 8.976 -8.624 -2.011 1.00 0.00 C ATOM 2020 C THR A1642 10.307 -8.632 -1.255 1.00 0.00 C ATOM 2021 O THR A1642 10.360 -8.326 -0.061 1.00 0.00 O ATOM 2022 CB THR A1642 8.658 -7.175 -2.544 1.00 0.00 C ATOM 2023 OG1 THR A1642 9.747 -6.690 -3.337 1.00 0.00 O ATOM 2024 CG2 THR A1642 8.393 -6.183 -1.410 1.00 0.00 C ATOM 0 H THR A1642 7.961 -8.722 -0.208 1.00 0.00 H new ATOM 0 HA THR A1642 9.044 -9.285 -2.875 1.00 0.00 H new ATOM 0 HB THR A1642 7.753 -7.253 -3.147 1.00 0.00 H new ATOM 0 HG1 THR A1642 9.478 -5.865 -3.793 1.00 0.00 H new ATOM 0 HG21 THR A1642 8.179 -5.200 -1.829 1.00 0.00 H new ATOM 0 HG22 THR A1642 7.539 -6.521 -0.823 1.00 0.00 H new ATOM 0 HG23 THR A1642 9.272 -6.120 -0.768 1.00 0.00 H new ATOM 2032 N PRO A1643 11.403 -9.032 -1.930 1.00 0.00 N ATOM 2033 CA PRO A1643 12.741 -9.040 -1.338 1.00 0.00 C ATOM 2034 C PRO A1643 13.303 -7.617 -1.179 1.00 0.00 C ATOM 2035 O PRO A1643 14.351 -7.417 -0.571 1.00 0.00 O ATOM 2036 CB PRO A1643 13.569 -9.849 -2.343 1.00 0.00 C ATOM 2037 CG PRO A1643 12.887 -9.631 -3.646 1.00 0.00 C ATOM 2038 CD PRO A1643 11.422 -9.532 -3.329 1.00 0.00 C ATOM 0 HA PRO A1643 12.750 -9.463 -0.333 1.00 0.00 H new ATOM 0 HB2 PRO A1643 14.603 -9.505 -2.374 1.00 0.00 H new ATOM 0 HB3 PRO A1643 13.592 -10.906 -2.079 1.00 0.00 H new ATOM 0 HG2 PRO A1643 13.245 -8.721 -4.128 1.00 0.00 H new ATOM 0 HG3 PRO A1643 13.084 -10.454 -4.333 1.00 0.00 H new ATOM 0 HD2 PRO A1643 10.910 -8.849 -4.006 1.00 0.00 H new ATOM 0 HD3 PRO A1643 10.926 -10.499 -3.417 1.00 0.00 H new ATOM 2046 N LEU A1644 12.564 -6.630 -1.702 1.00 0.00 N ATOM 2047 CA LEU A1644 12.938 -5.216 -1.613 1.00 0.00 C ATOM 2048 C LEU A1644 12.752 -4.680 -0.195 1.00 0.00 C ATOM 2049 O LEU A1644 13.154 -3.565 0.114 1.00 0.00 O ATOM 2050 CB LEU A1644 12.120 -4.372 -2.603 1.00 0.00 C ATOM 2051 CG LEU A1644 12.385 -4.614 -4.093 1.00 0.00 C ATOM 2052 CD1 LEU A1644 11.402 -3.820 -4.937 1.00 0.00 C ATOM 2053 CD2 LEU A1644 13.804 -4.210 -4.447 1.00 0.00 C ATOM 0 H LEU A1644 11.688 -6.792 -2.199 1.00 0.00 H new ATOM 0 HA LEU A1644 13.994 -5.141 -1.873 1.00 0.00 H new ATOM 0 HB2 LEU A1644 11.062 -4.552 -2.411 1.00 0.00 H new ATOM 0 HB3 LEU A1644 12.308 -3.320 -2.390 1.00 0.00 H new ATOM 0 HG LEU A1644 12.255 -5.677 -4.299 1.00 0.00 H new ATOM 0 HD11 LEU A1644 11.601 -4.001 -5.993 1.00 0.00 H new ATOM 0 HD12 LEU A1644 10.385 -4.132 -4.701 1.00 0.00 H new ATOM 0 HD13 LEU A1644 11.514 -2.757 -4.723 1.00 0.00 H new ATOM 0 HD21 LEU A1644 13.979 -4.387 -5.508 1.00 0.00 H new ATOM 0 HD22 LEU A1644 13.947 -3.152 -4.227 1.00 0.00 H new ATOM 0 HD23 LEU A1644 14.508 -4.800 -3.860 1.00 0.00 H new ATOM 2065 N ALA A1645 12.127 -5.472 0.655 1.00 0.00 N ATOM 2066 CA ALA A1645 11.940 -5.100 2.045 1.00 0.00 C ATOM 2067 C ALA A1645 13.185 -5.470 2.858 1.00 0.00 C ATOM 2068 O ALA A1645 13.347 -5.046 4.004 1.00 0.00 O ATOM 2069 CB ALA A1645 10.686 -5.754 2.604 1.00 0.00 C ATOM 0 H ALA A1645 11.738 -6.382 0.406 1.00 0.00 H new ATOM 0 HA ALA A1645 11.804 -4.021 2.115 1.00 0.00 H new ATOM 0 HB1 ALA A1645 10.559 -5.465 3.647 1.00 0.00 H new ATOM 0 HB2 ALA A1645 9.819 -5.428 2.030 1.00 0.00 H new ATOM 0 HB3 ALA A1645 10.780 -6.838 2.536 1.00 0.00 H new ATOM 2075 N CYS A1646 14.055 -6.249 2.251 1.00 0.00 N ATOM 2076 CA CYS A1646 15.309 -6.634 2.859 1.00 0.00 C ATOM 2077 C CYS A1646 16.406 -5.772 2.344 1.00 0.00 C ATOM 2078 O CYS A1646 16.364 -5.303 1.199 1.00 0.00 O ATOM 2079 CB CYS A1646 15.683 -8.088 2.537 1.00 0.00 C ATOM 2080 SG CYS A1646 14.693 -9.354 3.363 1.00 0.00 S ATOM 0 H CYS A1646 13.911 -6.634 1.318 1.00 0.00 H new ATOM 0 HA CYS A1646 15.183 -6.523 3.936 1.00 0.00 H new ATOM 0 HB2 CYS A1646 15.601 -8.235 1.460 1.00 0.00 H new ATOM 0 HB3 CYS A1646 16.729 -8.242 2.801 1.00 0.00 H new