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: A1607 LYS NZ :NH3+ -110:sc= 0.963 (180deg=-0.617) USER MOD Set 1.2: A1633 THR OG1 : rot -68:sc= 2.1 USER MOD Set 1.3: A1635 THR OG1 : rot 110:sc= 0.969 USER MOD Set 2.1: A1520 ASN : amide:sc= -0.999 K(o=-1,f=-10!) USER MOD Set 2.2: A1523 THR OG1 : rot 180:sc= 0 USER MOD Single : A1517 GLN : amide:sc= -0.0144 K(o=-0.014,f=-1.7) USER MOD Single : A1519 THR OG1 : rot 180:sc= -0.482 USER MOD Single : A1522 SER OG : rot 180:sc= 0 USER MOD Single : A1525 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A1530 SER OG : rot 90:sc= 1.19 USER MOD Single : A1531 SER OG : rot 180:sc= 0 USER MOD Single : A1533 SER OG : rot 49:sc= 0.713 USER MOD Single : A1539 THR OG1 : rot 180:sc= 0 USER MOD Single : A1542 TYR OH : rot 35:sc= 1.16 USER MOD Single : A1549 TYR OH : rot 180:sc= 0 USER MOD Single : A1550 MET CE :methyl -166:sc= -0.121 (180deg=-0.537) USER MOD Single : A1551 SER OG : rot 93:sc= 1.29 USER MOD Single : A1556 ASN : amide:sc= 0.611 K(o=0.61,f=-2.1!) USER MOD Single : A1558 ASN : amide:sc= 0 K(o=0,f=-0.81) USER MOD Single : A1569 GLN : amide:sc= 0.345 X(o=0.35,f=-0.034) USER MOD Single : A1570 THR OG1 : rot 180:sc= 0 USER MOD Single : A1573 SER OG : rot 180:sc= 0.00472 USER MOD Single : A1576 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1578 ASN :FLIP amide:sc= 0 F(o=-2.3!,f=0) USER MOD Single : A1579 LYS NZ :NH3+ 164:sc= -0.0515 (180deg=-0.324) USER MOD Single : A1583 TYR OH : rot 180:sc= 0 USER MOD Single : A1586 GLN : amide:sc= 1.35 K(o=1.3,f=-0.84) USER MOD Single : A1589 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1592 TYR OH : rot -119:sc= 1.91 USER MOD Single : A1593 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0675) USER MOD Single : A1596 SER OG : rot -83:sc= 0.928 USER MOD Single : A1605 SER OG : rot 180:sc= 0 USER MOD Single : A1606 TYR OH : rot 180:sc= 0 USER MOD Single : A1608 SER OG : rot -76:sc= 0.496 USER MOD Single : A1611 SER OG : rot 180:sc= -0.49 USER MOD Single : A1625 MET CE :methyl 164:sc= -0.0906 (180deg=-0.476) USER MOD Single : A1628 SER OG : rot 180:sc= -0.377 USER MOD Single : A1631 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1632 GLN :FLIP amide:sc= 0 F(o=-1,f=0) USER MOD Single : A1639 SER OG : rot 33:sc= 1.19 USER MOD Single : A1641 HIS : no HD1:sc= -0.321 K(o=-0.32,f=-2.8!) USER MOD Single : A1642 THR OG1 : rot 170:sc= 0.046 USER MOD ----------------------------------------------------------------- ATOM 124 N CYS A1516 8.127 6.900 0.059 1.00 0.00 N ATOM 125 CA CYS A1516 8.431 5.488 -0.041 1.00 0.00 C ATOM 126 C CYS A1516 9.909 5.233 -0.164 1.00 0.00 C ATOM 127 O CYS A1516 10.358 4.470 -1.028 1.00 0.00 O ATOM 128 CB CYS A1516 7.677 4.804 -1.164 1.00 0.00 C ATOM 129 SG CYS A1516 5.903 4.652 -0.891 1.00 0.00 S ATOM 0 HA CYS A1516 8.090 5.047 0.896 1.00 0.00 H new ATOM 0 HB2 CYS A1516 7.843 5.360 -2.087 1.00 0.00 H new ATOM 0 HB3 CYS A1516 8.095 3.808 -1.312 1.00 0.00 H new ATOM 134 N GLN A1517 10.664 5.888 0.675 1.00 0.00 N ATOM 135 CA GLN A1517 12.059 5.649 0.737 1.00 0.00 C ATOM 136 C GLN A1517 12.512 5.651 2.175 1.00 0.00 C ATOM 137 O GLN A1517 12.201 6.577 2.948 1.00 0.00 O ATOM 138 CB GLN A1517 12.878 6.608 -0.148 1.00 0.00 C ATOM 139 CG GLN A1517 12.691 8.091 0.118 1.00 0.00 C ATOM 140 CD GLN A1517 13.631 8.938 -0.725 1.00 0.00 C ATOM 141 OE1 GLN A1517 14.736 8.509 -1.064 1.00 0.00 O ATOM 142 NE2 GLN A1517 13.219 10.130 -1.069 1.00 0.00 N ATOM 0 H GLN A1517 10.322 6.595 1.326 1.00 0.00 H new ATOM 0 HA GLN A1517 12.249 4.661 0.318 1.00 0.00 H new ATOM 0 HB2 GLN A1517 13.934 6.369 -0.026 1.00 0.00 H new ATOM 0 HB3 GLN A1517 12.625 6.412 -1.190 1.00 0.00 H new ATOM 0 HG2 GLN A1517 11.659 8.371 -0.095 1.00 0.00 H new ATOM 0 HG3 GLN A1517 12.866 8.296 1.174 1.00 0.00 H new ATOM 0 HE21 GLN A1517 12.299 10.457 -0.773 1.00 0.00 H new ATOM 0 HE22 GLN A1517 13.817 10.733 -1.633 1.00 0.00 H new ATOM 151 N VAL A1518 13.203 4.614 2.539 1.00 0.00 N ATOM 152 CA VAL A1518 13.676 4.427 3.889 1.00 0.00 C ATOM 153 C VAL A1518 15.131 4.067 3.832 1.00 0.00 C ATOM 154 O VAL A1518 15.505 3.095 3.176 1.00 0.00 O ATOM 155 CB VAL A1518 12.913 3.269 4.622 1.00 0.00 C ATOM 156 CG1 VAL A1518 13.387 3.106 6.062 1.00 0.00 C ATOM 157 CG2 VAL A1518 11.415 3.480 4.590 1.00 0.00 C ATOM 0 H VAL A1518 13.461 3.860 1.903 1.00 0.00 H new ATOM 0 HA VAL A1518 13.506 5.352 4.441 1.00 0.00 H new ATOM 0 HB VAL A1518 13.142 2.352 4.079 1.00 0.00 H new ATOM 0 HG11 VAL A1518 12.836 2.295 6.537 1.00 0.00 H new ATOM 0 HG12 VAL A1518 14.452 2.875 6.070 1.00 0.00 H new ATOM 0 HG13 VAL A1518 13.213 4.032 6.609 1.00 0.00 H new ATOM 0 HG21 VAL A1518 10.921 2.658 5.107 1.00 0.00 H new ATOM 0 HG22 VAL A1518 11.169 4.420 5.084 1.00 0.00 H new ATOM 0 HG23 VAL A1518 11.074 3.514 3.555 1.00 0.00 H new ATOM 167 N THR A1519 15.948 4.843 4.448 1.00 0.00 N ATOM 168 CA THR A1519 17.324 4.521 4.512 1.00 0.00 C ATOM 169 C THR A1519 17.560 3.774 5.802 1.00 0.00 C ATOM 170 O THR A1519 17.287 4.300 6.883 1.00 0.00 O ATOM 171 CB THR A1519 18.206 5.783 4.476 1.00 0.00 C ATOM 172 OG1 THR A1519 17.783 6.623 3.389 1.00 0.00 O ATOM 173 CG2 THR A1519 19.668 5.396 4.264 1.00 0.00 C ATOM 0 H THR A1519 15.684 5.710 4.917 1.00 0.00 H new ATOM 0 HA THR A1519 17.592 3.914 3.647 1.00 0.00 H new ATOM 0 HB THR A1519 18.108 6.314 5.423 1.00 0.00 H new ATOM 0 HG1 THR A1519 18.340 7.429 3.362 1.00 0.00 H new ATOM 0 HG21 THR A1519 20.283 6.296 4.240 1.00 0.00 H new ATOM 0 HG22 THR A1519 19.996 4.754 5.081 1.00 0.00 H new ATOM 0 HG23 THR A1519 19.770 4.862 3.319 1.00 0.00 H new ATOM 181 N ASN A1520 17.962 2.541 5.688 1.00 0.00 N ATOM 182 CA ASN A1520 18.314 1.751 6.844 1.00 0.00 C ATOM 183 C ASN A1520 19.813 1.887 7.040 1.00 0.00 C ATOM 184 O ASN A1520 20.584 1.311 6.280 1.00 0.00 O ATOM 185 CB ASN A1520 17.888 0.282 6.613 1.00 0.00 C ATOM 186 CG ASN A1520 18.309 -0.720 7.697 1.00 0.00 C ATOM 187 OD1 ASN A1520 19.343 -0.597 8.328 1.00 0.00 O ATOM 188 ND2 ASN A1520 17.508 -1.727 7.897 1.00 0.00 N ATOM 0 H ASN A1520 18.056 2.052 4.798 1.00 0.00 H new ATOM 0 HA ASN A1520 17.801 2.094 7.743 1.00 0.00 H new ATOM 0 HB2 ASN A1520 16.803 0.250 6.519 1.00 0.00 H new ATOM 0 HB3 ASN A1520 18.301 -0.049 5.660 1.00 0.00 H new ATOM 0 HD21 ASN A1520 17.742 -2.434 8.594 1.00 0.00 H new ATOM 0 HD22 ASN A1520 16.647 -1.809 7.356 1.00 0.00 H new ATOM 195 N PRO A1521 20.247 2.663 8.048 1.00 0.00 N ATOM 196 CA PRO A1521 21.667 2.937 8.300 1.00 0.00 C ATOM 197 C PRO A1521 22.492 1.688 8.621 1.00 0.00 C ATOM 198 O PRO A1521 23.704 1.665 8.395 1.00 0.00 O ATOM 199 CB PRO A1521 21.655 3.891 9.505 1.00 0.00 C ATOM 200 CG PRO A1521 20.279 4.446 9.546 1.00 0.00 C ATOM 201 CD PRO A1521 19.387 3.372 9.012 1.00 0.00 C ATOM 0 HA PRO A1521 22.140 3.351 7.409 1.00 0.00 H new ATOM 0 HB2 PRO A1521 21.895 3.363 10.428 1.00 0.00 H new ATOM 0 HB3 PRO A1521 22.396 4.682 9.389 1.00 0.00 H new ATOM 0 HG2 PRO A1521 19.998 4.717 10.564 1.00 0.00 H new ATOM 0 HG3 PRO A1521 20.205 5.351 8.943 1.00 0.00 H new ATOM 0 HD2 PRO A1521 19.038 2.709 9.803 1.00 0.00 H new ATOM 0 HD3 PRO A1521 18.501 3.787 8.531 1.00 0.00 H new ATOM 209 N SER A1522 21.841 0.659 9.123 1.00 0.00 N ATOM 210 CA SER A1522 22.509 -0.566 9.503 1.00 0.00 C ATOM 211 C SER A1522 22.996 -1.340 8.267 1.00 0.00 C ATOM 212 O SER A1522 23.986 -2.083 8.329 1.00 0.00 O ATOM 213 CB SER A1522 21.550 -1.414 10.322 1.00 0.00 C ATOM 214 OG SER A1522 20.961 -0.631 11.355 1.00 0.00 O ATOM 0 H SER A1522 20.833 0.650 9.279 1.00 0.00 H new ATOM 0 HA SER A1522 23.388 -0.323 10.100 1.00 0.00 H new ATOM 0 HB2 SER A1522 20.772 -1.822 9.677 1.00 0.00 H new ATOM 0 HB3 SER A1522 22.082 -2.261 10.756 1.00 0.00 H new ATOM 0 HG SER A1522 20.344 -1.187 11.875 1.00 0.00 H new ATOM 220 N THR A1523 22.312 -1.168 7.161 1.00 0.00 N ATOM 221 CA THR A1523 22.687 -1.840 5.946 1.00 0.00 C ATOM 222 C THR A1523 23.165 -0.874 4.859 1.00 0.00 C ATOM 223 O THR A1523 23.966 -1.235 3.990 1.00 0.00 O ATOM 224 CB THR A1523 21.527 -2.714 5.430 1.00 0.00 C ATOM 225 OG1 THR A1523 20.291 -1.986 5.540 1.00 0.00 O ATOM 226 CG2 THR A1523 21.436 -4.012 6.212 1.00 0.00 C ATOM 0 H THR A1523 21.492 -0.567 7.080 1.00 0.00 H new ATOM 0 HA THR A1523 23.534 -2.482 6.188 1.00 0.00 H new ATOM 0 HB THR A1523 21.715 -2.960 4.385 1.00 0.00 H new ATOM 0 HG1 THR A1523 19.554 -2.541 5.210 1.00 0.00 H new ATOM 0 HG21 THR A1523 20.610 -4.611 5.829 1.00 0.00 H new ATOM 0 HG22 THR A1523 22.367 -4.568 6.104 1.00 0.00 H new ATOM 0 HG23 THR A1523 21.265 -3.791 7.266 1.00 0.00 H new ATOM 234 N GLY A1524 22.682 0.358 4.929 1.00 0.00 N ATOM 235 CA GLY A1524 23.014 1.362 3.944 1.00 0.00 C ATOM 236 C GLY A1524 22.149 1.207 2.726 1.00 0.00 C ATOM 237 O GLY A1524 22.428 1.758 1.665 1.00 0.00 O ATOM 0 H GLY A1524 22.055 0.682 5.665 1.00 0.00 H new ATOM 0 HA2 GLY A1524 22.879 2.356 4.369 1.00 0.00 H new ATOM 0 HA3 GLY A1524 24.064 1.274 3.666 1.00 0.00 H new ATOM 241 N HIS A1525 21.084 0.459 2.895 1.00 0.00 N ATOM 242 CA HIS A1525 20.187 0.135 1.820 1.00 0.00 C ATOM 243 C HIS A1525 19.012 1.086 1.835 1.00 0.00 C ATOM 244 O HIS A1525 18.273 1.166 2.830 1.00 0.00 O ATOM 245 CB HIS A1525 19.708 -1.328 1.964 1.00 0.00 C ATOM 246 CG HIS A1525 18.852 -1.850 0.828 1.00 0.00 C ATOM 247 ND1 HIS A1525 19.348 -2.638 -0.175 1.00 0.00 N ATOM 248 CD2 HIS A1525 17.523 -1.743 0.584 1.00 0.00 C ATOM 249 CE1 HIS A1525 18.377 -2.991 -0.985 1.00 0.00 C ATOM 250 NE2 HIS A1525 17.262 -2.464 -0.545 1.00 0.00 N ATOM 0 H HIS A1525 20.817 0.056 3.793 1.00 0.00 H new ATOM 0 HA HIS A1525 20.705 0.238 0.867 1.00 0.00 H new ATOM 0 HB2 HIS A1525 20.583 -1.970 2.061 1.00 0.00 H new ATOM 0 HB3 HIS A1525 19.143 -1.417 2.892 1.00 0.00 H new ATOM 0 HD2 HIS A1525 16.805 -1.191 1.173 1.00 0.00 H new ATOM 0 HE1 HIS A1525 18.480 -3.610 -1.864 1.00 0.00 H new ATOM 0 HE2 HIS A1525 16.345 -2.575 -0.977 1.00 0.00 H new ATOM 259 N LEU A1526 18.866 1.819 0.767 1.00 0.00 N ATOM 260 CA LEU A1526 17.761 2.719 0.598 1.00 0.00 C ATOM 261 C LEU A1526 16.592 1.962 0.001 1.00 0.00 C ATOM 262 O LEU A1526 16.642 1.521 -1.158 1.00 0.00 O ATOM 263 CB LEU A1526 18.165 3.894 -0.304 1.00 0.00 C ATOM 264 CG LEU A1526 17.078 4.930 -0.629 1.00 0.00 C ATOM 265 CD1 LEU A1526 16.539 5.571 0.630 1.00 0.00 C ATOM 266 CD2 LEU A1526 17.623 5.990 -1.564 1.00 0.00 C ATOM 0 H LEU A1526 19.517 1.808 -0.018 1.00 0.00 H new ATOM 0 HA LEU A1526 17.468 3.124 1.566 1.00 0.00 H new ATOM 0 HB2 LEU A1526 18.998 4.414 0.170 1.00 0.00 H new ATOM 0 HB3 LEU A1526 18.537 3.487 -1.244 1.00 0.00 H new ATOM 0 HG LEU A1526 16.256 4.411 -1.122 1.00 0.00 H new ATOM 0 HD11 LEU A1526 15.772 6.299 0.368 1.00 0.00 H new ATOM 0 HD12 LEU A1526 16.107 4.804 1.272 1.00 0.00 H new ATOM 0 HD13 LEU A1526 17.350 6.072 1.159 1.00 0.00 H new ATOM 0 HD21 LEU A1526 16.841 6.717 -1.785 1.00 0.00 H new ATOM 0 HD22 LEU A1526 18.465 6.495 -1.090 1.00 0.00 H new ATOM 0 HD23 LEU A1526 17.956 5.522 -2.490 1.00 0.00 H new ATOM 278 N PHE A1527 15.577 1.771 0.792 1.00 0.00 N ATOM 279 CA PHE A1527 14.381 1.095 0.355 1.00 0.00 C ATOM 280 C PHE A1527 13.553 2.042 -0.441 1.00 0.00 C ATOM 281 O PHE A1527 13.176 3.078 0.071 1.00 0.00 O ATOM 282 CB PHE A1527 13.525 0.645 1.541 1.00 0.00 C ATOM 283 CG PHE A1527 14.134 -0.375 2.431 1.00 0.00 C ATOM 284 CD1 PHE A1527 14.087 -1.700 2.091 1.00 0.00 C ATOM 285 CD2 PHE A1527 14.723 -0.015 3.628 1.00 0.00 C ATOM 286 CE1 PHE A1527 14.616 -2.649 2.912 1.00 0.00 C ATOM 287 CE2 PHE A1527 15.259 -0.969 4.453 1.00 0.00 C ATOM 288 CZ PHE A1527 15.204 -2.286 4.096 1.00 0.00 C ATOM 0 H PHE A1527 15.551 2.080 1.764 1.00 0.00 H new ATOM 0 HA PHE A1527 14.687 0.226 -0.227 1.00 0.00 H new ATOM 0 HB2 PHE A1527 13.280 1.522 2.140 1.00 0.00 H new ATOM 0 HB3 PHE A1527 12.585 0.249 1.156 1.00 0.00 H new ATOM 0 HD1 PHE A1527 13.625 -1.996 1.161 1.00 0.00 H new ATOM 0 HD2 PHE A1527 14.761 1.025 3.915 1.00 0.00 H new ATOM 0 HE1 PHE A1527 14.572 -3.690 2.630 1.00 0.00 H new ATOM 0 HE2 PHE A1527 15.724 -0.680 5.384 1.00 0.00 H new ATOM 0 HZ PHE A1527 15.623 -3.040 4.745 1.00 0.00 H new ATOM 298 N ASP A1528 13.302 1.725 -1.669 1.00 0.00 N ATOM 299 CA ASP A1528 12.393 2.520 -2.460 1.00 0.00 C ATOM 300 C ASP A1528 11.432 1.578 -3.128 1.00 0.00 C ATOM 301 O ASP A1528 11.777 0.422 -3.408 1.00 0.00 O ATOM 302 CB ASP A1528 13.104 3.401 -3.526 1.00 0.00 C ATOM 303 CG ASP A1528 13.483 2.663 -4.800 1.00 0.00 C ATOM 304 OD1 ASP A1528 14.598 2.105 -4.886 1.00 0.00 O ATOM 305 OD2 ASP A1528 12.673 2.642 -5.753 1.00 0.00 O1- ATOM 0 H ASP A1528 13.708 0.925 -2.154 1.00 0.00 H new ATOM 0 HA ASP A1528 11.883 3.217 -1.796 1.00 0.00 H new ATOM 0 HB2 ASP A1528 12.451 4.235 -3.784 1.00 0.00 H new ATOM 0 HB3 ASP A1528 14.006 3.826 -3.085 1.00 0.00 H new ATOM 310 N LEU A1529 10.241 2.031 -3.359 1.00 0.00 N ATOM 311 CA LEU A1529 9.236 1.220 -4.014 1.00 0.00 C ATOM 312 C LEU A1529 8.822 1.850 -5.333 1.00 0.00 C ATOM 313 O LEU A1529 7.720 1.626 -5.819 1.00 0.00 O ATOM 314 CB LEU A1529 8.016 1.024 -3.102 1.00 0.00 C ATOM 315 CG LEU A1529 8.251 0.244 -1.800 1.00 0.00 C ATOM 316 CD1 LEU A1529 6.993 0.240 -0.958 1.00 0.00 C ATOM 317 CD2 LEU A1529 8.679 -1.190 -2.095 1.00 0.00 C ATOM 0 H LEU A1529 9.928 2.968 -3.105 1.00 0.00 H new ATOM 0 HA LEU A1529 9.667 0.240 -4.220 1.00 0.00 H new ATOM 0 HB2 LEU A1529 7.622 2.007 -2.844 1.00 0.00 H new ATOM 0 HB3 LEU A1529 7.243 0.510 -3.673 1.00 0.00 H new ATOM 0 HG LEU A1529 9.051 0.738 -1.249 1.00 0.00 H new ATOM 0 HD11 LEU A1529 7.173 -0.316 -0.038 1.00 0.00 H new ATOM 0 HD12 LEU A1529 6.715 1.265 -0.714 1.00 0.00 H new ATOM 0 HD13 LEU A1529 6.184 -0.232 -1.515 1.00 0.00 H new ATOM 0 HD21 LEU A1529 8.839 -1.722 -1.157 1.00 0.00 H new ATOM 0 HD22 LEU A1529 7.899 -1.692 -2.668 1.00 0.00 H new ATOM 0 HD23 LEU A1529 9.605 -1.182 -2.671 1.00 0.00 H new ATOM 329 N SER A1530 9.737 2.594 -5.937 1.00 0.00 N ATOM 330 CA SER A1530 9.453 3.334 -7.161 1.00 0.00 C ATOM 331 C SER A1530 9.151 2.376 -8.321 1.00 0.00 C ATOM 332 O SER A1530 8.295 2.656 -9.169 1.00 0.00 O ATOM 333 CB SER A1530 10.644 4.206 -7.512 1.00 0.00 C ATOM 334 OG SER A1530 11.182 4.812 -6.344 1.00 0.00 O ATOM 0 H SER A1530 10.692 2.703 -5.596 1.00 0.00 H new ATOM 0 HA SER A1530 8.575 3.959 -6.995 1.00 0.00 H new ATOM 0 HB2 SER A1530 11.410 3.605 -8.002 1.00 0.00 H new ATOM 0 HB3 SER A1530 10.341 4.976 -8.221 1.00 0.00 H new ATOM 0 HG SER A1530 11.870 4.229 -5.960 1.00 0.00 H new ATOM 340 N SER A1531 9.808 1.221 -8.315 1.00 0.00 N ATOM 341 CA SER A1531 9.643 0.223 -9.350 1.00 0.00 C ATOM 342 C SER A1531 8.255 -0.425 -9.254 1.00 0.00 C ATOM 343 O SER A1531 7.778 -1.035 -10.203 1.00 0.00 O ATOM 344 CB SER A1531 10.759 -0.842 -9.239 1.00 0.00 C ATOM 345 OG SER A1531 10.719 -1.785 -10.313 1.00 0.00 O ATOM 0 H SER A1531 10.471 0.956 -7.587 1.00 0.00 H new ATOM 0 HA SER A1531 9.722 0.706 -10.324 1.00 0.00 H new ATOM 0 HB2 SER A1531 11.730 -0.347 -9.229 1.00 0.00 H new ATOM 0 HB3 SER A1531 10.661 -1.370 -8.291 1.00 0.00 H new ATOM 0 HG SER A1531 11.442 -2.437 -10.203 1.00 0.00 H new ATOM 351 N LEU A1532 7.612 -0.273 -8.114 1.00 0.00 N ATOM 352 CA LEU A1532 6.297 -0.837 -7.896 1.00 0.00 C ATOM 353 C LEU A1532 5.276 0.289 -7.780 1.00 0.00 C ATOM 354 O LEU A1532 4.111 0.069 -7.474 1.00 0.00 O ATOM 355 CB LEU A1532 6.302 -1.704 -6.629 1.00 0.00 C ATOM 356 CG LEU A1532 7.313 -2.867 -6.616 1.00 0.00 C ATOM 357 CD1 LEU A1532 7.258 -3.611 -5.297 1.00 0.00 C ATOM 358 CD2 LEU A1532 7.060 -3.824 -7.776 1.00 0.00 C ATOM 0 H LEU A1532 7.985 0.242 -7.317 1.00 0.00 H new ATOM 0 HA LEU A1532 6.025 -1.471 -8.740 1.00 0.00 H new ATOM 0 HB2 LEU A1532 6.505 -1.061 -5.773 1.00 0.00 H new ATOM 0 HB3 LEU A1532 5.302 -2.115 -6.489 1.00 0.00 H new ATOM 0 HG LEU A1532 8.311 -2.444 -6.734 1.00 0.00 H new ATOM 0 HD11 LEU A1532 7.980 -4.428 -5.310 1.00 0.00 H new ATOM 0 HD12 LEU A1532 7.498 -2.927 -4.483 1.00 0.00 H new ATOM 0 HD13 LEU A1532 6.256 -4.014 -5.148 1.00 0.00 H new ATOM 0 HD21 LEU A1532 7.787 -4.635 -7.743 1.00 0.00 H new ATOM 0 HD22 LEU A1532 6.054 -4.235 -7.696 1.00 0.00 H new ATOM 0 HD23 LEU A1532 7.158 -3.286 -8.719 1.00 0.00 H new ATOM 370 N SER A1533 5.725 1.488 -8.046 1.00 0.00 N ATOM 371 CA SER A1533 4.891 2.640 -7.961 1.00 0.00 C ATOM 372 C SER A1533 4.362 2.956 -9.349 1.00 0.00 C ATOM 373 O SER A1533 5.137 3.198 -10.295 1.00 0.00 O ATOM 374 CB SER A1533 5.675 3.828 -7.372 1.00 0.00 C ATOM 375 OG SER A1533 4.829 4.950 -7.139 1.00 0.00 O ATOM 0 H SER A1533 6.685 1.685 -8.328 1.00 0.00 H new ATOM 0 HA SER A1533 4.050 2.448 -7.295 1.00 0.00 H new ATOM 0 HB2 SER A1533 6.146 3.526 -6.436 1.00 0.00 H new ATOM 0 HB3 SER A1533 6.476 4.111 -8.055 1.00 0.00 H new ATOM 0 HG SER A1533 4.030 4.661 -6.651 1.00 0.00 H new ATOM 381 N GLY A1534 3.072 2.923 -9.481 1.00 0.00 N ATOM 382 CA GLY A1534 2.447 3.164 -10.751 1.00 0.00 C ATOM 383 C GLY A1534 1.346 4.164 -10.611 1.00 0.00 C ATOM 384 O GLY A1534 0.594 4.115 -9.641 1.00 0.00 O ATOM 0 H GLY A1534 2.423 2.730 -8.718 1.00 0.00 H new ATOM 0 HA2 GLY A1534 3.187 3.527 -11.464 1.00 0.00 H new ATOM 0 HA3 GLY A1534 2.050 2.231 -11.151 1.00 0.00 H new ATOM 388 N ARG A1535 1.227 5.056 -11.570 1.00 0.00 N ATOM 389 CA ARG A1535 0.245 6.126 -11.516 1.00 0.00 C ATOM 390 C ARG A1535 -1.180 5.614 -11.717 1.00 0.00 C ATOM 391 O ARG A1535 -2.131 6.186 -11.185 1.00 0.00 O ATOM 392 CB ARG A1535 0.591 7.242 -12.509 1.00 0.00 C ATOM 393 CG ARG A1535 1.877 7.992 -12.166 1.00 0.00 C ATOM 394 CD ARG A1535 2.177 9.114 -13.156 1.00 0.00 C ATOM 395 NE ARG A1535 1.082 10.096 -13.250 1.00 0.00 N ATOM 396 CZ ARG A1535 1.220 11.411 -13.503 1.00 0.00 C ATOM 397 NH1 ARG A1535 2.425 11.966 -13.548 1.00 0.00 N1+ ATOM 398 NH2 ARG A1535 0.139 12.161 -13.681 1.00 0.00 N ATOM 0 H ARG A1535 1.806 5.063 -12.410 1.00 0.00 H new ATOM 0 HA ARG A1535 0.284 6.549 -10.512 1.00 0.00 H new ATOM 0 HB2 ARG A1535 0.686 6.812 -13.506 1.00 0.00 H new ATOM 0 HB3 ARG A1535 -0.235 7.953 -12.546 1.00 0.00 H new ATOM 0 HG2 ARG A1535 1.795 8.409 -11.162 1.00 0.00 H new ATOM 0 HG3 ARG A1535 2.711 7.290 -12.152 1.00 0.00 H new ATOM 0 HD2 ARG A1535 3.092 9.624 -12.855 1.00 0.00 H new ATOM 0 HD3 ARG A1535 2.360 8.685 -14.141 1.00 0.00 H new ATOM 0 HE ARG A1535 0.134 9.748 -13.111 1.00 0.00 H new ATOM 0 HH11 ARG A1535 3.256 11.395 -13.390 1.00 0.00 H new ATOM 0 HH12 ARG A1535 2.520 12.963 -13.740 1.00 0.00 H new ATOM 0 HH21 ARG A1535 -0.788 11.740 -13.626 1.00 0.00 H new ATOM 0 HH22 ARG A1535 0.236 13.158 -13.873 1.00 0.00 H new ATOM 412 N ALA A1536 -1.332 4.534 -12.454 1.00 0.00 N ATOM 413 CA ALA A1536 -2.642 3.954 -12.639 1.00 0.00 C ATOM 414 C ALA A1536 -2.938 2.969 -11.529 1.00 0.00 C ATOM 415 O ALA A1536 -4.076 2.832 -11.076 1.00 0.00 O ATOM 416 CB ALA A1536 -2.784 3.313 -14.004 1.00 0.00 C ATOM 0 H ALA A1536 -0.573 4.046 -12.929 1.00 0.00 H new ATOM 0 HA ALA A1536 -3.378 4.756 -12.592 1.00 0.00 H new ATOM 0 HB1 ALA A1536 -3.783 2.888 -14.104 1.00 0.00 H new ATOM 0 HB2 ALA A1536 -2.630 4.066 -14.777 1.00 0.00 H new ATOM 0 HB3 ALA A1536 -2.041 2.523 -14.114 1.00 0.00 H new ATOM 422 N GLY A1537 -1.895 2.306 -11.078 1.00 0.00 N ATOM 423 CA GLY A1537 -2.008 1.385 -9.987 1.00 0.00 C ATOM 424 C GLY A1537 -2.419 0.020 -10.449 1.00 0.00 C ATOM 425 O GLY A1537 -2.352 -0.288 -11.646 1.00 0.00 O ATOM 0 H GLY A1537 -0.953 2.395 -11.460 1.00 0.00 H new ATOM 0 HA2 GLY A1537 -1.053 1.320 -9.466 1.00 0.00 H new ATOM 0 HA3 GLY A1537 -2.737 1.760 -9.269 1.00 0.00 H new ATOM 429 N PHE A1538 -2.839 -0.785 -9.530 1.00 0.00 N ATOM 430 CA PHE A1538 -3.281 -2.116 -9.804 1.00 0.00 C ATOM 431 C PHE A1538 -4.707 -2.236 -9.335 1.00 0.00 C ATOM 432 O PHE A1538 -5.027 -1.820 -8.220 1.00 0.00 O ATOM 433 CB PHE A1538 -2.428 -3.149 -9.039 1.00 0.00 C ATOM 434 CG PHE A1538 -0.956 -3.149 -9.362 1.00 0.00 C ATOM 435 CD1 PHE A1538 -0.457 -3.950 -10.374 1.00 0.00 C ATOM 436 CD2 PHE A1538 -0.072 -2.366 -8.637 1.00 0.00 C ATOM 437 CE1 PHE A1538 0.895 -3.971 -10.660 1.00 0.00 C ATOM 438 CE2 PHE A1538 1.281 -2.378 -8.919 1.00 0.00 C ATOM 439 CZ PHE A1538 1.764 -3.182 -9.931 1.00 0.00 C ATOM 0 H PHE A1538 -2.886 -0.531 -8.543 1.00 0.00 H new ATOM 0 HA PHE A1538 -3.190 -2.311 -10.873 1.00 0.00 H new ATOM 0 HB2 PHE A1538 -2.547 -2.971 -7.970 1.00 0.00 H new ATOM 0 HB3 PHE A1538 -2.826 -4.143 -9.242 1.00 0.00 H new ATOM 0 HD1 PHE A1538 -1.133 -4.567 -10.948 1.00 0.00 H new ATOM 0 HD2 PHE A1538 -0.445 -1.738 -7.841 1.00 0.00 H new ATOM 0 HE1 PHE A1538 1.271 -4.602 -11.451 1.00 0.00 H new ATOM 0 HE2 PHE A1538 1.958 -1.760 -8.349 1.00 0.00 H new ATOM 0 HZ PHE A1538 2.821 -3.195 -10.153 1.00 0.00 H new ATOM 449 N THR A1539 -5.567 -2.727 -10.169 1.00 0.00 N ATOM 450 CA THR A1539 -6.900 -2.995 -9.744 1.00 0.00 C ATOM 451 C THR A1539 -6.975 -4.465 -9.374 1.00 0.00 C ATOM 452 O THR A1539 -6.838 -5.345 -10.232 1.00 0.00 O ATOM 453 CB THR A1539 -7.927 -2.661 -10.837 1.00 0.00 C ATOM 454 OG1 THR A1539 -7.734 -1.308 -11.266 1.00 0.00 O ATOM 455 CG2 THR A1539 -9.344 -2.810 -10.303 1.00 0.00 C ATOM 0 H THR A1539 -5.370 -2.949 -11.145 1.00 0.00 H new ATOM 0 HA THR A1539 -7.144 -2.366 -8.888 1.00 0.00 H new ATOM 0 HB THR A1539 -7.787 -3.349 -11.671 1.00 0.00 H new ATOM 0 HG1 THR A1539 -8.386 -1.090 -11.965 1.00 0.00 H new ATOM 0 HG21 THR A1539 -10.057 -2.569 -11.091 1.00 0.00 H new ATOM 0 HG22 THR A1539 -9.502 -3.836 -9.972 1.00 0.00 H new ATOM 0 HG23 THR A1539 -9.489 -2.131 -9.463 1.00 0.00 H new ATOM 463 N ALA A1540 -7.103 -4.731 -8.112 1.00 0.00 N ATOM 464 CA ALA A1540 -7.151 -6.081 -7.638 1.00 0.00 C ATOM 465 C ALA A1540 -8.585 -6.503 -7.419 1.00 0.00 C ATOM 466 O ALA A1540 -9.248 -6.023 -6.497 1.00 0.00 O ATOM 467 CB ALA A1540 -6.342 -6.218 -6.362 1.00 0.00 C ATOM 0 H ALA A1540 -7.177 -4.022 -7.382 1.00 0.00 H new ATOM 0 HA ALA A1540 -6.713 -6.738 -8.389 1.00 0.00 H new ATOM 0 HB1 ALA A1540 -6.387 -7.249 -6.012 1.00 0.00 H new ATOM 0 HB2 ALA A1540 -5.305 -5.946 -6.558 1.00 0.00 H new ATOM 0 HB3 ALA A1540 -6.752 -5.557 -5.598 1.00 0.00 H new ATOM 473 N ALA A1541 -9.084 -7.342 -8.300 1.00 0.00 N ATOM 474 CA ALA A1541 -10.420 -7.869 -8.167 1.00 0.00 C ATOM 475 C ALA A1541 -10.371 -9.115 -7.343 1.00 0.00 C ATOM 476 O ALA A1541 -9.939 -10.170 -7.810 1.00 0.00 O ATOM 477 CB ALA A1541 -11.030 -8.160 -9.525 1.00 0.00 C ATOM 0 H ALA A1541 -8.579 -7.675 -9.121 1.00 0.00 H new ATOM 0 HA ALA A1541 -11.047 -7.125 -7.676 1.00 0.00 H new ATOM 0 HB1 ALA A1541 -12.037 -8.556 -9.394 1.00 0.00 H new ATOM 0 HB2 ALA A1541 -11.075 -7.240 -10.108 1.00 0.00 H new ATOM 0 HB3 ALA A1541 -10.417 -8.893 -10.050 1.00 0.00 H new ATOM 483 N TYR A1542 -10.784 -9.001 -6.130 1.00 0.00 N ATOM 484 CA TYR A1542 -10.778 -10.112 -5.228 1.00 0.00 C ATOM 485 C TYR A1542 -12.033 -10.930 -5.410 1.00 0.00 C ATOM 486 O TYR A1542 -13.150 -10.418 -5.216 1.00 0.00 O ATOM 487 CB TYR A1542 -10.624 -9.624 -3.802 1.00 0.00 C ATOM 488 CG TYR A1542 -9.291 -8.954 -3.545 1.00 0.00 C ATOM 489 CD1 TYR A1542 -8.127 -9.700 -3.505 1.00 0.00 C ATOM 490 CD2 TYR A1542 -9.194 -7.584 -3.359 1.00 0.00 C ATOM 491 CE1 TYR A1542 -6.905 -9.107 -3.283 1.00 0.00 C ATOM 492 CE2 TYR A1542 -7.971 -6.982 -3.134 1.00 0.00 C ATOM 493 CZ TYR A1542 -6.831 -7.753 -3.098 1.00 0.00 C ATOM 494 OH TYR A1542 -5.613 -7.165 -2.869 1.00 0.00 O ATOM 0 H TYR A1542 -11.138 -8.133 -5.728 1.00 0.00 H new ATOM 0 HA TYR A1542 -9.927 -10.757 -5.449 1.00 0.00 H new ATOM 0 HB2 TYR A1542 -11.427 -8.922 -3.576 1.00 0.00 H new ATOM 0 HB3 TYR A1542 -10.737 -10.468 -3.121 1.00 0.00 H new ATOM 0 HD1 TYR A1542 -8.178 -10.769 -3.651 1.00 0.00 H new ATOM 0 HD2 TYR A1542 -10.088 -6.978 -3.390 1.00 0.00 H new ATOM 0 HE1 TYR A1542 -6.008 -9.708 -3.255 1.00 0.00 H new ATOM 0 HE2 TYR A1542 -7.910 -5.914 -2.987 1.00 0.00 H new ATOM 0 HH TYR A1542 -4.921 -7.636 -3.379 1.00 0.00 H new ATOM 567 N GLY A1547 -13.206 -4.988 -6.723 1.00 0.00 N ATOM 568 CA GLY A1547 -12.024 -4.546 -7.402 1.00 0.00 C ATOM 569 C GLY A1547 -11.466 -3.316 -6.769 1.00 0.00 C ATOM 570 O GLY A1547 -12.023 -2.228 -6.914 1.00 0.00 O ATOM 0 HA2 GLY A1547 -11.275 -5.338 -7.387 1.00 0.00 H new ATOM 0 HA3 GLY A1547 -12.256 -4.347 -8.448 1.00 0.00 H new ATOM 574 N VAL A1548 -10.395 -3.484 -6.065 1.00 0.00 N ATOM 575 CA VAL A1548 -9.742 -2.402 -5.374 1.00 0.00 C ATOM 576 C VAL A1548 -8.767 -1.704 -6.320 1.00 0.00 C ATOM 577 O VAL A1548 -7.836 -2.336 -6.822 1.00 0.00 O ATOM 578 CB VAL A1548 -8.960 -2.933 -4.126 1.00 0.00 C ATOM 579 CG1 VAL A1548 -8.276 -1.800 -3.368 1.00 0.00 C ATOM 580 CG2 VAL A1548 -9.880 -3.713 -3.193 1.00 0.00 C ATOM 0 H VAL A1548 -9.936 -4.387 -5.947 1.00 0.00 H new ATOM 0 HA VAL A1548 -10.503 -1.698 -5.038 1.00 0.00 H new ATOM 0 HB VAL A1548 -8.187 -3.607 -4.494 1.00 0.00 H new ATOM 0 HG11 VAL A1548 -7.743 -2.207 -2.508 1.00 0.00 H new ATOM 0 HG12 VAL A1548 -7.570 -1.296 -4.027 1.00 0.00 H new ATOM 0 HG13 VAL A1548 -9.026 -1.087 -3.026 1.00 0.00 H new ATOM 0 HG21 VAL A1548 -9.310 -4.070 -2.335 1.00 0.00 H new ATOM 0 HG22 VAL A1548 -10.685 -3.064 -2.849 1.00 0.00 H new ATOM 0 HG23 VAL A1548 -10.303 -4.564 -3.727 1.00 0.00 H new ATOM 590 N TYR A1549 -9.010 -0.435 -6.604 1.00 0.00 N ATOM 591 CA TYR A1549 -8.065 0.354 -7.390 1.00 0.00 C ATOM 592 C TYR A1549 -7.010 0.810 -6.414 1.00 0.00 C ATOM 593 O TYR A1549 -7.310 1.614 -5.536 1.00 0.00 O ATOM 594 CB TYR A1549 -8.679 1.643 -7.973 1.00 0.00 C ATOM 595 CG TYR A1549 -9.885 1.561 -8.901 1.00 0.00 C ATOM 596 CD1 TYR A1549 -9.746 1.223 -10.243 1.00 0.00 C ATOM 597 CD2 TYR A1549 -11.152 1.927 -8.452 1.00 0.00 C ATOM 598 CE1 TYR A1549 -10.829 1.252 -11.099 1.00 0.00 C ATOM 599 CE2 TYR A1549 -12.232 1.941 -9.299 1.00 0.00 C ATOM 600 CZ TYR A1549 -12.070 1.612 -10.619 1.00 0.00 C ATOM 601 OH TYR A1549 -13.152 1.658 -11.474 1.00 0.00 O ATOM 0 H TYR A1549 -9.845 0.071 -6.307 1.00 0.00 H new ATOM 0 HA TYR A1549 -7.711 -0.260 -8.218 1.00 0.00 H new ATOM 0 HB2 TYR A1549 -8.960 2.277 -7.132 1.00 0.00 H new ATOM 0 HB3 TYR A1549 -7.888 2.163 -8.514 1.00 0.00 H new ATOM 0 HD1 TYR A1549 -8.777 0.934 -10.621 1.00 0.00 H new ATOM 0 HD2 TYR A1549 -11.287 2.205 -7.417 1.00 0.00 H new ATOM 0 HE1 TYR A1549 -10.704 0.994 -12.140 1.00 0.00 H new ATOM 0 HE2 TYR A1549 -13.209 2.211 -8.925 1.00 0.00 H new ATOM 0 HH TYR A1549 -13.951 1.929 -10.976 1.00 0.00 H new ATOM 611 N MET A1550 -5.821 0.315 -6.504 1.00 0.00 N ATOM 612 CA MET A1550 -4.827 0.709 -5.539 1.00 0.00 C ATOM 613 C MET A1550 -3.491 1.004 -6.176 1.00 0.00 C ATOM 614 O MET A1550 -3.015 0.261 -7.025 1.00 0.00 O ATOM 615 CB MET A1550 -4.709 -0.347 -4.430 1.00 0.00 C ATOM 616 CG MET A1550 -4.305 -1.738 -4.906 1.00 0.00 C ATOM 617 SD MET A1550 -4.465 -2.989 -3.615 1.00 0.00 S ATOM 618 CE MET A1550 -3.474 -2.280 -2.308 1.00 0.00 C ATOM 0 H MET A1550 -5.510 -0.348 -7.214 1.00 0.00 H new ATOM 0 HA MET A1550 -5.159 1.644 -5.087 1.00 0.00 H new ATOM 0 HB2 MET A1550 -3.978 -0.003 -3.698 1.00 0.00 H new ATOM 0 HB3 MET A1550 -5.667 -0.420 -3.915 1.00 0.00 H new ATOM 0 HG2 MET A1550 -4.923 -2.020 -5.758 1.00 0.00 H new ATOM 0 HG3 MET A1550 -3.273 -1.712 -5.256 1.00 0.00 H new ATOM 0 HE1 MET A1550 -3.274 -3.038 -1.551 1.00 0.00 H new ATOM 0 HE2 MET A1550 -2.531 -1.921 -2.720 1.00 0.00 H new ATOM 0 HE3 MET A1550 -4.012 -1.447 -1.854 1.00 0.00 H new ATOM 628 N SER A1551 -2.906 2.099 -5.788 1.00 0.00 N ATOM 629 CA SER A1551 -1.605 2.461 -6.258 1.00 0.00 C ATOM 630 C SER A1551 -0.642 2.278 -5.124 1.00 0.00 C ATOM 631 O SER A1551 -1.024 2.383 -3.955 1.00 0.00 O ATOM 632 CB SER A1551 -1.578 3.922 -6.757 1.00 0.00 C ATOM 633 OG SER A1551 -0.277 4.326 -7.179 1.00 0.00 O ATOM 0 H SER A1551 -3.319 2.766 -5.136 1.00 0.00 H new ATOM 0 HA SER A1551 -1.328 1.829 -7.102 1.00 0.00 H new ATOM 0 HB2 SER A1551 -2.277 4.033 -7.586 1.00 0.00 H new ATOM 0 HB3 SER A1551 -1.920 4.582 -5.960 1.00 0.00 H new ATOM 0 HG SER A1551 -0.181 4.166 -8.141 1.00 0.00 H new ATOM 639 N ILE A1552 0.560 1.944 -5.449 1.00 0.00 N ATOM 640 CA ILE A1552 1.585 1.834 -4.478 1.00 0.00 C ATOM 641 C ILE A1552 2.389 3.115 -4.527 1.00 0.00 C ATOM 642 O ILE A1552 2.938 3.470 -5.591 1.00 0.00 O ATOM 643 CB ILE A1552 2.506 0.564 -4.690 1.00 0.00 C ATOM 644 CG1 ILE A1552 1.782 -0.761 -4.311 1.00 0.00 C ATOM 645 CG2 ILE A1552 3.811 0.678 -3.911 1.00 0.00 C ATOM 646 CD1 ILE A1552 0.603 -1.146 -5.186 1.00 0.00 C ATOM 0 H ILE A1552 0.857 1.739 -6.403 1.00 0.00 H new ATOM 0 HA ILE A1552 1.136 1.693 -3.495 1.00 0.00 H new ATOM 0 HB ILE A1552 2.735 0.533 -5.755 1.00 0.00 H new ATOM 0 HG12 ILE A1552 2.510 -1.571 -4.339 1.00 0.00 H new ATOM 0 HG13 ILE A1552 1.434 -0.681 -3.281 1.00 0.00 H new ATOM 0 HG21 ILE A1552 4.416 -0.213 -4.082 1.00 0.00 H new ATOM 0 HG22 ILE A1552 4.359 1.559 -4.246 1.00 0.00 H new ATOM 0 HG23 ILE A1552 3.593 0.769 -2.847 1.00 0.00 H new ATOM 0 HD11 ILE A1552 0.177 -2.084 -4.830 1.00 0.00 H new ATOM 0 HD12 ILE A1552 -0.154 -0.363 -5.141 1.00 0.00 H new ATOM 0 HD13 ILE A1552 0.939 -1.268 -6.216 1.00 0.00 H new ATOM 658 N CYS A1553 2.355 3.849 -3.421 1.00 0.00 N ATOM 659 CA CYS A1553 3.121 5.072 -3.247 1.00 0.00 C ATOM 660 C CYS A1553 2.558 6.238 -4.041 1.00 0.00 C ATOM 661 O CYS A1553 3.262 6.863 -4.835 1.00 0.00 O ATOM 662 CB CYS A1553 4.597 4.838 -3.563 1.00 0.00 C ATOM 663 SG CYS A1553 5.336 3.581 -2.496 1.00 0.00 S ATOM 0 H CYS A1553 1.786 3.606 -2.610 1.00 0.00 H new ATOM 0 HA CYS A1553 3.036 5.352 -2.197 1.00 0.00 H new ATOM 0 HB2 CYS A1553 4.699 4.533 -4.604 1.00 0.00 H new ATOM 0 HB3 CYS A1553 5.143 5.774 -3.450 1.00 0.00 H new ATOM 668 N GLY A1554 1.293 6.535 -3.828 1.00 0.00 N ATOM 669 CA GLY A1554 0.708 7.671 -4.468 1.00 0.00 C ATOM 670 C GLY A1554 -0.743 7.475 -4.734 1.00 0.00 C ATOM 671 O GLY A1554 -1.378 6.602 -4.131 1.00 0.00 O ATOM 0 H GLY A1554 0.665 6.007 -3.222 1.00 0.00 H new ATOM 0 HA2 GLY A1554 0.846 8.552 -3.841 1.00 0.00 H new ATOM 0 HA3 GLY A1554 1.226 7.865 -5.407 1.00 0.00 H new ATOM 675 N GLU A1555 -1.270 8.277 -5.616 1.00 0.00 N ATOM 676 CA GLU A1555 -2.653 8.221 -5.977 1.00 0.00 C ATOM 677 C GLU A1555 -2.809 7.469 -7.273 1.00 0.00 C ATOM 678 O GLU A1555 -1.921 7.508 -8.145 1.00 0.00 O ATOM 679 CB GLU A1555 -3.281 9.637 -6.100 1.00 0.00 C ATOM 680 CG GLU A1555 -2.640 10.585 -7.128 1.00 0.00 C ATOM 681 CD GLU A1555 -1.285 11.105 -6.708 1.00 0.00 C ATOM 682 OE1 GLU A1555 -0.270 10.431 -6.951 1.00 0.00 O ATOM 683 OE2 GLU A1555 -1.221 12.195 -6.111 1.00 0.00 O1- ATOM 0 H GLU A1555 -0.741 8.997 -6.109 1.00 0.00 H new ATOM 0 HA GLU A1555 -3.185 7.699 -5.182 1.00 0.00 H new ATOM 0 HB2 GLU A1555 -4.335 9.522 -6.353 1.00 0.00 H new ATOM 0 HB3 GLU A1555 -3.238 10.115 -5.122 1.00 0.00 H new ATOM 0 HG2 GLU A1555 -2.540 10.062 -8.079 1.00 0.00 H new ATOM 0 HG3 GLU A1555 -3.308 11.430 -7.297 1.00 0.00 H new ATOM 690 N ASN A1556 -3.897 6.772 -7.411 1.00 0.00 N ATOM 691 CA ASN A1556 -4.139 6.056 -8.626 1.00 0.00 C ATOM 692 C ASN A1556 -5.090 6.870 -9.465 1.00 0.00 C ATOM 693 O ASN A1556 -6.090 7.390 -8.966 1.00 0.00 O ATOM 694 CB ASN A1556 -4.671 4.613 -8.388 1.00 0.00 C ATOM 695 CG ASN A1556 -6.115 4.515 -7.965 1.00 0.00 C ATOM 696 OD1 ASN A1556 -6.991 4.429 -8.806 1.00 0.00 O ATOM 697 ND2 ASN A1556 -6.375 4.485 -6.671 1.00 0.00 N ATOM 0 H ASN A1556 -4.626 6.684 -6.703 1.00 0.00 H new ATOM 0 HA ASN A1556 -3.193 5.923 -9.150 1.00 0.00 H new ATOM 0 HB2 ASN A1556 -4.540 4.040 -9.306 1.00 0.00 H new ATOM 0 HB3 ASN A1556 -4.054 4.138 -7.625 1.00 0.00 H new ATOM 0 HD21 ASN A1556 -7.337 4.387 -6.346 1.00 0.00 H new ATOM 0 HD22 ASN A1556 -5.614 4.560 -5.996 1.00 0.00 H new ATOM 704 N GLU A1557 -4.763 7.023 -10.725 1.00 0.00 N ATOM 705 CA GLU A1557 -5.560 7.819 -11.643 1.00 0.00 C ATOM 706 C GLU A1557 -6.853 7.136 -12.069 1.00 0.00 C ATOM 707 O GLU A1557 -7.593 7.652 -12.904 1.00 0.00 O ATOM 708 CB GLU A1557 -4.756 8.271 -12.850 1.00 0.00 C ATOM 709 CG GLU A1557 -4.140 7.160 -13.671 1.00 0.00 C ATOM 710 CD GLU A1557 -3.425 7.700 -14.865 1.00 0.00 C ATOM 711 OE1 GLU A1557 -4.085 7.972 -15.898 1.00 0.00 O1- ATOM 712 OE2 GLU A1557 -2.208 7.923 -14.794 1.00 0.00 O ATOM 0 H GLU A1557 -3.937 6.601 -11.149 1.00 0.00 H new ATOM 0 HA GLU A1557 -5.851 8.706 -11.081 1.00 0.00 H new ATOM 0 HB2 GLU A1557 -5.405 8.862 -13.497 1.00 0.00 H new ATOM 0 HB3 GLU A1557 -3.960 8.932 -12.508 1.00 0.00 H new ATOM 0 HG2 GLU A1557 -3.444 6.592 -13.054 1.00 0.00 H new ATOM 0 HG3 GLU A1557 -4.918 6.468 -13.993 1.00 0.00 H new ATOM 719 N ASN A1558 -7.128 5.991 -11.501 1.00 0.00 N ATOM 720 CA ASN A1558 -8.379 5.302 -11.753 1.00 0.00 C ATOM 721 C ASN A1558 -9.341 5.616 -10.613 1.00 0.00 C ATOM 722 O ASN A1558 -10.403 5.006 -10.467 1.00 0.00 O ATOM 723 CB ASN A1558 -8.170 3.790 -11.928 1.00 0.00 C ATOM 724 CG ASN A1558 -7.364 3.441 -13.174 1.00 0.00 C ATOM 725 OD1 ASN A1558 -7.389 4.164 -14.180 1.00 0.00 O ATOM 726 ND2 ASN A1558 -6.653 2.345 -13.132 1.00 0.00 N ATOM 0 H ASN A1558 -6.502 5.509 -10.856 1.00 0.00 H new ATOM 0 HA ASN A1558 -8.806 5.654 -12.692 1.00 0.00 H new ATOM 0 HB2 ASN A1558 -7.660 3.395 -11.049 1.00 0.00 H new ATOM 0 HB3 ASN A1558 -9.141 3.298 -11.981 1.00 0.00 H new ATOM 0 HD21 ASN A1558 -6.099 2.065 -13.941 1.00 0.00 H new ATOM 0 HD22 ASN A1558 -6.652 1.770 -12.290 1.00 0.00 H new ATOM 733 N CYS A1559 -8.924 6.590 -9.825 1.00 0.00 N ATOM 734 CA CYS A1559 -9.639 7.160 -8.710 1.00 0.00 C ATOM 735 C CYS A1559 -9.384 8.665 -8.728 1.00 0.00 C ATOM 736 O CYS A1559 -8.571 9.129 -9.546 1.00 0.00 O ATOM 737 CB CYS A1559 -9.114 6.574 -7.397 1.00 0.00 C ATOM 738 SG CYS A1559 -9.655 4.887 -7.050 1.00 0.00 S ATOM 0 H CYS A1559 -8.014 7.030 -9.961 1.00 0.00 H new ATOM 0 HA CYS A1559 -10.704 6.940 -8.787 1.00 0.00 H new ATOM 0 HB2 CYS A1559 -8.024 6.594 -7.417 1.00 0.00 H new ATOM 0 HB3 CYS A1559 -9.430 7.218 -6.576 1.00 0.00 H new ATOM 743 N PRO A1560 -10.091 9.471 -7.899 1.00 0.00 N ATOM 744 CA PRO A1560 -9.816 10.904 -7.796 1.00 0.00 C ATOM 745 C PRO A1560 -8.398 11.133 -7.259 1.00 0.00 C ATOM 746 O PRO A1560 -8.042 10.591 -6.195 1.00 0.00 O ATOM 747 CB PRO A1560 -10.851 11.400 -6.770 1.00 0.00 C ATOM 748 CG PRO A1560 -11.915 10.365 -6.769 1.00 0.00 C ATOM 749 CD PRO A1560 -11.215 9.073 -7.021 1.00 0.00 C ATOM 0 HA PRO A1560 -9.881 11.419 -8.755 1.00 0.00 H new ATOM 0 HB2 PRO A1560 -10.406 11.510 -5.781 1.00 0.00 H new ATOM 0 HB3 PRO A1560 -11.249 12.375 -7.050 1.00 0.00 H new ATOM 0 HG2 PRO A1560 -12.443 10.346 -5.815 1.00 0.00 H new ATOM 0 HG3 PRO A1560 -12.658 10.566 -7.541 1.00 0.00 H new ATOM 0 HD2 PRO A1560 -10.863 8.617 -6.096 1.00 0.00 H new ATOM 0 HD3 PRO A1560 -11.868 8.347 -7.505 1.00 0.00 H new ATOM 757 N PRO A1561 -7.555 11.892 -8.006 1.00 0.00 N ATOM 758 CA PRO A1561 -6.180 12.196 -7.595 1.00 0.00 C ATOM 759 C PRO A1561 -6.148 12.770 -6.184 1.00 0.00 C ATOM 760 O PRO A1561 -6.704 13.837 -5.917 1.00 0.00 O ATOM 761 CB PRO A1561 -5.716 13.235 -8.618 1.00 0.00 C ATOM 762 CG PRO A1561 -6.554 12.975 -9.820 1.00 0.00 C ATOM 763 CD PRO A1561 -7.885 12.506 -9.307 1.00 0.00 C ATOM 0 HA PRO A1561 -5.542 11.313 -7.571 1.00 0.00 H new ATOM 0 HB2 PRO A1561 -5.859 14.250 -8.246 1.00 0.00 H new ATOM 0 HB3 PRO A1561 -4.655 13.125 -8.842 1.00 0.00 H new ATOM 0 HG2 PRO A1561 -6.664 13.878 -10.421 1.00 0.00 H new ATOM 0 HG3 PRO A1561 -6.095 12.221 -10.459 1.00 0.00 H new ATOM 0 HD2 PRO A1561 -8.586 13.333 -9.194 1.00 0.00 H new ATOM 0 HD3 PRO A1561 -8.346 11.787 -9.985 1.00 0.00 H new ATOM 771 N GLY A1562 -5.557 12.021 -5.294 1.00 0.00 N ATOM 772 CA GLY A1562 -5.506 12.372 -3.907 1.00 0.00 C ATOM 773 C GLY A1562 -5.798 11.151 -3.087 1.00 0.00 C ATOM 774 O GLY A1562 -5.289 10.986 -1.972 1.00 0.00 O ATOM 0 H GLY A1562 -5.093 11.140 -5.517 1.00 0.00 H new ATOM 0 HA2 GLY A1562 -4.523 12.770 -3.655 1.00 0.00 H new ATOM 0 HA3 GLY A1562 -6.232 13.155 -3.689 1.00 0.00 H new ATOM 778 N VAL A1563 -6.618 10.290 -3.656 1.00 0.00 N ATOM 779 CA VAL A1563 -6.981 9.020 -3.065 1.00 0.00 C ATOM 780 C VAL A1563 -5.956 7.970 -3.507 1.00 0.00 C ATOM 781 O VAL A1563 -5.629 7.871 -4.693 1.00 0.00 O ATOM 782 CB VAL A1563 -8.402 8.593 -3.527 1.00 0.00 C ATOM 783 CG1 VAL A1563 -8.805 7.273 -2.902 1.00 0.00 C ATOM 784 CG2 VAL A1563 -9.427 9.671 -3.190 1.00 0.00 C ATOM 0 H VAL A1563 -7.059 10.458 -4.560 1.00 0.00 H new ATOM 0 HA VAL A1563 -6.987 9.110 -1.979 1.00 0.00 H new ATOM 0 HB VAL A1563 -8.375 8.465 -4.609 1.00 0.00 H new ATOM 0 HG11 VAL A1563 -9.803 6.999 -3.243 1.00 0.00 H new ATOM 0 HG12 VAL A1563 -8.096 6.499 -3.197 1.00 0.00 H new ATOM 0 HG13 VAL A1563 -8.806 7.370 -1.816 1.00 0.00 H new ATOM 0 HG21 VAL A1563 -10.414 9.351 -3.522 1.00 0.00 H new ATOM 0 HG22 VAL A1563 -9.442 9.834 -2.112 1.00 0.00 H new ATOM 0 HG23 VAL A1563 -9.158 10.599 -3.694 1.00 0.00 H new ATOM 794 N GLY A1564 -5.452 7.209 -2.551 1.00 0.00 N ATOM 795 CA GLY A1564 -4.423 6.234 -2.840 1.00 0.00 C ATOM 796 C GLY A1564 -4.996 4.919 -3.292 1.00 0.00 C ATOM 797 O GLY A1564 -4.499 4.298 -4.250 1.00 0.00 O ATOM 0 H GLY A1564 -5.739 7.249 -1.573 1.00 0.00 H new ATOM 0 HA2 GLY A1564 -3.762 6.625 -3.613 1.00 0.00 H new ATOM 0 HA3 GLY A1564 -3.814 6.076 -1.950 1.00 0.00 H new ATOM 801 N ALA A1565 -6.053 4.501 -2.640 1.00 0.00 N ATOM 802 CA ALA A1565 -6.682 3.246 -2.944 1.00 0.00 C ATOM 803 C ALA A1565 -8.184 3.376 -2.789 1.00 0.00 C ATOM 804 O ALA A1565 -8.666 4.138 -1.936 1.00 0.00 O ATOM 805 CB ALA A1565 -6.136 2.150 -2.036 1.00 0.00 C ATOM 0 H ALA A1565 -6.499 5.023 -1.885 1.00 0.00 H new ATOM 0 HA ALA A1565 -6.461 2.973 -3.976 1.00 0.00 H new ATOM 0 HB1 ALA A1565 -6.621 1.204 -2.276 1.00 0.00 H new ATOM 0 HB2 ALA A1565 -5.061 2.055 -2.186 1.00 0.00 H new ATOM 0 HB3 ALA A1565 -6.336 2.406 -0.996 1.00 0.00 H new ATOM 811 N CYS A1566 -8.912 2.655 -3.593 1.00 0.00 N ATOM 812 CA CYS A1566 -10.351 2.687 -3.566 1.00 0.00 C ATOM 813 C CYS A1566 -10.910 1.291 -3.485 1.00 0.00 C ATOM 814 O CYS A1566 -10.479 0.401 -4.215 1.00 0.00 O ATOM 815 CB CYS A1566 -10.890 3.329 -4.819 1.00 0.00 C ATOM 816 SG CYS A1566 -10.303 5.004 -5.143 1.00 0.00 S ATOM 0 H CYS A1566 -8.523 2.023 -4.292 1.00 0.00 H new ATOM 0 HA CYS A1566 -10.649 3.263 -2.690 1.00 0.00 H new ATOM 0 HB2 CYS A1566 -10.630 2.700 -5.670 1.00 0.00 H new ATOM 0 HB3 CYS A1566 -11.978 3.349 -4.758 1.00 0.00 H new ATOM 821 N PHE A1567 -11.873 1.109 -2.636 1.00 0.00 N ATOM 822 CA PHE A1567 -12.523 -0.154 -2.484 1.00 0.00 C ATOM 823 C PHE A1567 -13.690 -0.206 -3.460 1.00 0.00 C ATOM 824 O PHE A1567 -14.625 0.594 -3.371 1.00 0.00 O ATOM 825 CB PHE A1567 -13.020 -0.313 -1.034 1.00 0.00 C ATOM 826 CG PHE A1567 -13.645 -1.652 -0.726 1.00 0.00 C ATOM 827 CD1 PHE A1567 -12.861 -2.712 -0.314 1.00 0.00 C ATOM 828 CD2 PHE A1567 -15.015 -1.847 -0.844 1.00 0.00 C ATOM 829 CE1 PHE A1567 -13.424 -3.940 -0.027 1.00 0.00 C ATOM 830 CE2 PHE A1567 -15.582 -3.070 -0.561 1.00 0.00 C ATOM 831 CZ PHE A1567 -14.786 -4.118 -0.151 1.00 0.00 C ATOM 0 H PHE A1567 -12.233 1.841 -2.023 1.00 0.00 H new ATOM 0 HA PHE A1567 -11.831 -0.969 -2.695 1.00 0.00 H new ATOM 0 HB2 PHE A1567 -12.181 -0.154 -0.357 1.00 0.00 H new ATOM 0 HB3 PHE A1567 -13.749 0.470 -0.826 1.00 0.00 H new ATOM 0 HD1 PHE A1567 -11.794 -2.579 -0.215 1.00 0.00 H new ATOM 0 HD2 PHE A1567 -15.644 -1.029 -1.162 1.00 0.00 H new ATOM 0 HE1 PHE A1567 -12.799 -4.760 0.294 1.00 0.00 H new ATOM 0 HE2 PHE A1567 -16.649 -3.208 -0.660 1.00 0.00 H new ATOM 0 HZ PHE A1567 -15.228 -5.077 0.073 1.00 0.00 H new ATOM 841 N GLY A1568 -13.604 -1.088 -4.417 1.00 0.00 N ATOM 842 CA GLY A1568 -14.670 -1.248 -5.354 1.00 0.00 C ATOM 843 C GLY A1568 -14.503 -0.345 -6.552 1.00 0.00 C ATOM 844 O GLY A1568 -13.760 0.647 -6.510 1.00 0.00 O ATOM 0 H GLY A1568 -12.805 -1.705 -4.565 1.00 0.00 H new ATOM 0 HA2 GLY A1568 -14.711 -2.286 -5.684 1.00 0.00 H new ATOM 0 HA3 GLY A1568 -15.620 -1.031 -4.865 1.00 0.00 H new ATOM 848 N GLN A1569 -15.228 -0.646 -7.600 1.00 0.00 N ATOM 849 CA GLN A1569 -15.154 0.101 -8.844 1.00 0.00 C ATOM 850 C GLN A1569 -15.971 1.396 -8.750 1.00 0.00 C ATOM 851 O GLN A1569 -16.085 2.152 -9.723 1.00 0.00 O ATOM 852 CB GLN A1569 -15.631 -0.769 -10.012 1.00 0.00 C ATOM 853 CG GLN A1569 -14.803 -2.037 -10.232 1.00 0.00 C ATOM 854 CD GLN A1569 -13.366 -1.753 -10.635 1.00 0.00 C ATOM 855 OE1 GLN A1569 -13.051 -1.644 -11.817 1.00 0.00 O ATOM 856 NE2 GLN A1569 -12.484 -1.638 -9.677 1.00 0.00 N ATOM 0 H GLN A1569 -15.892 -1.420 -7.621 1.00 0.00 H new ATOM 0 HA GLN A1569 -14.115 0.377 -9.024 1.00 0.00 H new ATOM 0 HB2 GLN A1569 -16.669 -1.053 -9.838 1.00 0.00 H new ATOM 0 HB3 GLN A1569 -15.612 -0.174 -10.925 1.00 0.00 H new ATOM 0 HG2 GLN A1569 -14.806 -2.628 -9.316 1.00 0.00 H new ATOM 0 HG3 GLN A1569 -15.277 -2.643 -11.004 1.00 0.00 H new ATOM 0 HE21 GLN A1569 -12.773 -1.733 -8.703 1.00 0.00 H new ATOM 0 HE22 GLN A1569 -11.507 -1.453 -9.903 1.00 0.00 H new ATOM 865 N THR A1570 -16.526 1.634 -7.570 1.00 0.00 N ATOM 866 CA THR A1570 -17.294 2.824 -7.276 1.00 0.00 C ATOM 867 C THR A1570 -16.341 3.963 -6.802 1.00 0.00 C ATOM 868 O THR A1570 -16.766 5.093 -6.530 1.00 0.00 O ATOM 869 CB THR A1570 -18.331 2.512 -6.160 1.00 0.00 C ATOM 870 OG1 THR A1570 -18.935 1.226 -6.409 1.00 0.00 O ATOM 871 CG2 THR A1570 -19.435 3.566 -6.126 1.00 0.00 C ATOM 0 H THR A1570 -16.451 0.992 -6.781 1.00 0.00 H new ATOM 0 HA THR A1570 -17.817 3.146 -8.176 1.00 0.00 H new ATOM 0 HB THR A1570 -17.808 2.513 -5.204 1.00 0.00 H new ATOM 0 HG1 THR A1570 -19.587 1.029 -5.705 1.00 0.00 H new ATOM 0 HG21 THR A1570 -20.146 3.323 -5.336 1.00 0.00 H new ATOM 0 HG22 THR A1570 -18.997 4.545 -5.931 1.00 0.00 H new ATOM 0 HG23 THR A1570 -19.951 3.584 -7.086 1.00 0.00 H new ATOM 879 N ARG A1571 -15.035 3.623 -6.701 1.00 0.00 N ATOM 880 CA ARG A1571 -13.971 4.567 -6.304 1.00 0.00 C ATOM 881 C ARG A1571 -14.125 5.049 -4.863 1.00 0.00 C ATOM 882 O ARG A1571 -13.825 6.202 -4.543 1.00 0.00 O ATOM 883 CB ARG A1571 -13.857 5.761 -7.278 1.00 0.00 C ATOM 884 CG ARG A1571 -13.380 5.377 -8.663 1.00 0.00 C ATOM 885 CD ARG A1571 -13.344 6.575 -9.598 1.00 0.00 C ATOM 886 NE ARG A1571 -12.803 6.212 -10.908 1.00 0.00 N ATOM 887 CZ ARG A1571 -13.041 6.848 -12.054 1.00 0.00 C ATOM 888 NH1 ARG A1571 -13.692 8.005 -12.055 1.00 0.00 N1+ ATOM 889 NH2 ARG A1571 -12.584 6.351 -13.190 1.00 0.00 N ATOM 0 H ARG A1571 -14.691 2.682 -6.894 1.00 0.00 H new ATOM 0 HA ARG A1571 -13.038 4.006 -6.359 1.00 0.00 H new ATOM 0 HB2 ARG A1571 -14.830 6.245 -7.360 1.00 0.00 H new ATOM 0 HB3 ARG A1571 -13.170 6.496 -6.858 1.00 0.00 H new ATOM 0 HG2 ARG A1571 -12.385 4.938 -8.596 1.00 0.00 H new ATOM 0 HG3 ARG A1571 -14.039 4.613 -9.076 1.00 0.00 H new ATOM 0 HD2 ARG A1571 -14.350 6.977 -9.717 1.00 0.00 H new ATOM 0 HD3 ARG A1571 -12.736 7.365 -9.157 1.00 0.00 H new ATOM 0 HE ARG A1571 -12.188 5.399 -10.947 1.00 0.00 H new ATOM 0 HH11 ARG A1571 -14.012 8.411 -11.176 1.00 0.00 H new ATOM 0 HH12 ARG A1571 -13.872 8.488 -12.935 1.00 0.00 H new ATOM 0 HH21 ARG A1571 -12.050 5.482 -13.188 1.00 0.00 H new ATOM 0 HH22 ARG A1571 -12.765 6.836 -14.069 1.00 0.00 H new ATOM 903 N ILE A1572 -14.577 4.159 -4.003 1.00 0.00 N ATOM 904 CA ILE A1572 -14.761 4.453 -2.590 1.00 0.00 C ATOM 905 C ILE A1572 -13.396 4.546 -1.919 1.00 0.00 C ATOM 906 O ILE A1572 -12.670 3.566 -1.858 1.00 0.00 O ATOM 907 CB ILE A1572 -15.615 3.348 -1.916 1.00 0.00 C ATOM 908 CG1 ILE A1572 -17.012 3.312 -2.544 1.00 0.00 C ATOM 909 CG2 ILE A1572 -15.703 3.559 -0.412 1.00 0.00 C ATOM 910 CD1 ILE A1572 -17.895 2.192 -2.038 1.00 0.00 C ATOM 0 H ILE A1572 -14.829 3.205 -4.263 1.00 0.00 H new ATOM 0 HA ILE A1572 -15.285 5.403 -2.483 1.00 0.00 H new ATOM 0 HB ILE A1572 -15.129 2.387 -2.083 1.00 0.00 H new ATOM 0 HG12 ILE A1572 -17.508 4.264 -2.353 1.00 0.00 H new ATOM 0 HG13 ILE A1572 -16.909 3.217 -3.625 1.00 0.00 H new ATOM 0 HG21 ILE A1572 -16.308 2.768 0.032 1.00 0.00 H new ATOM 0 HG22 ILE A1572 -14.702 3.534 0.018 1.00 0.00 H new ATOM 0 HG23 ILE A1572 -16.162 4.526 -0.207 1.00 0.00 H new ATOM 0 HD11 ILE A1572 -18.864 2.240 -2.534 1.00 0.00 H new ATOM 0 HD12 ILE A1572 -17.425 1.232 -2.253 1.00 0.00 H new ATOM 0 HD13 ILE A1572 -18.033 2.295 -0.962 1.00 0.00 H new ATOM 922 N SER A1573 -13.057 5.715 -1.439 1.00 0.00 N ATOM 923 CA SER A1573 -11.757 5.959 -0.873 1.00 0.00 C ATOM 924 C SER A1573 -11.477 5.112 0.381 1.00 0.00 C ATOM 925 O SER A1573 -12.258 5.115 1.351 1.00 0.00 O ATOM 926 CB SER A1573 -11.581 7.463 -0.612 1.00 0.00 C ATOM 927 OG SER A1573 -12.695 8.007 0.092 1.00 0.00 O ATOM 0 H SER A1573 -13.676 6.525 -1.430 1.00 0.00 H new ATOM 0 HA SER A1573 -11.010 5.641 -1.600 1.00 0.00 H new ATOM 0 HB2 SER A1573 -10.670 7.629 -0.037 1.00 0.00 H new ATOM 0 HB3 SER A1573 -11.459 7.986 -1.561 1.00 0.00 H new ATOM 0 HG SER A1573 -12.550 8.964 0.243 1.00 0.00 H new ATOM 933 N VAL A1574 -10.388 4.367 0.336 1.00 0.00 N ATOM 934 CA VAL A1574 -9.948 3.570 1.462 1.00 0.00 C ATOM 935 C VAL A1574 -8.559 4.081 1.903 1.00 0.00 C ATOM 936 O VAL A1574 -7.660 3.339 2.326 1.00 0.00 O ATOM 937 CB VAL A1574 -9.987 2.019 1.146 1.00 0.00 C ATOM 938 CG1 VAL A1574 -9.056 1.615 0.029 1.00 0.00 C ATOM 939 CG2 VAL A1574 -9.739 1.174 2.379 1.00 0.00 C ATOM 0 H VAL A1574 -9.785 4.299 -0.483 1.00 0.00 H new ATOM 0 HA VAL A1574 -10.638 3.689 2.298 1.00 0.00 H new ATOM 0 HB VAL A1574 -11.003 1.825 0.801 1.00 0.00 H new ATOM 0 HG11 VAL A1574 -9.131 0.540 -0.137 1.00 0.00 H new ATOM 0 HG12 VAL A1574 -9.332 2.143 -0.884 1.00 0.00 H new ATOM 0 HG13 VAL A1574 -8.031 1.869 0.300 1.00 0.00 H new ATOM 0 HG21 VAL A1574 -9.776 0.118 2.110 1.00 0.00 H new ATOM 0 HG22 VAL A1574 -8.757 1.410 2.790 1.00 0.00 H new ATOM 0 HG23 VAL A1574 -10.505 1.385 3.125 1.00 0.00 H new ATOM 949 N GLY A1575 -8.394 5.377 1.738 1.00 0.00 N ATOM 950 CA GLY A1575 -7.206 6.039 2.172 1.00 0.00 C ATOM 951 C GLY A1575 -6.683 7.037 1.162 1.00 0.00 C ATOM 952 O GLY A1575 -6.772 6.817 -0.062 1.00 0.00 O ATOM 0 H GLY A1575 -9.083 5.989 1.300 1.00 0.00 H new ATOM 0 HA2 GLY A1575 -7.406 6.553 3.112 1.00 0.00 H new ATOM 0 HA3 GLY A1575 -6.435 5.295 2.373 1.00 0.00 H new ATOM 956 N LYS A1576 -6.171 8.138 1.661 1.00 0.00 N ATOM 957 CA LYS A1576 -5.543 9.165 0.849 1.00 0.00 C ATOM 958 C LYS A1576 -4.130 8.734 0.542 1.00 0.00 C ATOM 959 O LYS A1576 -3.564 7.912 1.254 1.00 0.00 O ATOM 960 CB LYS A1576 -5.476 10.491 1.603 1.00 0.00 C ATOM 961 CG LYS A1576 -6.801 11.171 1.896 1.00 0.00 C ATOM 962 CD LYS A1576 -7.515 11.624 0.630 1.00 0.00 C ATOM 963 CE LYS A1576 -8.694 12.507 0.984 1.00 0.00 C ATOM 964 NZ LYS A1576 -9.413 12.998 -0.203 1.00 0.00 N1+ ATOM 0 H LYS A1576 -6.177 8.353 2.658 1.00 0.00 H new ATOM 0 HA LYS A1576 -6.129 9.298 -0.060 1.00 0.00 H new ATOM 0 HB2 LYS A1576 -4.964 10.320 2.550 1.00 0.00 H new ATOM 0 HB3 LYS A1576 -4.859 11.180 1.027 1.00 0.00 H new ATOM 0 HG2 LYS A1576 -7.444 10.485 2.447 1.00 0.00 H new ATOM 0 HG3 LYS A1576 -6.629 12.033 2.541 1.00 0.00 H new ATOM 0 HD2 LYS A1576 -6.823 12.169 -0.012 1.00 0.00 H new ATOM 0 HD3 LYS A1576 -7.857 10.756 0.066 1.00 0.00 H new ATOM 0 HE2 LYS A1576 -9.384 11.948 1.616 1.00 0.00 H new ATOM 0 HE3 LYS A1576 -8.343 13.357 1.569 1.00 0.00 H new ATOM 0 HZ1 LYS A1576 -10.209 13.596 0.096 1.00 0.00 H new ATOM 0 HZ2 LYS A1576 -8.765 13.555 -0.796 1.00 0.00 H new ATOM 0 HZ3 LYS A1576 -9.774 12.190 -0.749 1.00 0.00 H new ATOM 978 N ALA A1577 -3.579 9.297 -0.509 1.00 0.00 N ATOM 979 CA ALA A1577 -2.234 9.005 -0.966 1.00 0.00 C ATOM 980 C ALA A1577 -1.199 9.369 0.094 1.00 0.00 C ATOM 981 O ALA A1577 -0.829 10.520 0.245 1.00 0.00 O ATOM 982 CB ALA A1577 -1.955 9.763 -2.251 1.00 0.00 C ATOM 0 H ALA A1577 -4.062 9.987 -1.085 1.00 0.00 H new ATOM 0 HA ALA A1577 -2.160 7.934 -1.152 1.00 0.00 H new ATOM 0 HB1 ALA A1577 -0.944 9.542 -2.592 1.00 0.00 H new ATOM 0 HB2 ALA A1577 -2.670 9.459 -3.015 1.00 0.00 H new ATOM 0 HB3 ALA A1577 -2.051 10.834 -2.070 1.00 0.00 H new ATOM 988 N ASN A1578 -0.802 8.389 0.863 1.00 0.00 N ATOM 989 CA ASN A1578 0.224 8.535 1.887 1.00 0.00 C ATOM 990 C ASN A1578 1.350 7.602 1.523 1.00 0.00 C ATOM 991 O ASN A1578 1.096 6.452 1.165 1.00 0.00 O ATOM 992 CB ASN A1578 -0.307 8.164 3.302 1.00 0.00 C ATOM 993 CG ASN A1578 -1.298 9.150 3.946 1.00 0.00 C ATOM 994 OD1 ASN A1578 -2.068 9.856 3.165 1.00 0.00 O flip ATOM 995 ND2 ASN A1578 -1.364 9.254 5.170 1.00 0.00 N flip ATOM 0 H ASN A1578 -1.184 7.445 0.801 1.00 0.00 H new ATOM 0 HA ASN A1578 0.548 9.575 1.925 1.00 0.00 H new ATOM 0 HB2 ASN A1578 -0.789 7.188 3.240 1.00 0.00 H new ATOM 0 HB3 ASN A1578 0.548 8.056 3.969 1.00 0.00 H new ATOM 0 HD21 ASN A1578 -0.753 8.693 5.763 1.00 0.00 H new ATOM 0 HD22 ASN A1578 -2.030 9.901 5.592 1.00 0.00 H new ATOM 1002 N LYS A1579 2.580 8.055 1.609 1.00 0.00 N ATOM 1003 CA LYS A1579 3.708 7.233 1.187 1.00 0.00 C ATOM 1004 C LYS A1579 4.695 7.090 2.324 1.00 0.00 C ATOM 1005 O LYS A1579 5.909 6.939 2.107 1.00 0.00 O ATOM 1006 CB LYS A1579 4.432 7.821 -0.056 1.00 0.00 C ATOM 1007 CG LYS A1579 3.546 8.123 -1.276 1.00 0.00 C ATOM 1008 CD LYS A1579 2.851 9.490 -1.194 1.00 0.00 C ATOM 1009 CE LYS A1579 3.859 10.637 -1.279 1.00 0.00 C ATOM 1010 NZ LYS A1579 4.578 10.642 -2.572 1.00 0.00 N1+ ATOM 0 H LYS A1579 2.831 8.978 1.963 1.00 0.00 H new ATOM 0 HA LYS A1579 3.311 6.257 0.909 1.00 0.00 H new ATOM 0 HB2 LYS A1579 4.931 8.743 0.242 1.00 0.00 H new ATOM 0 HB3 LYS A1579 5.210 7.122 -0.362 1.00 0.00 H new ATOM 0 HG2 LYS A1579 4.156 8.086 -2.178 1.00 0.00 H new ATOM 0 HG3 LYS A1579 2.790 7.343 -1.370 1.00 0.00 H new ATOM 0 HD2 LYS A1579 2.127 9.580 -2.003 1.00 0.00 H new ATOM 0 HD3 LYS A1579 2.295 9.561 -0.259 1.00 0.00 H new ATOM 0 HE2 LYS A1579 3.341 11.587 -1.148 1.00 0.00 H new ATOM 0 HE3 LYS A1579 4.578 10.551 -0.464 1.00 0.00 H new ATOM 0 HZ1 LYS A1579 5.042 11.563 -2.708 1.00 0.00 H new ATOM 0 HZ2 LYS A1579 5.296 9.889 -2.573 1.00 0.00 H new ATOM 0 HZ3 LYS A1579 3.903 10.477 -3.345 1.00 0.00 H new ATOM 1024 N ARG A1580 4.185 7.132 3.531 1.00 0.00 N ATOM 1025 CA ARG A1580 5.034 7.061 4.693 1.00 0.00 C ATOM 1026 C ARG A1580 5.389 5.629 5.047 1.00 0.00 C ATOM 1027 O ARG A1580 4.665 4.948 5.787 1.00 0.00 O ATOM 1028 CB ARG A1580 4.455 7.829 5.892 1.00 0.00 C ATOM 1029 CG ARG A1580 4.261 9.315 5.617 1.00 0.00 C ATOM 1030 CD ARG A1580 3.992 10.110 6.885 1.00 0.00 C ATOM 1031 NE ARG A1580 3.736 11.534 6.589 1.00 0.00 N ATOM 1032 CZ ARG A1580 4.428 12.591 7.075 1.00 0.00 C ATOM 1033 NH1 ARG A1580 5.518 12.411 7.827 1.00 0.00 N1+ ATOM 1034 NH2 ARG A1580 4.032 13.829 6.773 1.00 0.00 N ATOM 0 H ARG A1580 3.189 7.215 3.733 1.00 0.00 H new ATOM 0 HA ARG A1580 5.965 7.563 4.430 1.00 0.00 H new ATOM 0 HB2 ARG A1580 3.497 7.389 6.168 1.00 0.00 H new ATOM 0 HB3 ARG A1580 5.120 7.708 6.748 1.00 0.00 H new ATOM 0 HG2 ARG A1580 5.150 9.710 5.126 1.00 0.00 H new ATOM 0 HG3 ARG A1580 3.429 9.448 4.925 1.00 0.00 H new ATOM 0 HD2 ARG A1580 3.134 9.686 7.406 1.00 0.00 H new ATOM 0 HD3 ARG A1580 4.846 10.025 7.557 1.00 0.00 H new ATOM 0 HE ARG A1580 2.963 11.741 5.957 1.00 0.00 H new ATOM 0 HH11 ARG A1580 5.839 11.467 8.042 1.00 0.00 H new ATOM 0 HH12 ARG A1580 6.029 13.218 8.186 1.00 0.00 H new ATOM 0 HH21 ARG A1580 3.214 13.973 6.181 1.00 0.00 H new ATOM 0 HH22 ARG A1580 4.547 14.632 7.135 1.00 0.00 H new ATOM 1048 N LEU A1581 6.505 5.178 4.500 1.00 0.00 N ATOM 1049 CA LEU A1581 7.016 3.851 4.754 1.00 0.00 C ATOM 1050 C LEU A1581 7.656 3.745 6.104 1.00 0.00 C ATOM 1051 O LEU A1581 8.527 4.547 6.470 1.00 0.00 O ATOM 1052 CB LEU A1581 8.041 3.410 3.707 1.00 0.00 C ATOM 1053 CG LEU A1581 7.536 2.710 2.456 1.00 0.00 C ATOM 1054 CD1 LEU A1581 8.711 2.358 1.557 1.00 0.00 C ATOM 1055 CD2 LEU A1581 6.803 1.445 2.844 1.00 0.00 C ATOM 0 H LEU A1581 7.082 5.729 3.864 1.00 0.00 H new ATOM 0 HA LEU A1581 6.146 3.196 4.706 1.00 0.00 H new ATOM 0 HB2 LEU A1581 8.597 4.294 3.393 1.00 0.00 H new ATOM 0 HB3 LEU A1581 8.752 2.744 4.197 1.00 0.00 H new ATOM 0 HG LEU A1581 6.857 3.374 1.921 1.00 0.00 H new ATOM 0 HD11 LEU A1581 8.346 1.856 0.661 1.00 0.00 H new ATOM 0 HD12 LEU A1581 9.238 3.269 1.274 1.00 0.00 H new ATOM 0 HD13 LEU A1581 9.392 1.696 2.091 1.00 0.00 H new ATOM 0 HD21 LEU A1581 6.441 0.944 1.946 1.00 0.00 H new ATOM 0 HD22 LEU A1581 7.481 0.782 3.381 1.00 0.00 H new ATOM 0 HD23 LEU A1581 5.958 1.696 3.485 1.00 0.00 H new ATOM 1067 N ARG A1582 7.226 2.782 6.838 1.00 0.00 N ATOM 1068 CA ARG A1582 7.823 2.469 8.099 1.00 0.00 C ATOM 1069 C ARG A1582 8.340 1.066 8.033 1.00 0.00 C ATOM 1070 O ARG A1582 7.585 0.138 7.726 1.00 0.00 O ATOM 1071 CB ARG A1582 6.827 2.612 9.241 1.00 0.00 C ATOM 1072 CG ARG A1582 6.399 4.040 9.513 1.00 0.00 C ATOM 1073 CD ARG A1582 5.438 4.102 10.675 1.00 0.00 C ATOM 1074 NE ARG A1582 6.017 3.571 11.909 1.00 0.00 N ATOM 1075 CZ ARG A1582 5.316 3.191 12.981 1.00 0.00 C ATOM 1076 NH1 ARG A1582 3.986 3.327 13.001 1.00 0.00 N1+ ATOM 1077 NH2 ARG A1582 5.946 2.701 14.037 1.00 0.00 N ATOM 0 H ARG A1582 6.443 2.180 6.583 1.00 0.00 H new ATOM 0 HA ARG A1582 8.636 3.168 8.296 1.00 0.00 H new ATOM 0 HB2 ARG A1582 5.943 2.016 9.015 1.00 0.00 H new ATOM 0 HB3 ARG A1582 7.268 2.197 10.147 1.00 0.00 H new ATOM 0 HG2 ARG A1582 7.275 4.652 9.727 1.00 0.00 H new ATOM 0 HG3 ARG A1582 5.928 4.458 8.624 1.00 0.00 H new ATOM 0 HD2 ARG A1582 5.134 5.136 10.836 1.00 0.00 H new ATOM 0 HD3 ARG A1582 4.538 3.539 10.428 1.00 0.00 H new ATOM 0 HE ARG A1582 7.032 3.484 11.954 1.00 0.00 H new ATOM 0 HH11 ARG A1582 3.502 3.723 12.195 1.00 0.00 H new ATOM 0 HH12 ARG A1582 3.456 3.035 13.822 1.00 0.00 H new ATOM 0 HH21 ARG A1582 6.962 2.615 14.030 1.00 0.00 H new ATOM 0 HH22 ARG A1582 5.415 2.410 14.858 1.00 0.00 H new ATOM 1091 N TYR A1583 9.611 0.908 8.253 1.00 0.00 N ATOM 1092 CA TYR A1583 10.217 -0.391 8.234 1.00 0.00 C ATOM 1093 C TYR A1583 10.268 -0.886 9.658 1.00 0.00 C ATOM 1094 O TYR A1583 11.157 -0.510 10.439 1.00 0.00 O ATOM 1095 CB TYR A1583 11.625 -0.293 7.620 1.00 0.00 C ATOM 1096 CG TYR A1583 12.360 -1.609 7.458 1.00 0.00 C ATOM 1097 CD1 TYR A1583 11.827 -2.645 6.696 1.00 0.00 C ATOM 1098 CD2 TYR A1583 13.602 -1.800 8.038 1.00 0.00 C ATOM 1099 CE1 TYR A1583 12.512 -3.832 6.525 1.00 0.00 C ATOM 1100 CE2 TYR A1583 14.289 -2.982 7.874 1.00 0.00 C ATOM 1101 CZ TYR A1583 13.743 -3.995 7.120 1.00 0.00 C ATOM 1102 OH TYR A1583 14.440 -5.171 6.949 1.00 0.00 O ATOM 0 H TYR A1583 10.256 1.673 8.450 1.00 0.00 H new ATOM 0 HA TYR A1583 9.644 -1.090 7.625 1.00 0.00 H new ATOM 0 HB2 TYR A1583 11.543 0.180 6.642 1.00 0.00 H new ATOM 0 HB3 TYR A1583 12.229 0.366 8.244 1.00 0.00 H new ATOM 0 HD1 TYR A1583 10.861 -2.518 6.230 1.00 0.00 H new ATOM 0 HD2 TYR A1583 14.040 -1.009 8.629 1.00 0.00 H new ATOM 0 HE1 TYR A1583 12.086 -4.626 5.930 1.00 0.00 H new ATOM 0 HE2 TYR A1583 15.256 -3.114 8.337 1.00 0.00 H new ATOM 0 HH TYR A1583 15.290 -5.121 7.434 1.00 0.00 H new ATOM 1112 N VAL A1584 9.324 -1.717 9.996 1.00 0.00 N ATOM 1113 CA VAL A1584 9.180 -2.209 11.341 1.00 0.00 C ATOM 1114 C VAL A1584 9.129 -3.719 11.349 1.00 0.00 C ATOM 1115 O VAL A1584 8.322 -4.314 10.658 1.00 0.00 O ATOM 1116 CB VAL A1584 7.933 -1.599 12.075 1.00 0.00 C ATOM 1117 CG1 VAL A1584 8.160 -0.123 12.380 1.00 0.00 C ATOM 1118 CG2 VAL A1584 6.656 -1.756 11.241 1.00 0.00 C ATOM 0 H VAL A1584 8.627 -2.076 9.344 1.00 0.00 H new ATOM 0 HA VAL A1584 10.059 -1.884 11.898 1.00 0.00 H new ATOM 0 HB VAL A1584 7.806 -2.148 13.008 1.00 0.00 H new ATOM 0 HG11 VAL A1584 7.285 0.282 12.889 1.00 0.00 H new ATOM 0 HG12 VAL A1584 9.035 -0.014 13.021 1.00 0.00 H new ATOM 0 HG13 VAL A1584 8.322 0.420 11.449 1.00 0.00 H new ATOM 0 HG21 VAL A1584 5.814 -1.323 11.780 1.00 0.00 H new ATOM 0 HG22 VAL A1584 6.779 -1.243 10.287 1.00 0.00 H new ATOM 0 HG23 VAL A1584 6.466 -2.814 11.062 1.00 0.00 H new ATOM 1128 N ASP A1585 10.023 -4.313 12.101 1.00 0.00 N ATOM 1129 CA ASP A1585 10.161 -5.771 12.232 1.00 0.00 C ATOM 1130 C ASP A1585 10.289 -6.476 10.867 1.00 0.00 C ATOM 1131 O ASP A1585 9.510 -7.373 10.508 1.00 0.00 O ATOM 1132 CB ASP A1585 9.067 -6.387 13.132 1.00 0.00 C ATOM 1133 CG ASP A1585 9.264 -7.875 13.369 1.00 0.00 C ATOM 1134 OD1 ASP A1585 10.323 -8.270 13.925 1.00 0.00 O ATOM 1135 OD2 ASP A1585 8.364 -8.677 13.015 1.00 0.00 O1- ATOM 0 H ASP A1585 10.701 -3.795 12.660 1.00 0.00 H new ATOM 0 HA ASP A1585 11.105 -5.949 12.747 1.00 0.00 H new ATOM 0 HB2 ASP A1585 9.059 -5.869 14.091 1.00 0.00 H new ATOM 0 HB3 ASP A1585 8.092 -6.223 12.673 1.00 0.00 H new ATOM 1140 N GLN A1586 11.246 -5.983 10.090 1.00 0.00 N ATOM 1141 CA GLN A1586 11.658 -6.561 8.803 1.00 0.00 C ATOM 1142 C GLN A1586 10.513 -6.531 7.743 1.00 0.00 C ATOM 1143 O GLN A1586 10.486 -7.332 6.795 1.00 0.00 O ATOM 1144 CB GLN A1586 12.204 -7.993 9.038 1.00 0.00 C ATOM 1145 CG GLN A1586 13.074 -8.555 7.926 1.00 0.00 C ATOM 1146 CD GLN A1586 13.605 -9.937 8.258 1.00 0.00 C ATOM 1147 OE1 GLN A1586 13.801 -10.282 9.424 1.00 0.00 O ATOM 1148 NE2 GLN A1586 13.865 -10.725 7.258 1.00 0.00 N ATOM 0 H GLN A1586 11.775 -5.147 10.339 1.00 0.00 H new ATOM 0 HA GLN A1586 12.454 -5.946 8.384 1.00 0.00 H new ATOM 0 HB2 GLN A1586 12.781 -7.995 9.963 1.00 0.00 H new ATOM 0 HB3 GLN A1586 11.359 -8.665 9.188 1.00 0.00 H new ATOM 0 HG2 GLN A1586 12.496 -8.602 7.003 1.00 0.00 H new ATOM 0 HG3 GLN A1586 13.910 -7.880 7.745 1.00 0.00 H new ATOM 0 HE21 GLN A1586 13.692 -10.411 6.303 1.00 0.00 H new ATOM 0 HE22 GLN A1586 14.242 -11.657 7.428 1.00 0.00 H new ATOM 1157 N VAL A1587 9.574 -5.624 7.915 1.00 0.00 N ATOM 1158 CA VAL A1587 8.492 -5.449 6.963 1.00 0.00 C ATOM 1159 C VAL A1587 8.179 -3.961 6.769 1.00 0.00 C ATOM 1160 O VAL A1587 8.165 -3.179 7.735 1.00 0.00 O ATOM 1161 CB VAL A1587 7.202 -6.293 7.348 1.00 0.00 C ATOM 1162 CG1 VAL A1587 6.798 -6.102 8.784 1.00 0.00 C ATOM 1163 CG2 VAL A1587 6.021 -5.965 6.459 1.00 0.00 C ATOM 0 H VAL A1587 9.537 -4.990 8.713 1.00 0.00 H new ATOM 0 HA VAL A1587 8.828 -5.845 6.005 1.00 0.00 H new ATOM 0 HB VAL A1587 7.484 -7.335 7.199 1.00 0.00 H new ATOM 0 HG11 VAL A1587 5.912 -6.700 8.995 1.00 0.00 H new ATOM 0 HG12 VAL A1587 7.613 -6.417 9.436 1.00 0.00 H new ATOM 0 HG13 VAL A1587 6.577 -5.050 8.963 1.00 0.00 H new ATOM 0 HG21 VAL A1587 5.162 -6.565 6.759 1.00 0.00 H new ATOM 0 HG22 VAL A1587 5.776 -4.907 6.555 1.00 0.00 H new ATOM 0 HG23 VAL A1587 6.274 -6.186 5.422 1.00 0.00 H new ATOM 1173 N LEU A1588 8.002 -3.571 5.521 1.00 0.00 N ATOM 1174 CA LEU A1588 7.662 -2.212 5.167 1.00 0.00 C ATOM 1175 C LEU A1588 6.160 -2.043 5.219 1.00 0.00 C ATOM 1176 O LEU A1588 5.417 -2.802 4.591 1.00 0.00 O ATOM 1177 CB LEU A1588 8.180 -1.851 3.765 1.00 0.00 C ATOM 1178 CG LEU A1588 9.682 -1.615 3.592 1.00 0.00 C ATOM 1179 CD1 LEU A1588 10.002 -1.400 2.122 1.00 0.00 C ATOM 1180 CD2 LEU A1588 10.119 -0.397 4.385 1.00 0.00 C ATOM 0 H LEU A1588 8.092 -4.196 4.720 1.00 0.00 H new ATOM 0 HA LEU A1588 8.138 -1.541 5.882 1.00 0.00 H new ATOM 0 HB2 LEU A1588 7.887 -2.651 3.085 1.00 0.00 H new ATOM 0 HB3 LEU A1588 7.661 -0.950 3.439 1.00 0.00 H new ATOM 0 HG LEU A1588 10.217 -2.490 3.960 1.00 0.00 H new ATOM 0 HD11 LEU A1588 11.072 -1.232 2.003 1.00 0.00 H new ATOM 0 HD12 LEU A1588 9.708 -2.282 1.553 1.00 0.00 H new ATOM 0 HD13 LEU A1588 9.456 -0.532 1.754 1.00 0.00 H new ATOM 0 HD21 LEU A1588 11.190 -0.241 4.252 1.00 0.00 H new ATOM 0 HD22 LEU A1588 9.578 0.481 4.031 1.00 0.00 H new ATOM 0 HD23 LEU A1588 9.903 -0.554 5.442 1.00 0.00 H new ATOM 1192 N GLN A1589 5.723 -1.093 5.987 1.00 0.00 N ATOM 1193 CA GLN A1589 4.319 -0.817 6.144 1.00 0.00 C ATOM 1194 C GLN A1589 3.936 0.489 5.449 1.00 0.00 C ATOM 1195 O GLN A1589 4.538 1.540 5.721 1.00 0.00 O ATOM 1196 CB GLN A1589 3.990 -0.694 7.638 1.00 0.00 C ATOM 1197 CG GLN A1589 2.533 -0.350 7.936 1.00 0.00 C ATOM 1198 CD GLN A1589 2.298 0.019 9.387 1.00 0.00 C ATOM 1199 OE1 GLN A1589 2.020 -0.840 10.233 1.00 0.00 O ATOM 1200 NE2 GLN A1589 2.379 1.293 9.692 1.00 0.00 N ATOM 0 H GLN A1589 6.332 -0.480 6.529 1.00 0.00 H new ATOM 0 HA GLN A1589 3.757 -1.635 5.693 1.00 0.00 H new ATOM 0 HB2 GLN A1589 4.237 -1.634 8.131 1.00 0.00 H new ATOM 0 HB3 GLN A1589 4.629 0.073 8.076 1.00 0.00 H new ATOM 0 HG2 GLN A1589 2.224 0.480 7.301 1.00 0.00 H new ATOM 0 HG3 GLN A1589 1.904 -1.201 7.677 1.00 0.00 H new ATOM 0 HE21 GLN A1589 2.610 1.976 8.971 1.00 0.00 H new ATOM 0 HE22 GLN A1589 2.211 1.600 10.650 1.00 0.00 H new ATOM 1209 N LEU A1590 2.953 0.416 4.580 1.00 0.00 N ATOM 1210 CA LEU A1590 2.338 1.592 3.972 1.00 0.00 C ATOM 1211 C LEU A1590 0.921 1.669 4.445 1.00 0.00 C ATOM 1212 O LEU A1590 0.215 0.671 4.429 1.00 0.00 O ATOM 1213 CB LEU A1590 2.335 1.561 2.426 1.00 0.00 C ATOM 1214 CG LEU A1590 3.595 2.042 1.706 1.00 0.00 C ATOM 1215 CD1 LEU A1590 3.415 1.948 0.200 1.00 0.00 C ATOM 1216 CD2 LEU A1590 3.914 3.478 2.095 1.00 0.00 C ATOM 0 H LEU A1590 2.548 -0.467 4.267 1.00 0.00 H new ATOM 0 HA LEU A1590 2.929 2.458 4.271 1.00 0.00 H new ATOM 0 HB2 LEU A1590 2.139 0.536 2.111 1.00 0.00 H new ATOM 0 HB3 LEU A1590 1.498 2.167 2.079 1.00 0.00 H new ATOM 0 HG LEU A1590 4.424 1.400 2.005 1.00 0.00 H new ATOM 0 HD11 LEU A1590 4.321 2.294 -0.297 1.00 0.00 H new ATOM 0 HD12 LEU A1590 3.221 0.912 -0.079 1.00 0.00 H new ATOM 0 HD13 LEU A1590 2.573 2.570 -0.105 1.00 0.00 H new ATOM 0 HD21 LEU A1590 4.814 3.805 1.574 1.00 0.00 H new ATOM 0 HD22 LEU A1590 3.080 4.123 1.819 1.00 0.00 H new ATOM 0 HD23 LEU A1590 4.077 3.536 3.171 1.00 0.00 H new ATOM 1228 N VAL A1591 0.509 2.816 4.880 1.00 0.00 N ATOM 1229 CA VAL A1591 -0.834 2.983 5.354 1.00 0.00 C ATOM 1230 C VAL A1591 -1.490 4.196 4.712 1.00 0.00 C ATOM 1231 O VAL A1591 -0.975 5.321 4.779 1.00 0.00 O ATOM 1232 CB VAL A1591 -0.916 3.040 6.921 1.00 0.00 C ATOM 1233 CG1 VAL A1591 -0.051 4.153 7.501 1.00 0.00 C ATOM 1234 CG2 VAL A1591 -2.362 3.185 7.392 1.00 0.00 C ATOM 0 H VAL A1591 1.084 3.658 4.918 1.00 0.00 H new ATOM 0 HA VAL A1591 -1.393 2.098 5.051 1.00 0.00 H new ATOM 0 HB VAL A1591 -0.524 2.093 7.292 1.00 0.00 H new ATOM 0 HG11 VAL A1591 -0.140 4.154 8.587 1.00 0.00 H new ATOM 0 HG12 VAL A1591 0.990 3.988 7.222 1.00 0.00 H new ATOM 0 HG13 VAL A1591 -0.384 5.114 7.109 1.00 0.00 H new ATOM 0 HG21 VAL A1591 -2.388 3.222 8.481 1.00 0.00 H new ATOM 0 HG22 VAL A1591 -2.786 4.104 6.988 1.00 0.00 H new ATOM 0 HG23 VAL A1591 -2.945 2.333 7.044 1.00 0.00 H new ATOM 1244 N TYR A1592 -2.573 3.959 4.050 1.00 0.00 N ATOM 1245 CA TYR A1592 -3.327 5.005 3.446 1.00 0.00 C ATOM 1246 C TYR A1592 -4.398 5.435 4.419 1.00 0.00 C ATOM 1247 O TYR A1592 -5.377 4.710 4.656 1.00 0.00 O ATOM 1248 CB TYR A1592 -3.912 4.565 2.098 1.00 0.00 C ATOM 1249 CG TYR A1592 -2.860 4.285 1.043 1.00 0.00 C ATOM 1250 CD1 TYR A1592 -2.274 5.328 0.350 1.00 0.00 C ATOM 1251 CD2 TYR A1592 -2.453 2.993 0.743 1.00 0.00 C ATOM 1252 CE1 TYR A1592 -1.317 5.109 -0.611 1.00 0.00 C ATOM 1253 CE2 TYR A1592 -1.488 2.763 -0.223 1.00 0.00 C ATOM 1254 CZ TYR A1592 -0.925 3.831 -0.892 1.00 0.00 C ATOM 1255 OH TYR A1592 0.025 3.614 -1.858 1.00 0.00 O ATOM 0 H TYR A1592 -2.962 3.026 3.912 1.00 0.00 H new ATOM 0 HA TYR A1592 -2.680 5.854 3.227 1.00 0.00 H new ATOM 0 HB2 TYR A1592 -4.513 3.668 2.247 1.00 0.00 H new ATOM 0 HB3 TYR A1592 -4.584 5.341 1.732 1.00 0.00 H new ATOM 0 HD1 TYR A1592 -2.576 6.341 0.570 1.00 0.00 H new ATOM 0 HD2 TYR A1592 -2.893 2.158 1.268 1.00 0.00 H new ATOM 0 HE1 TYR A1592 -0.878 5.941 -1.141 1.00 0.00 H new ATOM 0 HE2 TYR A1592 -1.178 1.754 -0.452 1.00 0.00 H new ATOM 0 HH TYR A1592 -0.355 3.061 -2.572 1.00 0.00 H new ATOM 1265 N LYS A1593 -4.168 6.582 5.030 1.00 0.00 N ATOM 1266 CA LYS A1593 -5.045 7.131 6.044 1.00 0.00 C ATOM 1267 C LYS A1593 -6.058 8.075 5.433 1.00 0.00 C ATOM 1268 O LYS A1593 -5.821 8.636 4.356 1.00 0.00 O ATOM 1269 CB LYS A1593 -4.230 7.876 7.105 1.00 0.00 C ATOM 1270 CG LYS A1593 -3.304 6.996 7.928 1.00 0.00 C ATOM 1271 CD LYS A1593 -2.450 7.835 8.864 1.00 0.00 C ATOM 1272 CE LYS A1593 -1.608 6.971 9.793 1.00 0.00 C ATOM 1273 NZ LYS A1593 -2.431 6.255 10.799 1.00 0.00 N1+ ATOM 0 H LYS A1593 -3.355 7.166 4.832 1.00 0.00 H new ATOM 0 HA LYS A1593 -5.576 6.301 6.510 1.00 0.00 H new ATOM 0 HB2 LYS A1593 -3.635 8.645 6.613 1.00 0.00 H new ATOM 0 HB3 LYS A1593 -4.917 8.387 7.779 1.00 0.00 H new ATOM 0 HG2 LYS A1593 -3.892 6.283 8.506 1.00 0.00 H new ATOM 0 HG3 LYS A1593 -2.662 6.416 7.265 1.00 0.00 H new ATOM 0 HD2 LYS A1593 -1.797 8.481 8.278 1.00 0.00 H new ATOM 0 HD3 LYS A1593 -3.093 8.485 9.457 1.00 0.00 H new ATOM 0 HE2 LYS A1593 -1.048 6.246 9.202 1.00 0.00 H new ATOM 0 HE3 LYS A1593 -0.877 7.597 10.305 1.00 0.00 H new ATOM 0 HZ1 LYS A1593 -1.809 5.818 11.509 1.00 0.00 H new ATOM 0 HZ2 LYS A1593 -3.071 6.928 11.267 1.00 0.00 H new ATOM 0 HZ3 LYS A1593 -2.990 5.516 10.327 1.00 0.00 H new ATOM 1287 N ASP A1594 -7.152 8.267 6.153 1.00 0.00 N ATOM 1288 CA ASP A1594 -8.281 9.123 5.767 1.00 0.00 C ATOM 1289 C ASP A1594 -9.037 8.546 4.592 1.00 0.00 C ATOM 1290 O ASP A1594 -8.735 8.815 3.421 1.00 0.00 O ATOM 1291 CB ASP A1594 -7.890 10.589 5.508 1.00 0.00 C ATOM 1292 CG ASP A1594 -9.099 11.451 5.192 1.00 0.00 C ATOM 1293 OD1 ASP A1594 -9.889 11.730 6.107 1.00 0.00 O1- ATOM 1294 OD2 ASP A1594 -9.294 11.851 4.033 1.00 0.00 O ATOM 0 H ASP A1594 -7.291 7.817 7.058 1.00 0.00 H new ATOM 0 HA ASP A1594 -8.944 9.138 6.632 1.00 0.00 H new ATOM 0 HB2 ASP A1594 -7.379 10.988 6.384 1.00 0.00 H new ATOM 0 HB3 ASP A1594 -7.185 10.635 4.678 1.00 0.00 H new ATOM 1299 N GLY A1595 -9.994 7.727 4.904 1.00 0.00 N ATOM 1300 CA GLY A1595 -10.806 7.128 3.901 1.00 0.00 C ATOM 1301 C GLY A1595 -12.240 7.492 4.101 1.00 0.00 C ATOM 1302 O GLY A1595 -12.543 8.451 4.825 1.00 0.00 O ATOM 0 H GLY A1595 -10.230 7.458 5.859 1.00 0.00 H new ATOM 0 HA2 GLY A1595 -10.476 7.455 2.915 1.00 0.00 H new ATOM 0 HA3 GLY A1595 -10.692 6.044 3.932 1.00 0.00 H new ATOM 1306 N SER A1596 -13.109 6.751 3.495 1.00 0.00 N ATOM 1307 CA SER A1596 -14.515 6.988 3.603 1.00 0.00 C ATOM 1308 C SER A1596 -15.033 6.500 4.969 1.00 0.00 C ATOM 1309 O SER A1596 -14.567 5.472 5.495 1.00 0.00 O ATOM 1310 CB SER A1596 -15.224 6.294 2.439 1.00 0.00 C ATOM 1311 OG SER A1596 -14.862 4.919 2.357 1.00 0.00 O ATOM 0 H SER A1596 -12.863 5.956 2.905 1.00 0.00 H new ATOM 0 HA SER A1596 -14.724 8.056 3.546 1.00 0.00 H new ATOM 0 HB2 SER A1596 -16.303 6.381 2.564 1.00 0.00 H new ATOM 0 HB3 SER A1596 -14.970 6.795 1.505 1.00 0.00 H new ATOM 0 HG SER A1596 -14.011 4.833 1.878 1.00 0.00 H new ATOM 1317 N PRO A1597 -15.952 7.267 5.581 1.00 0.00 N ATOM 1318 CA PRO A1597 -16.531 6.941 6.885 1.00 0.00 C ATOM 1319 C PRO A1597 -17.315 5.630 6.849 1.00 0.00 C ATOM 1320 O PRO A1597 -18.058 5.358 5.900 1.00 0.00 O ATOM 1321 CB PRO A1597 -17.469 8.120 7.170 1.00 0.00 C ATOM 1322 CG PRO A1597 -17.739 8.725 5.844 1.00 0.00 C ATOM 1323 CD PRO A1597 -16.501 8.521 5.039 1.00 0.00 C ATOM 0 HA PRO A1597 -15.766 6.801 7.649 1.00 0.00 H new ATOM 0 HB2 PRO A1597 -18.391 7.785 7.646 1.00 0.00 H new ATOM 0 HB3 PRO A1597 -17.005 8.839 7.845 1.00 0.00 H new ATOM 0 HG2 PRO A1597 -18.597 8.252 5.367 1.00 0.00 H new ATOM 0 HG3 PRO A1597 -17.972 9.786 5.939 1.00 0.00 H new ATOM 0 HD2 PRO A1597 -16.722 8.438 3.975 1.00 0.00 H new ATOM 0 HD3 PRO A1597 -15.803 9.350 5.156 1.00 0.00 H new ATOM 1331 N CYS A1598 -17.149 4.843 7.871 1.00 0.00 N ATOM 1332 CA CYS A1598 -17.767 3.549 7.962 1.00 0.00 C ATOM 1333 C CYS A1598 -19.192 3.636 8.471 1.00 0.00 C ATOM 1334 O CYS A1598 -19.434 4.173 9.553 1.00 0.00 O ATOM 1335 CB CYS A1598 -16.961 2.664 8.907 1.00 0.00 C ATOM 1336 SG CYS A1598 -15.247 2.431 8.404 1.00 0.00 S ATOM 0 H CYS A1598 -16.573 5.084 8.677 1.00 0.00 H new ATOM 0 HA CYS A1598 -17.788 3.124 6.958 1.00 0.00 H new ATOM 0 HB2 CYS A1598 -16.980 3.102 9.905 1.00 0.00 H new ATOM 0 HB3 CYS A1598 -17.444 1.690 8.978 1.00 0.00 H new ATOM 1406 N LEU A1604 -15.484 5.546 12.555 1.00 0.00 N ATOM 1407 CA LEU A1604 -14.271 5.070 11.925 1.00 0.00 C ATOM 1408 C LEU A1604 -14.339 5.288 10.427 1.00 0.00 C ATOM 1409 O LEU A1604 -15.410 5.602 9.888 1.00 0.00 O ATOM 1410 CB LEU A1604 -14.033 3.598 12.252 1.00 0.00 C ATOM 1411 CG LEU A1604 -13.810 3.269 13.731 1.00 0.00 C ATOM 1412 CD1 LEU A1604 -13.664 1.783 13.917 1.00 0.00 C ATOM 1413 CD2 LEU A1604 -12.577 3.985 14.269 1.00 0.00 C ATOM 0 HA LEU A1604 -13.429 5.639 12.318 1.00 0.00 H new ATOM 0 HB2 LEU A1604 -14.889 3.024 11.897 1.00 0.00 H new ATOM 0 HB3 LEU A1604 -13.165 3.256 11.689 1.00 0.00 H new ATOM 0 HG LEU A1604 -14.679 3.615 14.290 1.00 0.00 H new ATOM 0 HD11 LEU A1604 -13.506 1.562 14.973 1.00 0.00 H new ATOM 0 HD12 LEU A1604 -14.569 1.283 13.573 1.00 0.00 H new ATOM 0 HD13 LEU A1604 -12.811 1.426 13.340 1.00 0.00 H new ATOM 0 HD21 LEU A1604 -12.441 3.735 15.321 1.00 0.00 H new ATOM 0 HD22 LEU A1604 -11.699 3.671 13.705 1.00 0.00 H new ATOM 0 HD23 LEU A1604 -12.708 5.062 14.166 1.00 0.00 H new ATOM 1425 N SER A1605 -13.219 5.152 9.767 1.00 0.00 N ATOM 1426 CA SER A1605 -13.131 5.345 8.341 1.00 0.00 C ATOM 1427 C SER A1605 -12.270 4.229 7.743 1.00 0.00 C ATOM 1428 O SER A1605 -11.313 3.763 8.388 1.00 0.00 O ATOM 1429 CB SER A1605 -12.505 6.715 8.062 1.00 0.00 C ATOM 1430 OG SER A1605 -13.210 7.748 8.757 1.00 0.00 O ATOM 0 H SER A1605 -12.333 4.902 10.207 1.00 0.00 H new ATOM 0 HA SER A1605 -14.122 5.311 7.888 1.00 0.00 H new ATOM 0 HB2 SER A1605 -11.460 6.711 8.370 1.00 0.00 H new ATOM 0 HB3 SER A1605 -12.521 6.915 6.991 1.00 0.00 H new ATOM 0 HG SER A1605 -12.793 8.614 8.566 1.00 0.00 H new ATOM 1436 N TYR A1606 -12.634 3.785 6.548 1.00 0.00 N ATOM 1437 CA TYR A1606 -11.930 2.705 5.858 1.00 0.00 C ATOM 1438 C TYR A1606 -10.533 3.141 5.450 1.00 0.00 C ATOM 1439 O TYR A1606 -10.369 4.144 4.759 1.00 0.00 O ATOM 1440 CB TYR A1606 -12.718 2.224 4.625 1.00 0.00 C ATOM 1441 CG TYR A1606 -14.091 1.653 4.923 1.00 0.00 C ATOM 1442 CD1 TYR A1606 -14.234 0.368 5.437 1.00 0.00 C ATOM 1443 CD2 TYR A1606 -15.241 2.393 4.681 1.00 0.00 C ATOM 1444 CE1 TYR A1606 -15.486 -0.160 5.702 1.00 0.00 C ATOM 1445 CE2 TYR A1606 -16.493 1.874 4.940 1.00 0.00 C ATOM 1446 CZ TYR A1606 -16.610 0.598 5.451 1.00 0.00 C ATOM 1447 OH TYR A1606 -17.865 0.077 5.707 1.00 0.00 O ATOM 0 H TYR A1606 -13.426 4.161 6.027 1.00 0.00 H new ATOM 0 HA TYR A1606 -11.844 1.872 6.556 1.00 0.00 H new ATOM 0 HB2 TYR A1606 -12.831 3.061 3.936 1.00 0.00 H new ATOM 0 HB3 TYR A1606 -12.129 1.465 4.110 1.00 0.00 H new ATOM 0 HD1 TYR A1606 -13.354 -0.227 5.632 1.00 0.00 H new ATOM 0 HD2 TYR A1606 -15.154 3.393 4.283 1.00 0.00 H new ATOM 0 HE1 TYR A1606 -15.582 -1.158 6.102 1.00 0.00 H new ATOM 0 HE2 TYR A1606 -17.376 2.463 4.744 1.00 0.00 H new ATOM 0 HH TYR A1606 -18.548 0.741 5.476 1.00 0.00 H new ATOM 1457 N LYS A1607 -9.544 2.395 5.891 1.00 0.00 N ATOM 1458 CA LYS A1607 -8.155 2.691 5.608 1.00 0.00 C ATOM 1459 C LYS A1607 -7.459 1.413 5.154 1.00 0.00 C ATOM 1460 O LYS A1607 -7.968 0.298 5.394 1.00 0.00 O ATOM 1461 CB LYS A1607 -7.484 3.253 6.866 1.00 0.00 C ATOM 1462 CG LYS A1607 -7.364 2.248 8.009 1.00 0.00 C ATOM 1463 CD LYS A1607 -6.959 2.912 9.311 1.00 0.00 C ATOM 1464 CE LYS A1607 -8.087 3.774 9.864 1.00 0.00 C ATOM 1465 NZ LYS A1607 -9.285 2.966 10.197 1.00 0.00 N1+ ATOM 0 H LYS A1607 -9.681 1.560 6.460 1.00 0.00 H new ATOM 0 HA LYS A1607 -8.084 3.436 4.816 1.00 0.00 H new ATOM 0 HB2 LYS A1607 -6.488 3.611 6.605 1.00 0.00 H new ATOM 0 HB3 LYS A1607 -8.052 4.116 7.213 1.00 0.00 H new ATOM 0 HG2 LYS A1607 -8.317 1.737 8.144 1.00 0.00 H new ATOM 0 HG3 LYS A1607 -6.629 1.487 7.747 1.00 0.00 H new ATOM 0 HD2 LYS A1607 -6.688 2.150 10.042 1.00 0.00 H new ATOM 0 HD3 LYS A1607 -6.074 3.527 9.149 1.00 0.00 H new ATOM 0 HE2 LYS A1607 -7.741 4.296 10.756 1.00 0.00 H new ATOM 0 HE3 LYS A1607 -8.355 4.536 9.132 1.00 0.00 H new ATOM 0 HZ1 LYS A1607 -10.047 3.180 9.522 1.00 0.00 H new ATOM 0 HZ2 LYS A1607 -9.048 1.955 10.142 1.00 0.00 H new ATOM 0 HZ3 LYS A1607 -9.602 3.196 11.161 1.00 0.00 H new ATOM 1479 N SER A1608 -6.332 1.548 4.524 1.00 0.00 N ATOM 1480 CA SER A1608 -5.637 0.399 4.001 1.00 0.00 C ATOM 1481 C SER A1608 -4.177 0.352 4.449 1.00 0.00 C ATOM 1482 O SER A1608 -3.489 1.378 4.483 1.00 0.00 O ATOM 1483 CB SER A1608 -5.778 0.369 2.475 1.00 0.00 C ATOM 1484 OG SER A1608 -5.513 1.646 1.914 1.00 0.00 O ATOM 0 H SER A1608 -5.869 2.441 4.357 1.00 0.00 H new ATOM 0 HA SER A1608 -6.096 -0.501 4.410 1.00 0.00 H new ATOM 0 HB2 SER A1608 -5.090 -0.366 2.057 1.00 0.00 H new ATOM 0 HB3 SER A1608 -6.785 0.051 2.206 1.00 0.00 H new ATOM 0 HG SER A1608 -6.281 2.236 2.065 1.00 0.00 H new ATOM 1490 N VAL A1609 -3.732 -0.830 4.825 1.00 0.00 N ATOM 1491 CA VAL A1609 -2.372 -1.057 5.264 1.00 0.00 C ATOM 1492 C VAL A1609 -1.748 -2.120 4.374 1.00 0.00 C ATOM 1493 O VAL A1609 -2.268 -3.233 4.275 1.00 0.00 O ATOM 1494 CB VAL A1609 -2.319 -1.542 6.753 1.00 0.00 C ATOM 1495 CG1 VAL A1609 -0.885 -1.799 7.211 1.00 0.00 C ATOM 1496 CG2 VAL A1609 -2.980 -0.536 7.679 1.00 0.00 C ATOM 0 H VAL A1609 -4.312 -1.669 4.834 1.00 0.00 H new ATOM 0 HA VAL A1609 -1.825 -0.117 5.196 1.00 0.00 H new ATOM 0 HB VAL A1609 -2.869 -2.482 6.801 1.00 0.00 H new ATOM 0 HG11 VAL A1609 -0.889 -2.134 8.248 1.00 0.00 H new ATOM 0 HG12 VAL A1609 -0.435 -2.568 6.583 1.00 0.00 H new ATOM 0 HG13 VAL A1609 -0.306 -0.879 7.129 1.00 0.00 H new ATOM 0 HG21 VAL A1609 -2.929 -0.898 8.706 1.00 0.00 H new ATOM 0 HG22 VAL A1609 -2.463 0.421 7.605 1.00 0.00 H new ATOM 0 HG23 VAL A1609 -4.023 -0.407 7.391 1.00 0.00 H new ATOM 1506 N ILE A1610 -0.685 -1.772 3.692 1.00 0.00 N ATOM 1507 CA ILE A1610 0.011 -2.711 2.859 1.00 0.00 C ATOM 1508 C ILE A1610 1.296 -3.159 3.576 1.00 0.00 C ATOM 1509 O ILE A1610 2.130 -2.327 3.961 1.00 0.00 O ATOM 1510 CB ILE A1610 0.357 -2.117 1.468 1.00 0.00 C ATOM 1511 CG1 ILE A1610 -0.907 -1.541 0.805 1.00 0.00 C ATOM 1512 CG2 ILE A1610 0.969 -3.206 0.578 1.00 0.00 C ATOM 1513 CD1 ILE A1610 -0.657 -0.869 -0.530 1.00 0.00 C ATOM 0 H ILE A1610 -0.283 -0.835 3.701 1.00 0.00 H new ATOM 0 HA ILE A1610 -0.645 -3.564 2.687 1.00 0.00 H new ATOM 0 HB ILE A1610 1.080 -1.312 1.596 1.00 0.00 H new ATOM 0 HG12 ILE A1610 -1.629 -2.346 0.665 1.00 0.00 H new ATOM 0 HG13 ILE A1610 -1.362 -0.819 1.483 1.00 0.00 H new ATOM 0 HG21 ILE A1610 1.211 -2.785 -0.398 1.00 0.00 H new ATOM 0 HG22 ILE A1610 1.878 -3.588 1.043 1.00 0.00 H new ATOM 0 HG23 ILE A1610 0.254 -4.020 0.455 1.00 0.00 H new ATOM 0 HD11 ILE A1610 -1.598 -0.491 -0.929 1.00 0.00 H new ATOM 0 HD12 ILE A1610 0.039 -0.041 -0.396 1.00 0.00 H new ATOM 0 HD13 ILE A1610 -0.232 -1.591 -1.227 1.00 0.00 H new ATOM 1525 N SER A1611 1.416 -4.450 3.766 1.00 0.00 N ATOM 1526 CA SER A1611 2.518 -5.081 4.457 1.00 0.00 C ATOM 1527 C SER A1611 3.470 -5.737 3.427 1.00 0.00 C ATOM 1528 O SER A1611 3.142 -6.781 2.831 1.00 0.00 O ATOM 1529 CB SER A1611 1.919 -6.145 5.427 1.00 0.00 C ATOM 1530 OG SER A1611 2.896 -6.793 6.227 1.00 0.00 O ATOM 0 H SER A1611 0.722 -5.118 3.431 1.00 0.00 H new ATOM 0 HA SER A1611 3.097 -4.352 5.024 1.00 0.00 H new ATOM 0 HB2 SER A1611 1.189 -5.663 6.078 1.00 0.00 H new ATOM 0 HB3 SER A1611 1.382 -6.894 4.845 1.00 0.00 H new ATOM 0 HG SER A1611 2.459 -7.445 6.813 1.00 0.00 H new ATOM 1536 N PHE A1612 4.615 -5.119 3.199 1.00 0.00 N ATOM 1537 CA PHE A1612 5.612 -5.639 2.266 1.00 0.00 C ATOM 1538 C PHE A1612 6.615 -6.460 3.050 1.00 0.00 C ATOM 1539 O PHE A1612 7.489 -5.909 3.728 1.00 0.00 O ATOM 1540 CB PHE A1612 6.348 -4.508 1.547 1.00 0.00 C ATOM 1541 CG PHE A1612 5.488 -3.583 0.744 1.00 0.00 C ATOM 1542 CD1 PHE A1612 4.939 -2.452 1.319 1.00 0.00 C ATOM 1543 CD2 PHE A1612 5.247 -3.837 -0.589 1.00 0.00 C ATOM 1544 CE1 PHE A1612 4.160 -1.595 0.580 1.00 0.00 C ATOM 1545 CE2 PHE A1612 4.468 -2.983 -1.342 1.00 0.00 C ATOM 1546 CZ PHE A1612 3.922 -1.859 -0.757 1.00 0.00 C ATOM 0 H PHE A1612 4.884 -4.245 3.651 1.00 0.00 H new ATOM 0 HA PHE A1612 5.107 -6.246 1.514 1.00 0.00 H new ATOM 0 HB2 PHE A1612 6.888 -3.920 2.290 1.00 0.00 H new ATOM 0 HB3 PHE A1612 7.094 -4.948 0.885 1.00 0.00 H new ATOM 0 HD1 PHE A1612 5.125 -2.240 2.362 1.00 0.00 H new ATOM 0 HD2 PHE A1612 5.673 -4.716 -1.050 1.00 0.00 H new ATOM 0 HE1 PHE A1612 3.734 -0.717 1.042 1.00 0.00 H new ATOM 0 HE2 PHE A1612 4.286 -3.193 -2.386 1.00 0.00 H new ATOM 0 HZ PHE A1612 3.311 -1.187 -1.341 1.00 0.00 H new ATOM 1556 N VAL A1613 6.491 -7.750 2.963 1.00 0.00 N ATOM 1557 CA VAL A1613 7.288 -8.659 3.760 1.00 0.00 C ATOM 1558 C VAL A1613 8.574 -9.052 3.016 1.00 0.00 C ATOM 1559 O VAL A1613 8.540 -9.326 1.798 1.00 0.00 O ATOM 1560 CB VAL A1613 6.464 -9.936 4.102 1.00 0.00 C ATOM 1561 CG1 VAL A1613 7.222 -10.846 5.049 1.00 0.00 C ATOM 1562 CG2 VAL A1613 5.107 -9.567 4.695 1.00 0.00 C ATOM 0 H VAL A1613 5.833 -8.213 2.336 1.00 0.00 H new ATOM 0 HA VAL A1613 7.563 -8.151 4.684 1.00 0.00 H new ATOM 0 HB VAL A1613 6.300 -10.478 3.170 1.00 0.00 H new ATOM 0 HG11 VAL A1613 6.619 -11.727 5.267 1.00 0.00 H new ATOM 0 HG12 VAL A1613 8.160 -11.153 4.586 1.00 0.00 H new ATOM 0 HG13 VAL A1613 7.433 -10.312 5.976 1.00 0.00 H new ATOM 0 HG21 VAL A1613 4.551 -10.476 4.925 1.00 0.00 H new ATOM 0 HG22 VAL A1613 5.254 -8.990 5.608 1.00 0.00 H new ATOM 0 HG23 VAL A1613 4.546 -8.971 3.976 1.00 0.00 H new ATOM 1572 N CYS A1614 9.695 -9.046 3.754 1.00 0.00 N ATOM 1573 CA CYS A1614 11.019 -9.450 3.260 1.00 0.00 C ATOM 1574 C CYS A1614 11.027 -10.892 2.796 1.00 0.00 C ATOM 1575 O CYS A1614 11.193 -11.817 3.599 1.00 0.00 O ATOM 1576 CB CYS A1614 12.100 -9.262 4.364 1.00 0.00 C ATOM 1577 SG CYS A1614 13.654 -10.265 4.126 1.00 0.00 S ATOM 0 H CYS A1614 9.706 -8.754 4.731 1.00 0.00 H new ATOM 0 HA CYS A1614 11.250 -8.809 2.409 1.00 0.00 H new ATOM 0 HB2 CYS A1614 12.370 -8.207 4.411 1.00 0.00 H new ATOM 0 HB3 CYS A1614 11.662 -9.522 5.328 1.00 0.00 H new ATOM 1582 N ARG A1615 10.821 -11.094 1.522 1.00 0.00 N ATOM 1583 CA ARG A1615 10.884 -12.416 0.951 1.00 0.00 C ATOM 1584 C ARG A1615 11.711 -12.373 -0.305 1.00 0.00 C ATOM 1585 O ARG A1615 11.240 -11.899 -1.336 1.00 0.00 O ATOM 1586 CB ARG A1615 9.494 -12.984 0.620 1.00 0.00 C ATOM 1587 CG ARG A1615 8.539 -13.116 1.799 1.00 0.00 C ATOM 1588 CD ARG A1615 9.139 -13.895 2.967 1.00 0.00 C ATOM 1589 NE ARG A1615 9.650 -15.220 2.606 1.00 0.00 N ATOM 1590 CZ ARG A1615 9.947 -16.177 3.496 1.00 0.00 C ATOM 1591 NH1 ARG A1615 9.680 -16.002 4.789 1.00 0.00 N1+ ATOM 1592 NH2 ARG A1615 10.495 -17.302 3.087 1.00 0.00 N ATOM 0 H ARG A1615 10.606 -10.354 0.854 1.00 0.00 H new ATOM 0 HA ARG A1615 11.337 -13.072 1.695 1.00 0.00 H new ATOM 0 HB2 ARG A1615 9.030 -12.345 -0.131 1.00 0.00 H new ATOM 0 HB3 ARG A1615 9.621 -13.967 0.167 1.00 0.00 H new ATOM 0 HG2 ARG A1615 8.253 -12.121 2.141 1.00 0.00 H new ATOM 0 HG3 ARG A1615 7.627 -13.613 1.468 1.00 0.00 H new ATOM 0 HD2 ARG A1615 9.951 -13.311 3.400 1.00 0.00 H new ATOM 0 HD3 ARG A1615 8.380 -14.009 3.741 1.00 0.00 H new ATOM 0 HE ARG A1615 9.788 -15.427 1.617 1.00 0.00 H new ATOM 0 HH11 ARG A1615 9.247 -15.135 5.108 1.00 0.00 H new ATOM 0 HH12 ARG A1615 9.909 -16.735 5.461 1.00 0.00 H new ATOM 0 HH21 ARG A1615 10.692 -17.443 2.096 1.00 0.00 H new ATOM 0 HH22 ARG A1615 10.723 -18.033 3.761 1.00 0.00 H new ATOM 1606 N PRO A1616 12.971 -12.824 -0.229 1.00 0.00 N ATOM 1607 CA PRO A1616 13.876 -12.888 -1.390 1.00 0.00 C ATOM 1608 C PRO A1616 13.293 -13.703 -2.563 1.00 0.00 C ATOM 1609 O PRO A1616 13.614 -13.449 -3.731 1.00 0.00 O ATOM 1610 CB PRO A1616 15.124 -13.577 -0.828 1.00 0.00 C ATOM 1611 CG PRO A1616 15.096 -13.263 0.624 1.00 0.00 C ATOM 1612 CD PRO A1616 13.646 -13.280 1.008 1.00 0.00 C ATOM 0 HA PRO A1616 14.064 -11.899 -1.807 1.00 0.00 H new ATOM 0 HB2 PRO A1616 15.097 -14.653 -1.003 1.00 0.00 H new ATOM 0 HB3 PRO A1616 16.032 -13.200 -1.299 1.00 0.00 H new ATOM 0 HG2 PRO A1616 15.662 -13.998 1.196 1.00 0.00 H new ATOM 0 HG3 PRO A1616 15.544 -12.290 0.824 1.00 0.00 H new ATOM 0 HD2 PRO A1616 13.318 -14.277 1.303 1.00 0.00 H new ATOM 0 HD3 PRO A1616 13.443 -12.616 1.848 1.00 0.00 H new ATOM 1694 N ARG A1623 1.652 -9.106 -6.930 1.00 0.00 N ATOM 1695 CA ARG A1623 0.442 -8.334 -6.992 1.00 0.00 C ATOM 1696 C ARG A1623 -0.112 -8.307 -5.576 1.00 0.00 C ATOM 1697 O ARG A1623 0.155 -9.235 -4.800 1.00 0.00 O ATOM 1698 CB ARG A1623 -0.559 -9.012 -7.961 1.00 0.00 C ATOM 1699 CG ARG A1623 -0.059 -9.083 -9.401 1.00 0.00 C ATOM 1700 CD ARG A1623 -0.991 -9.849 -10.322 1.00 0.00 C ATOM 1701 NE ARG A1623 -2.270 -9.165 -10.553 1.00 0.00 N ATOM 1702 CZ ARG A1623 -3.055 -9.365 -11.630 1.00 0.00 C ATOM 1703 NH1 ARG A1623 -2.691 -10.210 -12.589 1.00 0.00 N1+ ATOM 1704 NH2 ARG A1623 -4.184 -8.700 -11.762 1.00 0.00 N ATOM 0 HA ARG A1623 0.619 -7.324 -7.360 1.00 0.00 H new ATOM 0 HB2 ARG A1623 -0.768 -10.022 -7.607 1.00 0.00 H new ATOM 0 HB3 ARG A1623 -1.501 -8.465 -7.939 1.00 0.00 H new ATOM 0 HG2 ARG A1623 0.069 -8.071 -9.784 1.00 0.00 H new ATOM 0 HG3 ARG A1623 0.923 -9.555 -9.415 1.00 0.00 H new ATOM 0 HD2 ARG A1623 -0.494 -10.009 -11.279 1.00 0.00 H new ATOM 0 HD3 ARG A1623 -1.185 -10.833 -9.895 1.00 0.00 H new ATOM 0 HE ARG A1623 -2.585 -8.494 -9.852 1.00 0.00 H new ATOM 0 HH11 ARG A1623 -1.808 -10.716 -12.515 1.00 0.00 H new ATOM 0 HH12 ARG A1623 -3.294 -10.353 -13.399 1.00 0.00 H new ATOM 0 HH21 ARG A1623 -4.468 -8.030 -11.047 1.00 0.00 H new ATOM 0 HH22 ARG A1623 -4.775 -8.855 -12.579 1.00 0.00 H new ATOM 1718 N PRO A1624 -0.837 -7.242 -5.201 1.00 0.00 N ATOM 1719 CA PRO A1624 -1.354 -7.075 -3.838 1.00 0.00 C ATOM 1720 C PRO A1624 -2.394 -8.135 -3.466 1.00 0.00 C ATOM 1721 O PRO A1624 -3.426 -8.291 -4.141 1.00 0.00 O ATOM 1722 CB PRO A1624 -1.994 -5.678 -3.869 1.00 0.00 C ATOM 1723 CG PRO A1624 -2.314 -5.445 -5.308 1.00 0.00 C ATOM 1724 CD PRO A1624 -1.225 -6.116 -6.076 1.00 0.00 C ATOM 0 HA PRO A1624 -0.568 -7.184 -3.091 1.00 0.00 H new ATOM 0 HB2 PRO A1624 -2.891 -5.639 -3.252 1.00 0.00 H new ATOM 0 HB3 PRO A1624 -1.311 -4.920 -3.487 1.00 0.00 H new ATOM 0 HG2 PRO A1624 -3.288 -5.861 -5.565 1.00 0.00 H new ATOM 0 HG3 PRO A1624 -2.353 -4.379 -5.533 1.00 0.00 H new ATOM 0 HD2 PRO A1624 -1.574 -6.464 -7.048 1.00 0.00 H new ATOM 0 HD3 PRO A1624 -0.388 -5.442 -6.260 1.00 0.00 H new ATOM 1732 N MET A1625 -2.120 -8.858 -2.409 1.00 0.00 N ATOM 1733 CA MET A1625 -3.022 -9.889 -1.923 1.00 0.00 C ATOM 1734 C MET A1625 -3.660 -9.425 -0.627 1.00 0.00 C ATOM 1735 O MET A1625 -3.006 -8.759 0.185 1.00 0.00 O ATOM 1736 CB MET A1625 -2.283 -11.235 -1.717 1.00 0.00 C ATOM 1737 CG MET A1625 -1.123 -11.185 -0.722 1.00 0.00 C ATOM 1738 SD MET A1625 -0.322 -12.789 -0.453 1.00 0.00 S ATOM 1739 CE MET A1625 0.237 -13.197 -2.111 1.00 0.00 C ATOM 0 H MET A1625 -1.268 -8.754 -1.857 1.00 0.00 H new ATOM 0 HA MET A1625 -3.797 -10.057 -2.671 1.00 0.00 H new ATOM 0 HB2 MET A1625 -3.003 -11.980 -1.377 1.00 0.00 H new ATOM 0 HB3 MET A1625 -1.903 -11.575 -2.680 1.00 0.00 H new ATOM 0 HG2 MET A1625 -0.379 -10.473 -1.080 1.00 0.00 H new ATOM 0 HG3 MET A1625 -1.491 -10.808 0.232 1.00 0.00 H new ATOM 0 HE1 MET A1625 0.978 -13.994 -2.059 1.00 0.00 H new ATOM 0 HE2 MET A1625 -0.611 -13.529 -2.710 1.00 0.00 H new ATOM 0 HE3 MET A1625 0.684 -12.316 -2.572 1.00 0.00 H new ATOM 1749 N LEU A1626 -4.914 -9.766 -0.437 1.00 0.00 N ATOM 1750 CA LEU A1626 -5.653 -9.355 0.736 1.00 0.00 C ATOM 1751 C LEU A1626 -5.431 -10.409 1.809 1.00 0.00 C ATOM 1752 O LEU A1626 -5.744 -11.586 1.607 1.00 0.00 O ATOM 1753 CB LEU A1626 -7.149 -9.248 0.383 1.00 0.00 C ATOM 1754 CG LEU A1626 -7.986 -8.196 1.145 1.00 0.00 C ATOM 1755 CD1 LEU A1626 -9.403 -8.191 0.624 1.00 0.00 C ATOM 1756 CD2 LEU A1626 -7.980 -8.421 2.654 1.00 0.00 C ATOM 0 H LEU A1626 -5.451 -10.336 -1.091 1.00 0.00 H new ATOM 0 HA LEU A1626 -5.317 -8.382 1.094 1.00 0.00 H new ATOM 0 HB2 LEU A1626 -7.229 -9.034 -0.683 1.00 0.00 H new ATOM 0 HB3 LEU A1626 -7.605 -10.224 0.548 1.00 0.00 H new ATOM 0 HG LEU A1626 -7.523 -7.225 0.967 1.00 0.00 H new ATOM 0 HD11 LEU A1626 -9.987 -7.447 1.166 1.00 0.00 H new ATOM 0 HD12 LEU A1626 -9.399 -7.946 -0.438 1.00 0.00 H new ATOM 0 HD13 LEU A1626 -9.847 -9.176 0.768 1.00 0.00 H new ATOM 0 HD21 LEU A1626 -8.583 -7.653 3.139 1.00 0.00 H new ATOM 0 HD22 LEU A1626 -8.396 -9.404 2.877 1.00 0.00 H new ATOM 0 HD23 LEU A1626 -6.957 -8.367 3.026 1.00 0.00 H new ATOM 1768 N ILE A1627 -4.856 -10.009 2.918 1.00 0.00 N ATOM 1769 CA ILE A1627 -4.553 -10.943 3.980 1.00 0.00 C ATOM 1770 C ILE A1627 -5.606 -10.898 5.065 1.00 0.00 C ATOM 1771 O ILE A1627 -6.178 -11.930 5.417 1.00 0.00 O ATOM 1772 CB ILE A1627 -3.138 -10.699 4.588 1.00 0.00 C ATOM 1773 CG1 ILE A1627 -2.056 -10.869 3.515 1.00 0.00 C ATOM 1774 CG2 ILE A1627 -2.862 -11.630 5.776 1.00 0.00 C ATOM 1775 CD1 ILE A1627 -2.018 -12.241 2.866 1.00 0.00 C ATOM 0 H ILE A1627 -4.588 -9.044 3.110 1.00 0.00 H new ATOM 0 HA ILE A1627 -4.555 -11.938 3.534 1.00 0.00 H new ATOM 0 HB ILE A1627 -3.112 -9.674 4.958 1.00 0.00 H new ATOM 0 HG12 ILE A1627 -2.211 -10.119 2.739 1.00 0.00 H new ATOM 0 HG13 ILE A1627 -1.083 -10.667 3.964 1.00 0.00 H new ATOM 0 HG21 ILE A1627 -1.866 -11.429 6.172 1.00 0.00 H new ATOM 0 HG22 ILE A1627 -3.604 -11.456 6.555 1.00 0.00 H new ATOM 0 HG23 ILE A1627 -2.919 -12.667 5.446 1.00 0.00 H new ATOM 0 HD11 ILE A1627 -1.223 -12.269 2.121 1.00 0.00 H new ATOM 0 HD12 ILE A1627 -1.829 -12.998 3.627 1.00 0.00 H new ATOM 0 HD13 ILE A1627 -2.975 -12.442 2.384 1.00 0.00 H new ATOM 1787 N SER A1628 -5.920 -9.721 5.543 1.00 0.00 N ATOM 1788 CA SER A1628 -6.847 -9.610 6.637 1.00 0.00 C ATOM 1789 C SER A1628 -7.824 -8.470 6.387 1.00 0.00 C ATOM 1790 O SER A1628 -7.424 -7.343 6.080 1.00 0.00 O ATOM 1791 CB SER A1628 -6.073 -9.380 7.941 1.00 0.00 C ATOM 1792 OG SER A1628 -5.019 -10.333 8.079 1.00 0.00 O ATOM 0 H SER A1628 -5.552 -8.836 5.196 1.00 0.00 H new ATOM 0 HA SER A1628 -7.418 -10.535 6.721 1.00 0.00 H new ATOM 0 HB2 SER A1628 -5.661 -8.371 7.952 1.00 0.00 H new ATOM 0 HB3 SER A1628 -6.752 -9.456 8.790 1.00 0.00 H new ATOM 0 HG SER A1628 -4.537 -10.168 8.916 1.00 0.00 H new ATOM 1798 N LEU A1629 -9.088 -8.776 6.472 1.00 0.00 N ATOM 1799 CA LEU A1629 -10.132 -7.800 6.278 1.00 0.00 C ATOM 1800 C LEU A1629 -10.694 -7.494 7.656 1.00 0.00 C ATOM 1801 O LEU A1629 -11.306 -8.364 8.279 1.00 0.00 O ATOM 1802 CB LEU A1629 -11.243 -8.412 5.394 1.00 0.00 C ATOM 1803 CG LEU A1629 -12.181 -7.452 4.616 1.00 0.00 C ATOM 1804 CD1 LEU A1629 -12.807 -6.378 5.485 1.00 0.00 C ATOM 1805 CD2 LEU A1629 -11.472 -6.853 3.430 1.00 0.00 C ATOM 0 H LEU A1629 -9.429 -9.715 6.679 1.00 0.00 H new ATOM 0 HA LEU A1629 -9.755 -6.900 5.793 1.00 0.00 H new ATOM 0 HB2 LEU A1629 -10.765 -9.069 4.668 1.00 0.00 H new ATOM 0 HB3 LEU A1629 -11.866 -9.040 6.031 1.00 0.00 H new ATOM 0 HG LEU A1629 -13.010 -8.061 4.257 1.00 0.00 H new ATOM 0 HD11 LEU A1629 -13.450 -5.744 4.874 1.00 0.00 H new ATOM 0 HD12 LEU A1629 -13.400 -6.846 6.271 1.00 0.00 H new ATOM 0 HD13 LEU A1629 -12.022 -5.771 5.935 1.00 0.00 H new ATOM 0 HD21 LEU A1629 -12.150 -6.184 2.901 1.00 0.00 H new ATOM 0 HD22 LEU A1629 -10.602 -6.292 3.771 1.00 0.00 H new ATOM 0 HD23 LEU A1629 -11.150 -7.649 2.758 1.00 0.00 H new ATOM 1817 N ASP A1630 -10.467 -6.312 8.155 1.00 0.00 N ATOM 1818 CA ASP A1630 -10.977 -5.973 9.458 1.00 0.00 C ATOM 1819 C ASP A1630 -11.943 -4.812 9.395 1.00 0.00 C ATOM 1820 O ASP A1630 -11.545 -3.663 9.264 1.00 0.00 O ATOM 1821 CB ASP A1630 -9.857 -5.661 10.434 1.00 0.00 C ATOM 1822 CG ASP A1630 -10.395 -5.373 11.806 1.00 0.00 C ATOM 1823 OD1 ASP A1630 -10.746 -6.320 12.526 1.00 0.00 O1- ATOM 1824 OD2 ASP A1630 -10.505 -4.196 12.188 1.00 0.00 O ATOM 0 H ASP A1630 -9.940 -5.574 7.689 1.00 0.00 H new ATOM 0 HA ASP A1630 -11.515 -6.850 9.819 1.00 0.00 H new ATOM 0 HB2 ASP A1630 -9.167 -6.504 10.481 1.00 0.00 H new ATOM 0 HB3 ASP A1630 -9.288 -4.803 10.076 1.00 0.00 H new ATOM 1829 N LYS A1631 -13.213 -5.106 9.467 1.00 0.00 N ATOM 1830 CA LYS A1631 -14.233 -4.068 9.489 1.00 0.00 C ATOM 1831 C LYS A1631 -14.456 -3.545 10.897 1.00 0.00 C ATOM 1832 O LYS A1631 -15.295 -2.674 11.117 1.00 0.00 O ATOM 1833 CB LYS A1631 -15.550 -4.551 8.891 1.00 0.00 C ATOM 1834 CG LYS A1631 -15.489 -4.851 7.414 1.00 0.00 C ATOM 1835 CD LYS A1631 -16.848 -5.253 6.886 1.00 0.00 C ATOM 1836 CE LYS A1631 -16.805 -5.517 5.397 1.00 0.00 C ATOM 1837 NZ LYS A1631 -18.135 -5.845 4.854 1.00 0.00 N1+ ATOM 0 H LYS A1631 -13.577 -6.058 9.512 1.00 0.00 H new ATOM 0 HA LYS A1631 -13.864 -3.251 8.869 1.00 0.00 H new ATOM 0 HB2 LYS A1631 -15.867 -5.450 9.419 1.00 0.00 H new ATOM 0 HB3 LYS A1631 -16.314 -3.793 9.064 1.00 0.00 H new ATOM 0 HG2 LYS A1631 -15.131 -3.974 6.876 1.00 0.00 H new ATOM 0 HG3 LYS A1631 -14.772 -5.652 7.231 1.00 0.00 H new ATOM 0 HD2 LYS A1631 -17.192 -6.147 7.406 1.00 0.00 H new ATOM 0 HD3 LYS A1631 -17.570 -4.464 7.097 1.00 0.00 H new ATOM 0 HE2 LYS A1631 -16.411 -4.639 4.885 1.00 0.00 H new ATOM 0 HE3 LYS A1631 -16.118 -6.339 5.195 1.00 0.00 H new ATOM 0 HZ1 LYS A1631 -18.059 -6.018 3.831 1.00 0.00 H new ATOM 0 HZ2 LYS A1631 -18.501 -6.698 5.324 1.00 0.00 H new ATOM 0 HZ3 LYS A1631 -18.785 -5.051 5.023 1.00 0.00 H new ATOM 1851 N GLN A1632 -13.707 -4.072 11.846 1.00 0.00 N ATOM 1852 CA GLN A1632 -13.845 -3.664 13.230 1.00 0.00 C ATOM 1853 C GLN A1632 -13.207 -2.306 13.444 1.00 0.00 C ATOM 1854 O GLN A1632 -13.784 -1.432 14.107 1.00 0.00 O ATOM 1855 CB GLN A1632 -13.245 -4.692 14.181 1.00 0.00 C ATOM 1856 CG GLN A1632 -13.903 -6.062 14.122 1.00 0.00 C ATOM 1857 CD GLN A1632 -13.306 -7.050 15.105 1.00 0.00 C ATOM 1858 OE1 GLN A1632 -12.840 -6.569 16.224 1.00 0.00 O flip ATOM 1859 NE2 GLN A1632 -13.284 -8.263 14.853 1.00 0.00 N flip ATOM 0 H GLN A1632 -12.996 -4.785 11.683 1.00 0.00 H new ATOM 0 HA GLN A1632 -14.910 -3.594 13.452 1.00 0.00 H new ATOM 0 HB2 GLN A1632 -12.184 -4.802 13.956 1.00 0.00 H new ATOM 0 HB3 GLN A1632 -13.317 -4.312 15.200 1.00 0.00 H new ATOM 0 HG2 GLN A1632 -14.969 -5.956 14.324 1.00 0.00 H new ATOM 0 HG3 GLN A1632 -13.809 -6.461 13.112 1.00 0.00 H new ATOM 0 HE21 GLN A1632 -13.657 -8.607 13.968 1.00 0.00 H new ATOM 0 HE22 GLN A1632 -12.893 -8.918 15.531 1.00 0.00 H new ATOM 1868 N THR A1633 -12.015 -2.137 12.902 1.00 0.00 N ATOM 1869 CA THR A1633 -11.320 -0.874 12.957 1.00 0.00 C ATOM 1870 C THR A1633 -11.358 -0.183 11.596 1.00 0.00 C ATOM 1871 O THR A1633 -10.848 0.935 11.426 1.00 0.00 O ATOM 1872 CB THR A1633 -9.842 -1.040 13.408 1.00 0.00 C ATOM 1873 OG1 THR A1633 -9.137 -1.962 12.533 1.00 0.00 O ATOM 1874 CG2 THR A1633 -9.767 -1.533 14.844 1.00 0.00 C ATOM 0 H THR A1633 -11.506 -2.873 12.413 1.00 0.00 H new ATOM 0 HA THR A1633 -11.834 -0.261 13.697 1.00 0.00 H new ATOM 0 HB THR A1633 -9.364 -0.062 13.348 1.00 0.00 H new ATOM 0 HG1 THR A1633 -9.491 -2.867 12.658 1.00 0.00 H new ATOM 0 HG21 THR A1633 -8.723 -1.642 15.137 1.00 0.00 H new ATOM 0 HG22 THR A1633 -10.256 -0.814 15.502 1.00 0.00 H new ATOM 0 HG23 THR A1633 -10.269 -2.497 14.924 1.00 0.00 H new ATOM 1882 N CYS A1634 -11.991 -0.877 10.633 1.00 0.00 N ATOM 1883 CA CYS A1634 -12.093 -0.442 9.240 1.00 0.00 C ATOM 1884 C CYS A1634 -10.709 -0.386 8.600 1.00 0.00 C ATOM 1885 O CYS A1634 -10.291 0.648 8.062 1.00 0.00 O ATOM 1886 CB CYS A1634 -12.798 0.909 9.110 1.00 0.00 C ATOM 1887 SG CYS A1634 -14.550 0.945 9.594 1.00 0.00 S ATOM 0 H CYS A1634 -12.452 -1.770 10.810 1.00 0.00 H new ATOM 0 HA CYS A1634 -12.701 -1.176 8.712 1.00 0.00 H new ATOM 0 HB2 CYS A1634 -12.259 1.637 9.716 1.00 0.00 H new ATOM 0 HB3 CYS A1634 -12.721 1.238 8.074 1.00 0.00 H new ATOM 1892 N THR A1635 -10.017 -1.489 8.648 1.00 0.00 N ATOM 1893 CA THR A1635 -8.672 -1.563 8.168 1.00 0.00 C ATOM 1894 C THR A1635 -8.503 -2.803 7.275 1.00 0.00 C ATOM 1895 O THR A1635 -8.850 -3.919 7.671 1.00 0.00 O ATOM 1896 CB THR A1635 -7.707 -1.652 9.371 1.00 0.00 C ATOM 1897 OG1 THR A1635 -8.020 -0.604 10.319 1.00 0.00 O ATOM 1898 CG2 THR A1635 -6.266 -1.494 8.916 1.00 0.00 C ATOM 0 H THR A1635 -10.376 -2.367 9.024 1.00 0.00 H new ATOM 0 HA THR A1635 -8.446 -0.672 7.583 1.00 0.00 H new ATOM 0 HB THR A1635 -7.826 -2.630 9.838 1.00 0.00 H new ATOM 0 HG1 THR A1635 -8.418 -0.998 11.123 1.00 0.00 H new ATOM 0 HG21 THR A1635 -5.603 -1.560 9.779 1.00 0.00 H new ATOM 0 HG22 THR A1635 -6.019 -2.285 8.208 1.00 0.00 H new ATOM 0 HG23 THR A1635 -6.141 -0.524 8.435 1.00 0.00 H new ATOM 1906 N LEU A1636 -8.033 -2.604 6.071 1.00 0.00 N ATOM 1907 CA LEU A1636 -7.775 -3.708 5.173 1.00 0.00 C ATOM 1908 C LEU A1636 -6.280 -3.939 5.063 1.00 0.00 C ATOM 1909 O LEU A1636 -5.525 -3.025 4.708 1.00 0.00 O ATOM 1910 CB LEU A1636 -8.387 -3.489 3.771 1.00 0.00 C ATOM 1911 CG LEU A1636 -9.929 -3.462 3.652 1.00 0.00 C ATOM 1912 CD1 LEU A1636 -10.542 -2.188 4.224 1.00 0.00 C ATOM 1913 CD2 LEU A1636 -10.365 -3.688 2.209 1.00 0.00 C ATOM 0 H LEU A1636 -7.819 -1.684 5.685 1.00 0.00 H new ATOM 0 HA LEU A1636 -8.257 -4.590 5.594 1.00 0.00 H new ATOM 0 HB2 LEU A1636 -8.005 -2.545 3.383 1.00 0.00 H new ATOM 0 HB3 LEU A1636 -8.015 -4.277 3.116 1.00 0.00 H new ATOM 0 HG LEU A1636 -10.308 -4.284 4.259 1.00 0.00 H new ATOM 0 HD11 LEU A1636 -11.626 -2.224 4.113 1.00 0.00 H new ATOM 0 HD12 LEU A1636 -10.288 -2.105 5.281 1.00 0.00 H new ATOM 0 HD13 LEU A1636 -10.151 -1.323 3.687 1.00 0.00 H new ATOM 0 HD21 LEU A1636 -11.453 -3.665 2.150 1.00 0.00 H new ATOM 0 HD22 LEU A1636 -9.950 -2.903 1.576 1.00 0.00 H new ATOM 0 HD23 LEU A1636 -10.004 -4.658 1.867 1.00 0.00 H new ATOM 1925 N PHE A1637 -5.858 -5.134 5.395 1.00 0.00 N ATOM 1926 CA PHE A1637 -4.460 -5.503 5.349 1.00 0.00 C ATOM 1927 C PHE A1637 -4.141 -6.228 4.055 1.00 0.00 C ATOM 1928 O PHE A1637 -4.619 -7.353 3.812 1.00 0.00 O ATOM 1929 CB PHE A1637 -4.081 -6.398 6.534 1.00 0.00 C ATOM 1930 CG PHE A1637 -4.178 -5.745 7.890 1.00 0.00 C ATOM 1931 CD1 PHE A1637 -5.367 -5.761 8.604 1.00 0.00 C ATOM 1932 CD2 PHE A1637 -3.069 -5.134 8.457 1.00 0.00 C ATOM 1933 CE1 PHE A1637 -5.446 -5.179 9.854 1.00 0.00 C ATOM 1934 CE2 PHE A1637 -3.147 -4.550 9.705 1.00 0.00 C ATOM 1935 CZ PHE A1637 -4.334 -4.574 10.404 1.00 0.00 C ATOM 0 H PHE A1637 -6.476 -5.884 5.707 1.00 0.00 H new ATOM 0 HA PHE A1637 -3.879 -4.582 5.404 1.00 0.00 H new ATOM 0 HB2 PHE A1637 -4.725 -7.277 6.525 1.00 0.00 H new ATOM 0 HB3 PHE A1637 -3.059 -6.750 6.390 1.00 0.00 H new ATOM 0 HD1 PHE A1637 -6.240 -6.233 8.178 1.00 0.00 H new ATOM 0 HD2 PHE A1637 -2.135 -5.115 7.916 1.00 0.00 H new ATOM 0 HE1 PHE A1637 -6.377 -5.197 10.401 1.00 0.00 H new ATOM 0 HE2 PHE A1637 -2.277 -4.074 10.134 1.00 0.00 H new ATOM 0 HZ PHE A1637 -4.394 -4.120 11.382 1.00 0.00 H new ATOM 1945 N PHE A1638 -3.355 -5.595 3.245 1.00 0.00 N ATOM 1946 CA PHE A1638 -2.900 -6.141 1.986 1.00 0.00 C ATOM 1947 C PHE A1638 -1.429 -6.452 2.152 1.00 0.00 C ATOM 1948 O PHE A1638 -0.754 -5.778 2.908 1.00 0.00 O ATOM 1949 CB PHE A1638 -3.093 -5.117 0.847 1.00 0.00 C ATOM 1950 CG PHE A1638 -4.511 -4.669 0.645 1.00 0.00 C ATOM 1951 CD1 PHE A1638 -5.398 -5.444 -0.079 1.00 0.00 C ATOM 1952 CD2 PHE A1638 -4.952 -3.460 1.162 1.00 0.00 C ATOM 1953 CE1 PHE A1638 -6.697 -5.027 -0.285 1.00 0.00 C ATOM 1954 CE2 PHE A1638 -6.250 -3.040 0.961 1.00 0.00 C ATOM 1955 CZ PHE A1638 -7.123 -3.825 0.235 1.00 0.00 C ATOM 0 H PHE A1638 -2.997 -4.659 3.436 1.00 0.00 H new ATOM 0 HA PHE A1638 -3.469 -7.034 1.727 1.00 0.00 H new ATOM 0 HB2 PHE A1638 -2.475 -4.243 1.053 1.00 0.00 H new ATOM 0 HB3 PHE A1638 -2.728 -5.554 -0.082 1.00 0.00 H new ATOM 0 HD1 PHE A1638 -5.070 -6.388 -0.489 1.00 0.00 H new ATOM 0 HD2 PHE A1638 -4.272 -2.841 1.728 1.00 0.00 H new ATOM 0 HE1 PHE A1638 -7.379 -5.642 -0.853 1.00 0.00 H new ATOM 0 HE2 PHE A1638 -6.583 -2.098 1.371 1.00 0.00 H new ATOM 0 HZ PHE A1638 -8.139 -3.497 0.075 1.00 0.00 H new ATOM 1965 N SER A1639 -0.927 -7.452 1.501 1.00 0.00 N ATOM 1966 CA SER A1639 0.445 -7.784 1.652 1.00 0.00 C ATOM 1967 C SER A1639 1.087 -8.050 0.299 1.00 0.00 C ATOM 1968 O SER A1639 0.397 -8.363 -0.692 1.00 0.00 O ATOM 1969 CB SER A1639 0.593 -8.977 2.600 1.00 0.00 C ATOM 1970 OG SER A1639 1.954 -9.278 2.883 1.00 0.00 O ATOM 0 H SER A1639 -1.450 -8.050 0.861 1.00 0.00 H new ATOM 0 HA SER A1639 0.971 -6.938 2.094 1.00 0.00 H new ATOM 0 HB2 SER A1639 0.069 -8.764 3.532 1.00 0.00 H new ATOM 0 HB3 SER A1639 0.115 -9.851 2.158 1.00 0.00 H new ATOM 0 HG SER A1639 2.478 -8.450 2.888 1.00 0.00 H new ATOM 1976 N TRP A1640 2.383 -7.887 0.260 1.00 0.00 N ATOM 1977 CA TRP A1640 3.174 -8.087 -0.906 1.00 0.00 C ATOM 1978 C TRP A1640 4.462 -8.776 -0.438 1.00 0.00 C ATOM 1979 O TRP A1640 4.996 -8.439 0.624 1.00 0.00 O ATOM 1980 CB TRP A1640 3.482 -6.709 -1.517 1.00 0.00 C ATOM 1981 CG TRP A1640 4.065 -6.709 -2.906 1.00 0.00 C ATOM 1982 CD1 TRP A1640 5.225 -7.286 -3.317 1.00 0.00 C ATOM 1983 CD2 TRP A1640 3.528 -6.039 -4.053 1.00 0.00 C ATOM 1984 NE1 TRP A1640 5.429 -7.051 -4.649 1.00 0.00 N ATOM 1985 CE2 TRP A1640 4.406 -6.280 -5.125 1.00 0.00 C ATOM 1986 CE3 TRP A1640 2.385 -5.266 -4.279 1.00 0.00 C ATOM 1987 CZ2 TRP A1640 4.178 -5.776 -6.399 1.00 0.00 C ATOM 1988 CZ3 TRP A1640 2.164 -4.765 -5.547 1.00 0.00 C ATOM 1989 CH2 TRP A1640 3.056 -5.022 -6.591 1.00 0.00 C ATOM 0 H TRP A1640 2.928 -7.601 1.073 1.00 0.00 H new ATOM 0 HA TRP A1640 2.673 -8.695 -1.659 1.00 0.00 H new ATOM 0 HB2 TRP A1640 2.560 -6.128 -1.533 1.00 0.00 H new ATOM 0 HB3 TRP A1640 4.175 -6.189 -0.855 1.00 0.00 H new ATOM 0 HD1 TRP A1640 5.892 -7.850 -2.682 1.00 0.00 H new ATOM 0 HE1 TRP A1640 6.217 -7.395 -5.198 1.00 0.00 H new ATOM 0 HE3 TRP A1640 1.689 -5.065 -3.478 1.00 0.00 H new ATOM 0 HZ2 TRP A1640 4.864 -5.974 -7.209 1.00 0.00 H new ATOM 0 HZ3 TRP A1640 1.286 -4.164 -5.735 1.00 0.00 H new ATOM 0 HH2 TRP A1640 2.854 -4.616 -7.571 1.00 0.00 H new ATOM 2000 N HIS A1641 4.917 -9.760 -1.175 1.00 0.00 N ATOM 2001 CA HIS A1641 6.147 -10.475 -0.835 1.00 0.00 C ATOM 2002 C HIS A1641 7.243 -9.991 -1.769 1.00 0.00 C ATOM 2003 O HIS A1641 7.235 -10.329 -2.943 1.00 0.00 O ATOM 2004 CB HIS A1641 5.964 -12.005 -0.998 1.00 0.00 C ATOM 2005 CG HIS A1641 4.900 -12.631 -0.124 1.00 0.00 C ATOM 2006 ND1 HIS A1641 5.165 -13.555 0.860 1.00 0.00 N ATOM 2007 CD2 HIS A1641 3.556 -12.485 -0.127 1.00 0.00 C ATOM 2008 CE1 HIS A1641 4.046 -13.933 1.416 1.00 0.00 C ATOM 2009 NE2 HIS A1641 3.057 -13.303 0.836 1.00 0.00 N ATOM 0 H HIS A1641 4.458 -10.094 -2.022 1.00 0.00 H new ATOM 0 HA HIS A1641 6.406 -10.278 0.205 1.00 0.00 H new ATOM 0 HB2 HIS A1641 5.723 -12.215 -2.040 1.00 0.00 H new ATOM 0 HB3 HIS A1641 6.916 -12.492 -0.786 1.00 0.00 H new ATOM 0 HD2 HIS A1641 2.984 -11.837 -0.775 1.00 0.00 H new ATOM 0 HE1 HIS A1641 3.952 -14.647 2.221 1.00 0.00 H new ATOM 0 HE2 HIS A1641 2.070 -13.409 1.069 1.00 0.00 H new ATOM 2018 N THR A1642 8.154 -9.186 -1.270 1.00 0.00 N ATOM 2019 CA THR A1642 9.174 -8.605 -2.123 1.00 0.00 C ATOM 2020 C THR A1642 10.548 -8.560 -1.423 1.00 0.00 C ATOM 2021 O THR A1642 10.640 -8.434 -0.188 1.00 0.00 O ATOM 2022 CB THR A1642 8.751 -7.160 -2.581 1.00 0.00 C ATOM 2023 OG1 THR A1642 9.744 -6.575 -3.429 1.00 0.00 O ATOM 2024 CG2 THR A1642 8.484 -6.241 -1.393 1.00 0.00 C ATOM 0 H THR A1642 8.212 -8.919 -0.287 1.00 0.00 H new ATOM 0 HA THR A1642 9.269 -9.245 -3.001 1.00 0.00 H new ATOM 0 HB THR A1642 7.823 -7.270 -3.143 1.00 0.00 H new ATOM 0 HG1 THR A1642 9.390 -5.753 -3.828 1.00 0.00 H new ATOM 0 HG21 THR A1642 8.195 -5.254 -1.754 1.00 0.00 H new ATOM 0 HG22 THR A1642 7.679 -6.655 -0.786 1.00 0.00 H new ATOM 0 HG23 THR A1642 9.387 -6.156 -0.789 1.00 0.00 H new ATOM 2032 N PRO A1643 11.641 -8.725 -2.213 1.00 0.00 N ATOM 2033 CA PRO A1643 13.015 -8.574 -1.724 1.00 0.00 C ATOM 2034 C PRO A1643 13.375 -7.093 -1.546 1.00 0.00 C ATOM 2035 O PRO A1643 14.403 -6.753 -0.947 1.00 0.00 O ATOM 2036 CB PRO A1643 13.859 -9.178 -2.850 1.00 0.00 C ATOM 2037 CG PRO A1643 13.042 -8.994 -4.075 1.00 0.00 C ATOM 2038 CD PRO A1643 11.614 -9.140 -3.642 1.00 0.00 C ATOM 0 HA PRO A1643 13.169 -9.050 -0.755 1.00 0.00 H new ATOM 0 HB2 PRO A1643 14.822 -8.674 -2.937 1.00 0.00 H new ATOM 0 HB3 PRO A1643 14.066 -10.232 -2.667 1.00 0.00 H new ATOM 0 HG2 PRO A1643 13.218 -8.014 -4.518 1.00 0.00 H new ATOM 0 HG3 PRO A1643 13.299 -9.736 -4.831 1.00 0.00 H new ATOM 0 HD2 PRO A1643 10.949 -8.508 -4.231 1.00 0.00 H new ATOM 0 HD3 PRO A1643 11.263 -10.166 -3.756 1.00 0.00 H new ATOM 2046 N LEU A1644 12.506 -6.215 -2.053 1.00 0.00 N ATOM 2047 CA LEU A1644 12.711 -4.772 -1.980 1.00 0.00 C ATOM 2048 C LEU A1644 12.311 -4.236 -0.620 1.00 0.00 C ATOM 2049 O LEU A1644 12.474 -3.059 -0.335 1.00 0.00 O ATOM 2050 CB LEU A1644 11.917 -4.054 -3.076 1.00 0.00 C ATOM 2051 CG LEU A1644 12.305 -4.389 -4.516 1.00 0.00 C ATOM 2052 CD1 LEU A1644 11.383 -3.680 -5.494 1.00 0.00 C ATOM 2053 CD2 LEU A1644 13.749 -4.000 -4.783 1.00 0.00 C ATOM 0 H LEU A1644 11.643 -6.487 -2.524 1.00 0.00 H new ATOM 0 HA LEU A1644 13.773 -4.580 -2.132 1.00 0.00 H new ATOM 0 HB2 LEU A1644 10.860 -4.286 -2.942 1.00 0.00 H new ATOM 0 HB3 LEU A1644 12.028 -2.979 -2.932 1.00 0.00 H new ATOM 0 HG LEU A1644 12.202 -5.465 -4.656 1.00 0.00 H new ATOM 0 HD11 LEU A1644 11.674 -3.930 -6.514 1.00 0.00 H new ATOM 0 HD12 LEU A1644 10.355 -3.999 -5.321 1.00 0.00 H new ATOM 0 HD13 LEU A1644 11.458 -2.602 -5.349 1.00 0.00 H new ATOM 0 HD21 LEU A1644 14.008 -4.246 -5.813 1.00 0.00 H new ATOM 0 HD22 LEU A1644 13.873 -2.929 -4.624 1.00 0.00 H new ATOM 0 HD23 LEU A1644 14.404 -4.546 -4.104 1.00 0.00 H new ATOM 2065 N ALA A1645 11.791 -5.107 0.207 1.00 0.00 N ATOM 2066 CA ALA A1645 11.372 -4.752 1.539 1.00 0.00 C ATOM 2067 C ALA A1645 12.254 -5.438 2.555 1.00 0.00 C ATOM 2068 O ALA A1645 11.840 -5.720 3.676 1.00 0.00 O ATOM 2069 CB ALA A1645 9.932 -5.158 1.744 1.00 0.00 C ATOM 0 H ALA A1645 11.645 -6.089 -0.027 1.00 0.00 H new ATOM 0 HA ALA A1645 11.460 -3.673 1.668 1.00 0.00 H new ATOM 0 HB1 ALA A1645 9.618 -4.888 2.752 1.00 0.00 H new ATOM 0 HB2 ALA A1645 9.302 -4.644 1.018 1.00 0.00 H new ATOM 0 HB3 ALA A1645 9.835 -6.235 1.610 1.00 0.00 H new ATOM 2075 N CYS A1646 13.464 -5.727 2.167 1.00 0.00 N ATOM 2076 CA CYS A1646 14.345 -6.419 3.053 1.00 0.00 C ATOM 2077 C CYS A1646 15.700 -5.747 3.106 1.00 0.00 C ATOM 2078 O CYS A1646 16.224 -5.295 2.074 1.00 0.00 O ATOM 2079 CB CYS A1646 14.485 -7.847 2.601 1.00 0.00 C ATOM 2080 SG CYS A1646 15.150 -8.939 3.875 1.00 0.00 S ATOM 0 H CYS A1646 13.856 -5.496 1.254 1.00 0.00 H new ATOM 0 HA CYS A1646 13.923 -6.395 4.058 1.00 0.00 H new ATOM 0 HB2 CYS A1646 13.509 -8.218 2.287 1.00 0.00 H new ATOM 0 HB3 CYS A1646 15.135 -7.882 1.727 1.00 0.00 H new