USER MOD reduce.3.24.130724 H: found=0, std=0, add=870, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 874 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A1639 SER OG : rot -117:sc= 0.266 USER MOD Set 1.2: A1641 HIS :FLIP no HD1:sc= -0.946 F(o=-1.8!,f=-0.68) USER MOD Set 2.1: A1633 THR OG1 : rot -65:sc= 1.21 USER MOD Set 2.2: A1635 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A1573 SER OG : rot 180:sc= 0.882 USER MOD Set 3.2: A1596 SER OG : rot 14:sc= 0.813 USER MOD Set 4.1: A1578 ASN : amide:sc= -3.3 K(o=-2.3,f=-6.8!) USER MOD Set 4.2: A1593 LYS NZ :NH3+ -179:sc= 1 (180deg=-0.0944) USER MOD Set 5.1: A1523 THR OG1 : rot 123:sc= 0.206 USER MOD Set 5.2: A1525 HIS : no HD1:sc= -0.192 K(o=0.014,f=-0.94) USER MOD Set 6.1: A1520 ASN : amide:sc= 0.00533 K(o=0.012,f=-0.75) USER MOD Set 6.2: A1522 SER OG : rot 97:sc= 0.00666 USER MOD Single : A1517 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A1519 THR OG1 : rot 180:sc=-0.00254 USER MOD Single : A1530 SER OG : rot 99:sc= 1.21 USER MOD Single : A1531 SER OG : rot 180:sc= 0 USER MOD Single : A1533 SER OG : rot 20:sc= 0.0273 USER MOD Single : A1539 THR OG1 : rot -99:sc= 0.562 USER MOD Single : A1542 TYR OH : rot 180:sc= 0 USER MOD Single : A1549 TYR OH : rot 110:sc= -0.226 USER MOD Single : A1550 MET CE :methyl -170:sc= -0.0206 (180deg=-0.243) USER MOD Single : A1551 SER OG : rot -89:sc= -1.08 USER MOD Single : A1556 ASN : amide:sc= 0.138 K(o=0.14,f=-4!) USER MOD Single : A1558 ASN : amide:sc=-0.00606 X(o=-0.0061,f=0) USER MOD Single : A1569 GLN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : A1570 THR OG1 : rot 180:sc= 0.00557 USER MOD Single : A1576 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1579 LYS NZ :NH3+ 160:sc= -0.0255 (180deg=-0.329) USER MOD Single : A1583 TYR OH : rot 180:sc= -0.613 USER MOD Single : A1586 GLN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A1589 GLN : amide:sc= 0.43 K(o=0.43,f=-6.5!) USER MOD Single : A1592 TYR OH : rot -115:sc= 0.936 USER MOD Single : A1605 SER OG : rot 16:sc= 1.74 USER MOD Single : A1606 TYR OH : rot 180:sc= 0 USER MOD Single : A1607 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1608 SER OG : rot 101:sc= 0.223 USER MOD Single : A1611 SER OG : rot 180:sc= -0.529 USER MOD Single : A1625 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A1628 SER OG : rot 180:sc= 0 USER MOD Single : A1631 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1632 GLN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A1642 THR OG1 : rot 100:sc= -0.106 USER MOD ----------------------------------------------------------------- ATOM 124 N CYS A1516 8.328 7.439 0.136 1.00 0.00 N ATOM 125 CA CYS A1516 8.499 5.981 0.093 1.00 0.00 C ATOM 126 C CYS A1516 9.949 5.524 0.065 1.00 0.00 C ATOM 127 O CYS A1516 10.311 4.605 -0.687 1.00 0.00 O ATOM 128 CB CYS A1516 7.730 5.363 -1.070 1.00 0.00 C ATOM 129 SG CYS A1516 5.953 5.681 -1.019 1.00 0.00 S ATOM 0 HA CYS A1516 8.082 5.622 1.034 1.00 0.00 H new ATOM 0 HB2 CYS A1516 8.132 5.750 -2.006 1.00 0.00 H new ATOM 0 HB3 CYS A1516 7.897 4.286 -1.073 1.00 0.00 H new ATOM 134 N GLN A1517 10.772 6.150 0.858 1.00 0.00 N ATOM 135 CA GLN A1517 12.132 5.722 0.987 1.00 0.00 C ATOM 136 C GLN A1517 12.554 5.819 2.442 1.00 0.00 C ATOM 137 O GLN A1517 12.323 6.835 3.102 1.00 0.00 O ATOM 138 CB GLN A1517 13.079 6.508 0.055 1.00 0.00 C ATOM 139 CG GLN A1517 13.136 8.012 0.301 1.00 0.00 C ATOM 140 CD GLN A1517 14.166 8.715 -0.560 1.00 0.00 C ATOM 141 OE1 GLN A1517 14.459 8.303 -1.678 1.00 0.00 O ATOM 142 NE2 GLN A1517 14.731 9.765 -0.044 1.00 0.00 N ATOM 0 H GLN A1517 10.522 6.960 1.425 1.00 0.00 H new ATOM 0 HA GLN A1517 12.202 4.681 0.671 1.00 0.00 H new ATOM 0 HB2 GLN A1517 14.085 6.101 0.159 1.00 0.00 H new ATOM 0 HB3 GLN A1517 12.771 6.337 -0.977 1.00 0.00 H new ATOM 0 HG2 GLN A1517 12.154 8.443 0.108 1.00 0.00 H new ATOM 0 HG3 GLN A1517 13.363 8.194 1.351 1.00 0.00 H new ATOM 0 HE21 GLN A1517 14.464 10.081 0.888 1.00 0.00 H new ATOM 0 HE22 GLN A1517 15.441 10.273 -0.571 1.00 0.00 H new ATOM 151 N VAL A1518 13.110 4.761 2.952 1.00 0.00 N ATOM 152 CA VAL A1518 13.555 4.724 4.324 1.00 0.00 C ATOM 153 C VAL A1518 15.032 4.446 4.348 1.00 0.00 C ATOM 154 O VAL A1518 15.502 3.514 3.710 1.00 0.00 O ATOM 155 CB VAL A1518 12.821 3.630 5.162 1.00 0.00 C ATOM 156 CG1 VAL A1518 13.298 3.644 6.612 1.00 0.00 C ATOM 157 CG2 VAL A1518 11.318 3.819 5.113 1.00 0.00 C ATOM 0 H VAL A1518 13.270 3.897 2.434 1.00 0.00 H new ATOM 0 HA VAL A1518 13.326 5.691 4.772 1.00 0.00 H new ATOM 0 HB VAL A1518 13.063 2.663 4.721 1.00 0.00 H new ATOM 0 HG11 VAL A1518 12.772 2.873 7.175 1.00 0.00 H new ATOM 0 HG12 VAL A1518 14.370 3.449 6.644 1.00 0.00 H new ATOM 0 HG13 VAL A1518 13.093 4.619 7.053 1.00 0.00 H new ATOM 0 HG21 VAL A1518 10.834 3.043 5.706 1.00 0.00 H new ATOM 0 HG22 VAL A1518 11.061 4.798 5.518 1.00 0.00 H new ATOM 0 HG23 VAL A1518 10.976 3.753 4.080 1.00 0.00 H new ATOM 167 N THR A1519 15.753 5.254 5.035 1.00 0.00 N ATOM 168 CA THR A1519 17.150 5.066 5.170 1.00 0.00 C ATOM 169 C THR A1519 17.413 4.472 6.542 1.00 0.00 C ATOM 170 O THR A1519 16.985 5.034 7.552 1.00 0.00 O ATOM 171 CB THR A1519 17.864 6.417 5.056 1.00 0.00 C ATOM 172 OG1 THR A1519 17.304 7.124 3.942 1.00 0.00 O ATOM 173 CG2 THR A1519 19.351 6.209 4.816 1.00 0.00 C ATOM 0 H THR A1519 15.387 6.071 5.524 1.00 0.00 H new ATOM 0 HA THR A1519 17.520 4.402 4.388 1.00 0.00 H new ATOM 0 HB THR A1519 17.734 6.981 5.980 1.00 0.00 H new ATOM 0 HG1 THR A1519 17.746 7.994 3.851 1.00 0.00 H new ATOM 0 HG21 THR A1519 19.846 7.177 4.737 1.00 0.00 H new ATOM 0 HG22 THR A1519 19.779 5.650 5.648 1.00 0.00 H new ATOM 0 HG23 THR A1519 19.496 5.651 3.891 1.00 0.00 H new ATOM 181 N ASN A1520 18.025 3.315 6.588 1.00 0.00 N ATOM 182 CA ASN A1520 18.396 2.737 7.863 1.00 0.00 C ATOM 183 C ASN A1520 19.849 3.075 8.119 1.00 0.00 C ATOM 184 O ASN A1520 20.731 2.475 7.514 1.00 0.00 O ATOM 185 CB ASN A1520 18.183 1.209 7.883 1.00 0.00 C ATOM 186 CG ASN A1520 18.555 0.589 9.229 1.00 0.00 C ATOM 187 OD1 ASN A1520 18.477 1.247 10.273 1.00 0.00 O ATOM 188 ND2 ASN A1520 18.935 -0.664 9.227 1.00 0.00 N ATOM 0 H ASN A1520 18.276 2.758 5.771 1.00 0.00 H new ATOM 0 HA ASN A1520 17.761 3.150 8.647 1.00 0.00 H new ATOM 0 HB2 ASN A1520 17.140 0.987 7.659 1.00 0.00 H new ATOM 0 HB3 ASN A1520 18.782 0.751 7.096 1.00 0.00 H new ATOM 0 HD21 ASN A1520 19.177 -1.125 10.104 1.00 0.00 H new ATOM 0 HD22 ASN A1520 18.989 -1.179 8.348 1.00 0.00 H new ATOM 195 N PRO A1521 20.121 4.038 9.030 1.00 0.00 N ATOM 196 CA PRO A1521 21.485 4.540 9.312 1.00 0.00 C ATOM 197 C PRO A1521 22.437 3.480 9.844 1.00 0.00 C ATOM 198 O PRO A1521 23.649 3.666 9.838 1.00 0.00 O ATOM 199 CB PRO A1521 21.271 5.618 10.377 1.00 0.00 C ATOM 200 CG PRO A1521 19.842 5.994 10.262 1.00 0.00 C ATOM 201 CD PRO A1521 19.121 4.751 9.842 1.00 0.00 C ATOM 0 HA PRO A1521 21.952 4.896 8.394 1.00 0.00 H new ATOM 0 HB2 PRO A1521 21.500 5.239 11.373 1.00 0.00 H new ATOM 0 HB3 PRO A1521 21.920 6.477 10.205 1.00 0.00 H new ATOM 0 HG2 PRO A1521 19.459 6.365 11.212 1.00 0.00 H new ATOM 0 HG3 PRO A1521 19.706 6.790 9.530 1.00 0.00 H new ATOM 0 HD2 PRO A1521 18.805 4.160 10.701 1.00 0.00 H new ATOM 0 HD3 PRO A1521 18.225 4.981 9.266 1.00 0.00 H new ATOM 209 N SER A1522 21.889 2.386 10.303 1.00 0.00 N ATOM 210 CA SER A1522 22.676 1.315 10.824 1.00 0.00 C ATOM 211 C SER A1522 23.502 0.651 9.705 1.00 0.00 C ATOM 212 O SER A1522 24.704 0.390 9.870 1.00 0.00 O ATOM 213 CB SER A1522 21.744 0.337 11.514 1.00 0.00 C ATOM 214 OG SER A1522 20.919 1.047 12.442 1.00 0.00 O ATOM 0 H SER A1522 20.883 2.218 10.323 1.00 0.00 H new ATOM 0 HA SER A1522 23.397 1.687 11.552 1.00 0.00 H new ATOM 0 HB2 SER A1522 21.125 -0.175 10.777 1.00 0.00 H new ATOM 0 HB3 SER A1522 22.321 -0.428 12.034 1.00 0.00 H new ATOM 0 HG SER A1522 20.058 1.253 12.023 1.00 0.00 H new ATOM 220 N THR A1523 22.882 0.412 8.568 1.00 0.00 N ATOM 221 CA THR A1523 23.576 -0.198 7.456 1.00 0.00 C ATOM 222 C THR A1523 23.747 0.773 6.278 1.00 0.00 C ATOM 223 O THR A1523 24.400 0.460 5.278 1.00 0.00 O ATOM 224 CB THR A1523 22.847 -1.464 7.008 1.00 0.00 C ATOM 225 OG1 THR A1523 21.436 -1.180 6.876 1.00 0.00 O ATOM 226 CG2 THR A1523 23.051 -2.586 8.012 1.00 0.00 C ATOM 0 H THR A1523 21.902 0.631 8.391 1.00 0.00 H new ATOM 0 HA THR A1523 24.575 -0.464 7.800 1.00 0.00 H new ATOM 0 HB THR A1523 23.253 -1.783 6.048 1.00 0.00 H new ATOM 0 HG1 THR A1523 21.145 -1.384 5.963 1.00 0.00 H new ATOM 0 HG21 THR A1523 22.523 -3.478 7.673 1.00 0.00 H new ATOM 0 HG22 THR A1523 24.115 -2.806 8.101 1.00 0.00 H new ATOM 0 HG23 THR A1523 22.661 -2.281 8.983 1.00 0.00 H new ATOM 234 N GLY A1524 23.141 1.949 6.409 1.00 0.00 N ATOM 235 CA GLY A1524 23.220 2.979 5.391 1.00 0.00 C ATOM 236 C GLY A1524 22.422 2.614 4.154 1.00 0.00 C ATOM 237 O GLY A1524 22.672 3.122 3.063 1.00 0.00 O ATOM 0 H GLY A1524 22.584 2.210 7.223 1.00 0.00 H new ATOM 0 HA2 GLY A1524 22.850 3.920 5.797 1.00 0.00 H new ATOM 0 HA3 GLY A1524 24.263 3.139 5.116 1.00 0.00 H new ATOM 241 N HIS A1525 21.455 1.745 4.322 1.00 0.00 N ATOM 242 CA HIS A1525 20.671 1.272 3.199 1.00 0.00 C ATOM 243 C HIS A1525 19.400 2.063 3.029 1.00 0.00 C ATOM 244 O HIS A1525 18.665 2.303 3.996 1.00 0.00 O ATOM 245 CB HIS A1525 20.367 -0.235 3.289 1.00 0.00 C ATOM 246 CG HIS A1525 21.574 -1.106 3.105 1.00 0.00 C ATOM 247 ND1 HIS A1525 21.876 -2.162 3.920 1.00 0.00 N ATOM 248 CD2 HIS A1525 22.544 -1.080 2.169 1.00 0.00 C ATOM 249 CE1 HIS A1525 22.976 -2.740 3.500 1.00 0.00 C ATOM 250 NE2 HIS A1525 23.398 -2.103 2.444 1.00 0.00 N ATOM 0 H HIS A1525 21.189 1.349 5.224 1.00 0.00 H new ATOM 0 HA HIS A1525 21.286 1.428 2.313 1.00 0.00 H new ATOM 0 HB2 HIS A1525 19.920 -0.449 4.260 1.00 0.00 H new ATOM 0 HB3 HIS A1525 19.625 -0.493 2.533 1.00 0.00 H new ATOM 0 HD2 HIS A1525 22.628 -0.378 1.353 1.00 0.00 H new ATOM 0 HE1 HIS A1525 23.451 -3.598 3.952 1.00 0.00 H new ATOM 0 HE2 HIS A1525 24.235 -2.334 1.909 1.00 0.00 H new ATOM 259 N LEU A1526 19.169 2.483 1.812 1.00 0.00 N ATOM 260 CA LEU A1526 17.990 3.207 1.436 1.00 0.00 C ATOM 261 C LEU A1526 17.002 2.224 0.837 1.00 0.00 C ATOM 262 O LEU A1526 17.230 1.686 -0.253 1.00 0.00 O ATOM 263 CB LEU A1526 18.347 4.285 0.399 1.00 0.00 C ATOM 264 CG LEU A1526 17.201 5.177 -0.097 1.00 0.00 C ATOM 265 CD1 LEU A1526 16.640 6.012 1.032 1.00 0.00 C ATOM 266 CD2 LEU A1526 17.666 6.064 -1.241 1.00 0.00 C ATOM 0 H LEU A1526 19.814 2.325 1.038 1.00 0.00 H new ATOM 0 HA LEU A1526 17.554 3.695 2.308 1.00 0.00 H new ATOM 0 HB2 LEU A1526 19.116 4.928 0.828 1.00 0.00 H new ATOM 0 HB3 LEU A1526 18.791 3.791 -0.465 1.00 0.00 H new ATOM 0 HG LEU A1526 16.406 4.530 -0.467 1.00 0.00 H new ATOM 0 HD11 LEU A1526 15.829 6.636 0.655 1.00 0.00 H new ATOM 0 HD12 LEU A1526 16.260 5.356 1.815 1.00 0.00 H new ATOM 0 HD13 LEU A1526 17.426 6.647 1.440 1.00 0.00 H new ATOM 0 HD21 LEU A1526 16.838 6.688 -1.577 1.00 0.00 H new ATOM 0 HD22 LEU A1526 18.484 6.699 -0.900 1.00 0.00 H new ATOM 0 HD23 LEU A1526 18.010 5.442 -2.067 1.00 0.00 H new ATOM 278 N PHE A1527 15.960 1.957 1.554 1.00 0.00 N ATOM 279 CA PHE A1527 14.927 1.057 1.110 1.00 0.00 C ATOM 280 C PHE A1527 13.860 1.875 0.426 1.00 0.00 C ATOM 281 O PHE A1527 13.205 2.706 1.068 1.00 0.00 O ATOM 282 CB PHE A1527 14.316 0.298 2.298 1.00 0.00 C ATOM 283 CG PHE A1527 15.308 -0.501 3.099 1.00 0.00 C ATOM 284 CD1 PHE A1527 15.718 -1.750 2.670 1.00 0.00 C ATOM 285 CD2 PHE A1527 15.828 0.000 4.284 1.00 0.00 C ATOM 286 CE1 PHE A1527 16.624 -2.485 3.403 1.00 0.00 C ATOM 287 CE2 PHE A1527 16.737 -0.733 5.021 1.00 0.00 C ATOM 288 CZ PHE A1527 17.136 -1.977 4.580 1.00 0.00 C ATOM 0 H PHE A1527 15.793 2.358 2.477 1.00 0.00 H new ATOM 0 HA PHE A1527 15.350 0.322 0.425 1.00 0.00 H new ATOM 0 HB2 PHE A1527 13.826 1.014 2.958 1.00 0.00 H new ATOM 0 HB3 PHE A1527 13.542 -0.374 1.926 1.00 0.00 H new ATOM 0 HD1 PHE A1527 15.323 -2.154 1.749 1.00 0.00 H new ATOM 0 HD2 PHE A1527 15.518 0.974 4.634 1.00 0.00 H new ATOM 0 HE1 PHE A1527 16.934 -3.460 3.056 1.00 0.00 H new ATOM 0 HE2 PHE A1527 17.135 -0.332 5.942 1.00 0.00 H new ATOM 0 HZ PHE A1527 17.847 -2.552 5.154 1.00 0.00 H new ATOM 298 N ASP A1528 13.719 1.692 -0.852 1.00 0.00 N ATOM 299 CA ASP A1528 12.732 2.423 -1.622 1.00 0.00 C ATOM 300 C ASP A1528 11.880 1.436 -2.380 1.00 0.00 C ATOM 301 O ASP A1528 12.273 0.281 -2.576 1.00 0.00 O ATOM 302 CB ASP A1528 13.398 3.402 -2.608 1.00 0.00 C ATOM 303 CG ASP A1528 13.959 2.723 -3.835 1.00 0.00 C ATOM 304 OD1 ASP A1528 15.061 2.169 -3.781 1.00 0.00 O ATOM 305 OD2 ASP A1528 13.298 2.749 -4.889 1.00 0.00 O1- ATOM 0 H ASP A1528 14.278 1.036 -1.398 1.00 0.00 H new ATOM 0 HA ASP A1528 12.118 3.009 -0.938 1.00 0.00 H new ATOM 0 HB2 ASP A1528 12.667 4.149 -2.917 1.00 0.00 H new ATOM 0 HB3 ASP A1528 14.200 3.933 -2.096 1.00 0.00 H new ATOM 310 N LEU A1529 10.729 1.870 -2.792 1.00 0.00 N ATOM 311 CA LEU A1529 9.813 1.019 -3.512 1.00 0.00 C ATOM 312 C LEU A1529 9.508 1.581 -4.886 1.00 0.00 C ATOM 313 O LEU A1529 8.441 1.327 -5.443 1.00 0.00 O ATOM 314 CB LEU A1529 8.524 0.832 -2.714 1.00 0.00 C ATOM 315 CG LEU A1529 8.642 0.052 -1.402 1.00 0.00 C ATOM 316 CD1 LEU A1529 7.307 0.022 -0.691 1.00 0.00 C ATOM 317 CD2 LEU A1529 9.134 -1.371 -1.661 1.00 0.00 C ATOM 0 H LEU A1529 10.392 2.821 -2.643 1.00 0.00 H new ATOM 0 HA LEU A1529 10.289 0.047 -3.645 1.00 0.00 H new ATOM 0 HB2 LEU A1529 8.115 1.817 -2.490 1.00 0.00 H new ATOM 0 HB3 LEU A1529 7.799 0.323 -3.350 1.00 0.00 H new ATOM 0 HG LEU A1529 9.370 0.556 -0.767 1.00 0.00 H new ATOM 0 HD11 LEU A1529 7.403 -0.535 0.241 1.00 0.00 H new ATOM 0 HD12 LEU A1529 6.988 1.041 -0.473 1.00 0.00 H new ATOM 0 HD13 LEU A1529 6.566 -0.461 -1.328 1.00 0.00 H new ATOM 0 HD21 LEU A1529 9.211 -1.907 -0.715 1.00 0.00 H new ATOM 0 HD22 LEU A1529 8.430 -1.886 -2.314 1.00 0.00 H new ATOM 0 HD23 LEU A1529 10.113 -1.336 -2.139 1.00 0.00 H new ATOM 329 N SER A1530 10.452 2.319 -5.447 1.00 0.00 N ATOM 330 CA SER A1530 10.248 2.981 -6.738 1.00 0.00 C ATOM 331 C SER A1530 9.982 1.964 -7.856 1.00 0.00 C ATOM 332 O SER A1530 9.101 2.166 -8.697 1.00 0.00 O ATOM 333 CB SER A1530 11.464 3.823 -7.083 1.00 0.00 C ATOM 334 OG SER A1530 11.831 4.634 -5.978 1.00 0.00 O ATOM 0 H SER A1530 11.370 2.479 -5.033 1.00 0.00 H new ATOM 0 HA SER A1530 9.371 3.622 -6.653 1.00 0.00 H new ATOM 0 HB2 SER A1530 12.296 3.176 -7.360 1.00 0.00 H new ATOM 0 HB3 SER A1530 11.247 4.451 -7.947 1.00 0.00 H new ATOM 0 HG SER A1530 12.571 4.212 -5.494 1.00 0.00 H new ATOM 340 N SER A1531 10.692 0.842 -7.809 1.00 0.00 N ATOM 341 CA SER A1531 10.588 -0.203 -8.815 1.00 0.00 C ATOM 342 C SER A1531 9.164 -0.812 -8.884 1.00 0.00 C ATOM 343 O SER A1531 8.760 -1.364 -9.906 1.00 0.00 O ATOM 344 CB SER A1531 11.627 -1.275 -8.513 1.00 0.00 C ATOM 345 OG SER A1531 12.911 -0.673 -8.332 1.00 0.00 O ATOM 0 H SER A1531 11.359 0.633 -7.066 1.00 0.00 H new ATOM 0 HA SER A1531 10.779 0.235 -9.795 1.00 0.00 H new ATOM 0 HB2 SER A1531 11.344 -1.825 -7.615 1.00 0.00 H new ATOM 0 HB3 SER A1531 11.666 -1.996 -9.330 1.00 0.00 H new ATOM 0 HG SER A1531 13.574 -1.368 -8.136 1.00 0.00 H new ATOM 351 N LEU A1532 8.409 -0.685 -7.807 1.00 0.00 N ATOM 352 CA LEU A1532 7.066 -1.217 -7.777 1.00 0.00 C ATOM 353 C LEU A1532 6.029 -0.126 -7.523 1.00 0.00 C ATOM 354 O LEU A1532 4.884 -0.401 -7.198 1.00 0.00 O ATOM 355 CB LEU A1532 6.962 -2.434 -6.815 1.00 0.00 C ATOM 356 CG LEU A1532 7.392 -2.250 -5.341 1.00 0.00 C ATOM 357 CD1 LEU A1532 6.308 -1.605 -4.495 1.00 0.00 C ATOM 358 CD2 LEU A1532 7.812 -3.573 -4.745 1.00 0.00 C ATOM 0 H LEU A1532 8.704 -0.220 -6.948 1.00 0.00 H new ATOM 0 HA LEU A1532 6.829 -1.606 -8.767 1.00 0.00 H new ATOM 0 HB2 LEU A1532 5.925 -2.771 -6.818 1.00 0.00 H new ATOM 0 HB3 LEU A1532 7.561 -3.241 -7.236 1.00 0.00 H new ATOM 0 HG LEU A1532 8.244 -1.570 -5.339 1.00 0.00 H new ATOM 0 HD11 LEU A1532 6.662 -1.499 -3.469 1.00 0.00 H new ATOM 0 HD12 LEU A1532 6.068 -0.622 -4.899 1.00 0.00 H new ATOM 0 HD13 LEU A1532 5.416 -2.231 -4.508 1.00 0.00 H new ATOM 0 HD21 LEU A1532 8.112 -3.426 -3.707 1.00 0.00 H new ATOM 0 HD22 LEU A1532 6.977 -4.272 -4.786 1.00 0.00 H new ATOM 0 HD23 LEU A1532 8.651 -3.977 -5.311 1.00 0.00 H new ATOM 370 N SER A1533 6.436 1.117 -7.708 1.00 0.00 N ATOM 371 CA SER A1533 5.563 2.231 -7.476 1.00 0.00 C ATOM 372 C SER A1533 4.823 2.559 -8.761 1.00 0.00 C ATOM 373 O SER A1533 5.444 2.836 -9.805 1.00 0.00 O ATOM 374 CB SER A1533 6.360 3.449 -6.968 1.00 0.00 C ATOM 375 OG SER A1533 5.506 4.546 -6.622 1.00 0.00 O ATOM 0 H SER A1533 7.373 1.371 -8.020 1.00 0.00 H new ATOM 0 HA SER A1533 4.838 1.970 -6.705 1.00 0.00 H new ATOM 0 HB2 SER A1533 6.948 3.159 -6.097 1.00 0.00 H new ATOM 0 HB3 SER A1533 7.064 3.767 -7.737 1.00 0.00 H new ATOM 0 HG SER A1533 4.596 4.216 -6.468 1.00 0.00 H new ATOM 381 N GLY A1534 3.524 2.487 -8.697 1.00 0.00 N ATOM 382 CA GLY A1534 2.707 2.771 -9.824 1.00 0.00 C ATOM 383 C GLY A1534 1.484 3.531 -9.405 1.00 0.00 C ATOM 384 O GLY A1534 0.774 3.092 -8.488 1.00 0.00 O ATOM 0 H GLY A1534 3.008 2.228 -7.856 1.00 0.00 H new ATOM 0 HA2 GLY A1534 3.272 3.352 -10.553 1.00 0.00 H new ATOM 0 HA3 GLY A1534 2.416 1.842 -10.313 1.00 0.00 H new ATOM 388 N ARG A1535 1.235 4.665 -10.050 1.00 0.00 N ATOM 389 CA ARG A1535 0.092 5.515 -9.719 1.00 0.00 C ATOM 390 C ARG A1535 -1.176 5.031 -10.399 1.00 0.00 C ATOM 391 O ARG A1535 -2.287 5.413 -10.023 1.00 0.00 O ATOM 392 CB ARG A1535 0.360 6.974 -10.074 1.00 0.00 C ATOM 393 CG ARG A1535 0.598 7.240 -11.554 1.00 0.00 C ATOM 394 CD ARG A1535 0.869 8.713 -11.804 1.00 0.00 C ATOM 395 NE ARG A1535 2.111 9.175 -11.155 1.00 0.00 N ATOM 396 CZ ARG A1535 2.179 9.950 -10.055 1.00 0.00 C ATOM 397 NH1 ARG A1535 1.076 10.256 -9.369 1.00 0.00 N1+ ATOM 398 NH2 ARG A1535 3.355 10.380 -9.631 1.00 0.00 N ATOM 0 H ARG A1535 1.813 5.021 -10.811 1.00 0.00 H new ATOM 0 HA ARG A1535 -0.053 5.448 -8.641 1.00 0.00 H new ATOM 0 HB2 ARG A1535 -0.487 7.575 -9.743 1.00 0.00 H new ATOM 0 HB3 ARG A1535 1.231 7.315 -9.514 1.00 0.00 H new ATOM 0 HG2 ARG A1535 1.443 6.647 -11.903 1.00 0.00 H new ATOM 0 HG3 ARG A1535 -0.272 6.924 -12.129 1.00 0.00 H new ATOM 0 HD2 ARG A1535 0.936 8.890 -12.877 1.00 0.00 H new ATOM 0 HD3 ARG A1535 0.029 9.302 -11.435 1.00 0.00 H new ATOM 0 HE ARG A1535 2.993 8.883 -11.575 1.00 0.00 H new ATOM 0 HH11 ARG A1535 0.170 9.902 -9.676 1.00 0.00 H new ATOM 0 HH12 ARG A1535 1.139 10.844 -8.538 1.00 0.00 H new ATOM 0 HH21 ARG A1535 4.204 10.125 -10.136 1.00 0.00 H new ATOM 0 HH22 ARG A1535 3.414 10.967 -8.799 1.00 0.00 H new ATOM 412 N ALA A1536 -1.025 4.209 -11.423 1.00 0.00 N ATOM 413 CA ALA A1536 -2.186 3.630 -12.053 1.00 0.00 C ATOM 414 C ALA A1536 -2.742 2.591 -11.110 1.00 0.00 C ATOM 415 O ALA A1536 -3.950 2.388 -11.001 1.00 0.00 O ATOM 416 CB ALA A1536 -1.857 3.028 -13.411 1.00 0.00 C ATOM 0 H ALA A1536 -0.128 3.935 -11.825 1.00 0.00 H new ATOM 0 HA ALA A1536 -2.928 4.405 -12.245 1.00 0.00 H new ATOM 0 HB1 ALA A1536 -2.760 2.603 -13.849 1.00 0.00 H new ATOM 0 HB2 ALA A1536 -1.465 3.805 -14.068 1.00 0.00 H new ATOM 0 HB3 ALA A1536 -1.109 2.244 -13.290 1.00 0.00 H new ATOM 422 N GLY A1537 -1.827 1.973 -10.399 1.00 0.00 N ATOM 423 CA GLY A1537 -2.151 1.048 -9.384 1.00 0.00 C ATOM 424 C GLY A1537 -2.292 -0.338 -9.895 1.00 0.00 C ATOM 425 O GLY A1537 -1.842 -0.661 -11.005 1.00 0.00 O ATOM 0 H GLY A1537 -0.825 2.114 -10.526 1.00 0.00 H new ATOM 0 HA2 GLY A1537 -1.377 1.071 -8.617 1.00 0.00 H new ATOM 0 HA3 GLY A1537 -3.083 1.351 -8.906 1.00 0.00 H new ATOM 429 N PHE A1538 -2.859 -1.160 -9.079 1.00 0.00 N ATOM 430 CA PHE A1538 -3.147 -2.520 -9.398 1.00 0.00 C ATOM 431 C PHE A1538 -4.564 -2.775 -8.967 1.00 0.00 C ATOM 432 O PHE A1538 -4.973 -2.314 -7.894 1.00 0.00 O ATOM 433 CB PHE A1538 -2.181 -3.474 -8.660 1.00 0.00 C ATOM 434 CG PHE A1538 -0.727 -3.289 -9.027 1.00 0.00 C ATOM 435 CD1 PHE A1538 -0.171 -3.997 -10.077 1.00 0.00 C ATOM 436 CD2 PHE A1538 0.076 -2.404 -8.323 1.00 0.00 C ATOM 437 CE1 PHE A1538 1.157 -3.828 -10.418 1.00 0.00 C ATOM 438 CE2 PHE A1538 1.404 -2.231 -8.661 1.00 0.00 C ATOM 439 CZ PHE A1538 1.945 -2.944 -9.708 1.00 0.00 C ATOM 0 H PHE A1538 -3.146 -0.895 -8.137 1.00 0.00 H new ATOM 0 HA PHE A1538 -3.022 -2.700 -10.466 1.00 0.00 H new ATOM 0 HB2 PHE A1538 -2.294 -3.328 -7.586 1.00 0.00 H new ATOM 0 HB3 PHE A1538 -2.470 -4.503 -8.874 1.00 0.00 H new ATOM 0 HD1 PHE A1538 -0.782 -4.690 -10.637 1.00 0.00 H new ATOM 0 HD2 PHE A1538 -0.342 -1.843 -7.500 1.00 0.00 H new ATOM 0 HE1 PHE A1538 1.579 -4.387 -11.240 1.00 0.00 H new ATOM 0 HE2 PHE A1538 2.017 -1.538 -8.105 1.00 0.00 H new ATOM 0 HZ PHE A1538 2.984 -2.812 -9.973 1.00 0.00 H new ATOM 449 N THR A1539 -5.320 -3.420 -9.794 1.00 0.00 N ATOM 450 CA THR A1539 -6.677 -3.720 -9.474 1.00 0.00 C ATOM 451 C THR A1539 -6.788 -5.197 -9.141 1.00 0.00 C ATOM 452 O THR A1539 -6.672 -6.055 -10.032 1.00 0.00 O ATOM 453 CB THR A1539 -7.586 -3.394 -10.666 1.00 0.00 C ATOM 454 OG1 THR A1539 -7.283 -2.072 -11.146 1.00 0.00 O ATOM 455 CG2 THR A1539 -9.054 -3.453 -10.255 1.00 0.00 C ATOM 0 H THR A1539 -5.015 -3.753 -10.709 1.00 0.00 H new ATOM 0 HA THR A1539 -6.989 -3.119 -8.620 1.00 0.00 H new ATOM 0 HB THR A1539 -7.411 -4.129 -11.451 1.00 0.00 H new ATOM 0 HG1 THR A1539 -7.940 -1.437 -10.791 1.00 0.00 H new ATOM 0 HG21 THR A1539 -9.682 -3.219 -11.114 1.00 0.00 H new ATOM 0 HG22 THR A1539 -9.291 -4.454 -9.894 1.00 0.00 H new ATOM 0 HG23 THR A1539 -9.239 -2.728 -9.462 1.00 0.00 H new ATOM 463 N ALA A1540 -6.974 -5.494 -7.887 1.00 0.00 N ATOM 464 CA ALA A1540 -7.099 -6.858 -7.461 1.00 0.00 C ATOM 465 C ALA A1540 -8.526 -7.322 -7.655 1.00 0.00 C ATOM 466 O ALA A1540 -9.478 -6.622 -7.264 1.00 0.00 O ATOM 467 CB ALA A1540 -6.660 -7.018 -6.015 1.00 0.00 C ATOM 0 H ALA A1540 -7.043 -4.805 -7.138 1.00 0.00 H new ATOM 0 HA ALA A1540 -6.443 -7.481 -8.069 1.00 0.00 H new ATOM 0 HB1 ALA A1540 -6.764 -8.061 -5.716 1.00 0.00 H new ATOM 0 HB2 ALA A1540 -5.618 -6.715 -5.915 1.00 0.00 H new ATOM 0 HB3 ALA A1540 -7.282 -6.393 -5.375 1.00 0.00 H new ATOM 473 N ALA A1541 -8.673 -8.459 -8.295 1.00 0.00 N ATOM 474 CA ALA A1541 -9.964 -9.037 -8.551 1.00 0.00 C ATOM 475 C ALA A1541 -10.501 -9.658 -7.283 1.00 0.00 C ATOM 476 O ALA A1541 -9.936 -10.631 -6.769 1.00 0.00 O ATOM 477 CB ALA A1541 -9.869 -10.076 -9.657 1.00 0.00 C ATOM 0 H ALA A1541 -7.893 -9.009 -8.653 1.00 0.00 H new ATOM 0 HA ALA A1541 -10.648 -8.254 -8.879 1.00 0.00 H new ATOM 0 HB1 ALA A1541 -10.855 -10.505 -9.839 1.00 0.00 H new ATOM 0 HB2 ALA A1541 -9.504 -9.604 -10.569 1.00 0.00 H new ATOM 0 HB3 ALA A1541 -9.180 -10.865 -9.356 1.00 0.00 H new ATOM 483 N TYR A1542 -11.534 -9.082 -6.753 1.00 0.00 N ATOM 484 CA TYR A1542 -12.136 -9.564 -5.549 1.00 0.00 C ATOM 485 C TYR A1542 -13.508 -10.141 -5.881 1.00 0.00 C ATOM 486 O TYR A1542 -14.458 -9.392 -6.178 1.00 0.00 O ATOM 487 CB TYR A1542 -12.225 -8.408 -4.536 1.00 0.00 C ATOM 488 CG TYR A1542 -12.782 -8.754 -3.167 1.00 0.00 C ATOM 489 CD1 TYR A1542 -14.147 -8.718 -2.915 1.00 0.00 C ATOM 490 CD2 TYR A1542 -11.934 -9.072 -2.116 1.00 0.00 C ATOM 491 CE1 TYR A1542 -14.649 -8.993 -1.666 1.00 0.00 C ATOM 492 CE2 TYR A1542 -12.433 -9.357 -0.860 1.00 0.00 C ATOM 493 CZ TYR A1542 -13.787 -9.314 -0.641 1.00 0.00 C ATOM 494 OH TYR A1542 -14.292 -9.587 0.617 1.00 0.00 O ATOM 0 H TYR A1542 -11.987 -8.257 -7.147 1.00 0.00 H new ATOM 0 HA TYR A1542 -11.537 -10.356 -5.100 1.00 0.00 H new ATOM 0 HB2 TYR A1542 -11.226 -7.992 -4.404 1.00 0.00 H new ATOM 0 HB3 TYR A1542 -12.844 -7.621 -4.968 1.00 0.00 H new ATOM 0 HD1 TYR A1542 -14.827 -8.469 -3.716 1.00 0.00 H new ATOM 0 HD2 TYR A1542 -10.867 -9.097 -2.283 1.00 0.00 H new ATOM 0 HE1 TYR A1542 -15.714 -8.958 -1.489 1.00 0.00 H new ATOM 0 HE2 TYR A1542 -11.761 -9.612 -0.054 1.00 0.00 H new ATOM 0 HH TYR A1542 -13.554 -9.797 1.227 1.00 0.00 H new ATOM 567 N GLY A1547 -13.349 -4.451 -7.683 1.00 0.00 N ATOM 568 CA GLY A1547 -12.043 -4.153 -8.142 1.00 0.00 C ATOM 569 C GLY A1547 -11.424 -3.140 -7.255 1.00 0.00 C ATOM 570 O GLY A1547 -11.786 -1.973 -7.301 1.00 0.00 O ATOM 0 HA2 GLY A1547 -11.436 -5.058 -8.156 1.00 0.00 H new ATOM 0 HA3 GLY A1547 -12.083 -3.780 -9.165 1.00 0.00 H new ATOM 574 N VAL A1548 -10.552 -3.567 -6.402 1.00 0.00 N ATOM 575 CA VAL A1548 -9.895 -2.643 -5.528 1.00 0.00 C ATOM 576 C VAL A1548 -8.715 -2.007 -6.260 1.00 0.00 C ATOM 577 O VAL A1548 -7.774 -2.687 -6.668 1.00 0.00 O ATOM 578 CB VAL A1548 -9.498 -3.284 -4.147 1.00 0.00 C ATOM 579 CG1 VAL A1548 -8.616 -4.512 -4.305 1.00 0.00 C ATOM 580 CG2 VAL A1548 -8.840 -2.263 -3.227 1.00 0.00 C ATOM 0 H VAL A1548 -10.277 -4.543 -6.289 1.00 0.00 H new ATOM 0 HA VAL A1548 -10.598 -1.853 -5.265 1.00 0.00 H new ATOM 0 HB VAL A1548 -10.428 -3.614 -3.684 1.00 0.00 H new ATOM 0 HG11 VAL A1548 -8.372 -4.914 -3.322 1.00 0.00 H new ATOM 0 HG12 VAL A1548 -9.145 -5.268 -4.885 1.00 0.00 H new ATOM 0 HG13 VAL A1548 -7.697 -4.236 -4.822 1.00 0.00 H new ATOM 0 HG21 VAL A1548 -8.579 -2.740 -2.282 1.00 0.00 H new ATOM 0 HG22 VAL A1548 -7.937 -1.876 -3.700 1.00 0.00 H new ATOM 0 HG23 VAL A1548 -9.532 -1.442 -3.040 1.00 0.00 H new ATOM 590 N TYR A1549 -8.828 -0.724 -6.495 1.00 0.00 N ATOM 591 CA TYR A1549 -7.825 0.023 -7.200 1.00 0.00 C ATOM 592 C TYR A1549 -6.886 0.578 -6.182 1.00 0.00 C ATOM 593 O TYR A1549 -7.222 1.521 -5.469 1.00 0.00 O ATOM 594 CB TYR A1549 -8.451 1.184 -7.987 1.00 0.00 C ATOM 595 CG TYR A1549 -9.564 0.786 -8.927 1.00 0.00 C ATOM 596 CD1 TYR A1549 -9.293 0.334 -10.209 1.00 0.00 C ATOM 597 CD2 TYR A1549 -10.894 0.871 -8.532 1.00 0.00 C ATOM 598 CE1 TYR A1549 -10.309 -0.020 -11.067 1.00 0.00 C ATOM 599 CE2 TYR A1549 -11.912 0.516 -9.385 1.00 0.00 C ATOM 600 CZ TYR A1549 -11.616 0.072 -10.649 1.00 0.00 C ATOM 601 OH TYR A1549 -12.634 -0.268 -11.506 1.00 0.00 O ATOM 0 H TYR A1549 -9.628 -0.166 -6.198 1.00 0.00 H new ATOM 0 HA TYR A1549 -7.314 -0.628 -7.909 1.00 0.00 H new ATOM 0 HB2 TYR A1549 -8.837 1.917 -7.279 1.00 0.00 H new ATOM 0 HB3 TYR A1549 -7.668 1.678 -8.562 1.00 0.00 H new ATOM 0 HD1 TYR A1549 -8.268 0.258 -10.540 1.00 0.00 H new ATOM 0 HD2 TYR A1549 -11.132 1.222 -7.539 1.00 0.00 H new ATOM 0 HE1 TYR A1549 -10.081 -0.368 -12.064 1.00 0.00 H new ATOM 0 HE2 TYR A1549 -12.940 0.586 -9.062 1.00 0.00 H new ATOM 0 HH TYR A1549 -13.054 -1.099 -11.201 1.00 0.00 H new ATOM 611 N MET A1550 -5.749 -0.001 -6.087 1.00 0.00 N ATOM 612 CA MET A1550 -4.789 0.407 -5.107 1.00 0.00 C ATOM 613 C MET A1550 -3.520 0.873 -5.778 1.00 0.00 C ATOM 614 O MET A1550 -2.910 0.140 -6.555 1.00 0.00 O ATOM 615 CB MET A1550 -4.559 -0.732 -4.093 1.00 0.00 C ATOM 616 CG MET A1550 -4.107 -2.058 -4.710 1.00 0.00 C ATOM 617 SD MET A1550 -4.206 -3.450 -3.562 1.00 0.00 S ATOM 618 CE MET A1550 -3.181 -2.865 -2.226 1.00 0.00 C ATOM 0 H MET A1550 -5.447 -0.773 -6.682 1.00 0.00 H new ATOM 0 HA MET A1550 -5.170 1.259 -4.544 1.00 0.00 H new ATOM 0 HB2 MET A1550 -3.810 -0.410 -3.370 1.00 0.00 H new ATOM 0 HB3 MET A1550 -5.484 -0.901 -3.541 1.00 0.00 H new ATOM 0 HG2 MET A1550 -4.722 -2.272 -5.584 1.00 0.00 H new ATOM 0 HG3 MET A1550 -3.080 -1.957 -5.060 1.00 0.00 H new ATOM 0 HE1 MET A1550 -2.999 -3.679 -1.524 1.00 0.00 H new ATOM 0 HE2 MET A1550 -2.231 -2.511 -2.625 1.00 0.00 H new ATOM 0 HE3 MET A1550 -3.686 -2.048 -1.711 1.00 0.00 H new ATOM 628 N SER A1551 -3.179 2.111 -5.538 1.00 0.00 N ATOM 629 CA SER A1551 -1.999 2.716 -6.086 1.00 0.00 C ATOM 630 C SER A1551 -0.852 2.466 -5.145 1.00 0.00 C ATOM 631 O SER A1551 -1.049 2.392 -3.928 1.00 0.00 O ATOM 632 CB SER A1551 -2.235 4.220 -6.263 1.00 0.00 C ATOM 633 OG SER A1551 -1.117 4.894 -6.789 1.00 0.00 O ATOM 0 H SER A1551 -3.725 2.737 -4.945 1.00 0.00 H new ATOM 0 HA SER A1551 -1.765 2.286 -7.060 1.00 0.00 H new ATOM 0 HB2 SER A1551 -3.088 4.373 -6.924 1.00 0.00 H new ATOM 0 HB3 SER A1551 -2.496 4.657 -5.299 1.00 0.00 H new ATOM 0 HG SER A1551 -0.537 5.188 -6.056 1.00 0.00 H new ATOM 639 N ILE A1552 0.324 2.324 -5.681 1.00 0.00 N ATOM 640 CA ILE A1552 1.462 2.069 -4.862 1.00 0.00 C ATOM 641 C ILE A1552 2.350 3.290 -4.856 1.00 0.00 C ATOM 642 O ILE A1552 3.109 3.540 -5.812 1.00 0.00 O ATOM 643 CB ILE A1552 2.264 0.815 -5.306 1.00 0.00 C ATOM 644 CG1 ILE A1552 1.355 -0.436 -5.376 1.00 0.00 C ATOM 645 CG2 ILE A1552 3.429 0.565 -4.347 1.00 0.00 C ATOM 646 CD1 ILE A1552 0.690 -0.820 -4.058 1.00 0.00 C ATOM 0 H ILE A1552 0.516 2.381 -6.681 1.00 0.00 H new ATOM 0 HA ILE A1552 1.102 1.857 -3.855 1.00 0.00 H new ATOM 0 HB ILE A1552 2.658 1.004 -6.305 1.00 0.00 H new ATOM 0 HG12 ILE A1552 0.579 -0.262 -6.121 1.00 0.00 H new ATOM 0 HG13 ILE A1552 1.949 -1.280 -5.726 1.00 0.00 H new ATOM 0 HG21 ILE A1552 3.983 -0.317 -4.669 1.00 0.00 H new ATOM 0 HG22 ILE A1552 4.092 1.430 -4.347 1.00 0.00 H new ATOM 0 HG23 ILE A1552 3.043 0.403 -3.340 1.00 0.00 H new ATOM 0 HD11 ILE A1552 0.074 -1.707 -4.206 1.00 0.00 H new ATOM 0 HD12 ILE A1552 1.456 -1.031 -3.312 1.00 0.00 H new ATOM 0 HD13 ILE A1552 0.064 0.003 -3.713 1.00 0.00 H new ATOM 658 N CYS A1553 2.205 4.059 -3.800 1.00 0.00 N ATOM 659 CA CYS A1553 2.978 5.258 -3.540 1.00 0.00 C ATOM 660 C CYS A1553 2.636 6.358 -4.547 1.00 0.00 C ATOM 661 O CYS A1553 3.491 6.833 -5.301 1.00 0.00 O ATOM 662 CB CYS A1553 4.487 4.945 -3.517 1.00 0.00 C ATOM 663 SG CYS A1553 5.531 6.293 -2.895 1.00 0.00 S ATOM 0 H CYS A1553 1.521 3.861 -3.070 1.00 0.00 H new ATOM 0 HA CYS A1553 2.711 5.632 -2.552 1.00 0.00 H new ATOM 0 HB2 CYS A1553 4.652 4.062 -2.900 1.00 0.00 H new ATOM 0 HB3 CYS A1553 4.807 4.692 -4.528 1.00 0.00 H new ATOM 668 N GLY A1554 1.379 6.736 -4.568 1.00 0.00 N ATOM 669 CA GLY A1554 0.924 7.776 -5.441 1.00 0.00 C ATOM 670 C GLY A1554 -0.569 7.822 -5.448 1.00 0.00 C ATOM 671 O GLY A1554 -1.210 6.962 -4.835 1.00 0.00 O ATOM 0 H GLY A1554 0.651 6.329 -3.981 1.00 0.00 H new ATOM 0 HA2 GLY A1554 1.324 8.736 -5.115 1.00 0.00 H new ATOM 0 HA3 GLY A1554 1.295 7.602 -6.451 1.00 0.00 H new ATOM 675 N GLU A1555 -1.124 8.802 -6.101 1.00 0.00 N ATOM 676 CA GLU A1555 -2.560 8.940 -6.209 1.00 0.00 C ATOM 677 C GLU A1555 -3.028 8.017 -7.315 1.00 0.00 C ATOM 678 O GLU A1555 -2.408 7.975 -8.382 1.00 0.00 O ATOM 679 CB GLU A1555 -2.972 10.392 -6.551 1.00 0.00 C ATOM 680 CG GLU A1555 -2.109 11.499 -5.932 1.00 0.00 C ATOM 681 CD GLU A1555 -0.853 11.798 -6.744 1.00 0.00 C ATOM 682 OE1 GLU A1555 0.163 11.085 -6.607 1.00 0.00 O1- ATOM 683 OE2 GLU A1555 -0.870 12.738 -7.549 1.00 0.00 O ATOM 0 H GLU A1555 -0.597 9.534 -6.578 1.00 0.00 H new ATOM 0 HA GLU A1555 -3.016 8.685 -5.252 1.00 0.00 H new ATOM 0 HB2 GLU A1555 -2.954 10.508 -7.635 1.00 0.00 H new ATOM 0 HB3 GLU A1555 -4.003 10.541 -6.231 1.00 0.00 H new ATOM 0 HG2 GLU A1555 -2.703 12.409 -5.843 1.00 0.00 H new ATOM 0 HG3 GLU A1555 -1.821 11.206 -4.922 1.00 0.00 H new ATOM 690 N ASN A1556 -4.102 7.303 -7.082 1.00 0.00 N ATOM 691 CA ASN A1556 -4.573 6.310 -8.042 1.00 0.00 C ATOM 692 C ASN A1556 -5.321 6.974 -9.190 1.00 0.00 C ATOM 693 O ASN A1556 -6.218 7.782 -8.969 1.00 0.00 O ATOM 694 CB ASN A1556 -5.476 5.272 -7.370 1.00 0.00 C ATOM 695 CG ASN A1556 -5.801 4.115 -8.299 1.00 0.00 C ATOM 696 OD1 ASN A1556 -6.751 4.168 -9.070 1.00 0.00 O ATOM 697 ND2 ASN A1556 -5.030 3.059 -8.220 1.00 0.00 N ATOM 0 H ASN A1556 -4.672 7.384 -6.240 1.00 0.00 H new ATOM 0 HA ASN A1556 -3.694 5.802 -8.439 1.00 0.00 H new ATOM 0 HB2 ASN A1556 -4.986 4.891 -6.474 1.00 0.00 H new ATOM 0 HB3 ASN A1556 -6.401 5.750 -7.049 1.00 0.00 H new ATOM 0 HD21 ASN A1556 -5.213 2.248 -8.812 1.00 0.00 H new ATOM 0 HD22 ASN A1556 -4.247 3.047 -7.567 1.00 0.00 H new ATOM 704 N GLU A1557 -4.940 6.629 -10.403 1.00 0.00 N ATOM 705 CA GLU A1557 -5.524 7.192 -11.633 1.00 0.00 C ATOM 706 C GLU A1557 -7.004 6.842 -11.877 1.00 0.00 C ATOM 707 O GLU A1557 -7.668 7.475 -12.709 1.00 0.00 O ATOM 708 CB GLU A1557 -4.671 6.834 -12.842 1.00 0.00 C ATOM 709 CG GLU A1557 -3.329 7.542 -12.856 1.00 0.00 C ATOM 710 CD GLU A1557 -3.500 9.039 -12.935 1.00 0.00 C ATOM 711 OE1 GLU A1557 -3.670 9.569 -14.056 1.00 0.00 O ATOM 712 OE2 GLU A1557 -3.508 9.715 -11.890 1.00 0.00 O1- ATOM 0 H GLU A1557 -4.207 5.942 -10.579 1.00 0.00 H new ATOM 0 HA GLU A1557 -5.519 8.272 -11.482 1.00 0.00 H new ATOM 0 HB2 GLU A1557 -4.507 5.757 -12.857 1.00 0.00 H new ATOM 0 HB3 GLU A1557 -5.217 7.085 -13.751 1.00 0.00 H new ATOM 0 HG2 GLU A1557 -2.770 7.285 -11.956 1.00 0.00 H new ATOM 0 HG3 GLU A1557 -2.741 7.196 -13.706 1.00 0.00 H new ATOM 719 N ASN A1558 -7.529 5.855 -11.187 1.00 0.00 N ATOM 720 CA ASN A1558 -8.946 5.535 -11.346 1.00 0.00 C ATOM 721 C ASN A1558 -9.739 6.283 -10.280 1.00 0.00 C ATOM 722 O ASN A1558 -10.963 6.401 -10.339 1.00 0.00 O ATOM 723 CB ASN A1558 -9.199 4.015 -11.250 1.00 0.00 C ATOM 724 CG ASN A1558 -10.631 3.609 -11.630 1.00 0.00 C ATOM 725 OD1 ASN A1558 -10.925 3.349 -12.800 1.00 0.00 O ATOM 726 ND2 ASN A1558 -11.522 3.544 -10.668 1.00 0.00 N ATOM 0 H ASN A1558 -7.020 5.269 -10.525 1.00 0.00 H new ATOM 0 HA ASN A1558 -9.272 5.848 -12.338 1.00 0.00 H new ATOM 0 HB2 ASN A1558 -8.497 3.496 -11.902 1.00 0.00 H new ATOM 0 HB3 ASN A1558 -8.993 3.684 -10.232 1.00 0.00 H new ATOM 0 HD21 ASN A1558 -12.482 3.274 -10.880 1.00 0.00 H new ATOM 0 HD22 ASN A1558 -11.254 3.764 -9.709 1.00 0.00 H new ATOM 733 N CYS A1559 -9.019 6.828 -9.346 1.00 0.00 N ATOM 734 CA CYS A1559 -9.573 7.538 -8.225 1.00 0.00 C ATOM 735 C CYS A1559 -9.418 9.034 -8.426 1.00 0.00 C ATOM 736 O CYS A1559 -8.564 9.474 -9.206 1.00 0.00 O ATOM 737 CB CYS A1559 -8.814 7.135 -6.971 1.00 0.00 C ATOM 738 SG CYS A1559 -8.953 5.384 -6.553 1.00 0.00 S ATOM 0 H CYS A1559 -8.000 6.792 -9.340 1.00 0.00 H new ATOM 0 HA CYS A1559 -10.631 7.294 -8.132 1.00 0.00 H new ATOM 0 HB2 CYS A1559 -7.761 7.383 -7.102 1.00 0.00 H new ATOM 0 HB3 CYS A1559 -9.180 7.727 -6.132 1.00 0.00 H new ATOM 743 N PRO A1560 -10.274 9.842 -7.776 1.00 0.00 N ATOM 744 CA PRO A1560 -10.135 11.296 -7.778 1.00 0.00 C ATOM 745 C PRO A1560 -8.792 11.691 -7.143 1.00 0.00 C ATOM 746 O PRO A1560 -8.486 11.266 -6.010 1.00 0.00 O ATOM 747 CB PRO A1560 -11.294 11.763 -6.888 1.00 0.00 C ATOM 748 CG PRO A1560 -12.282 10.665 -6.959 1.00 0.00 C ATOM 749 CD PRO A1560 -11.470 9.413 -7.021 1.00 0.00 C ATOM 0 HA PRO A1560 -10.158 11.732 -8.777 1.00 0.00 H new ATOM 0 HB2 PRO A1560 -10.964 11.934 -5.863 1.00 0.00 H new ATOM 0 HB3 PRO A1560 -11.717 12.701 -7.247 1.00 0.00 H new ATOM 0 HG2 PRO A1560 -12.937 10.667 -6.088 1.00 0.00 H new ATOM 0 HG3 PRO A1560 -12.920 10.765 -7.837 1.00 0.00 H new ATOM 0 HD2 PRO A1560 -11.212 9.047 -6.027 1.00 0.00 H new ATOM 0 HD3 PRO A1560 -12.003 8.609 -7.528 1.00 0.00 H new ATOM 757 N PRO A1561 -7.979 12.490 -7.883 1.00 0.00 N ATOM 758 CA PRO A1561 -6.625 12.928 -7.479 1.00 0.00 C ATOM 759 C PRO A1561 -6.516 13.268 -5.998 1.00 0.00 C ATOM 760 O PRO A1561 -7.141 14.207 -5.518 1.00 0.00 O ATOM 761 CB PRO A1561 -6.414 14.176 -8.321 1.00 0.00 C ATOM 762 CG PRO A1561 -7.186 13.934 -9.570 1.00 0.00 C ATOM 763 CD PRO A1561 -8.340 13.043 -9.206 1.00 0.00 C ATOM 0 HA PRO A1561 -5.885 12.143 -7.631 1.00 0.00 H new ATOM 0 HB2 PRO A1561 -6.771 15.066 -7.803 1.00 0.00 H new ATOM 0 HB3 PRO A1561 -5.357 14.334 -8.535 1.00 0.00 H new ATOM 0 HG2 PRO A1561 -7.542 14.874 -9.992 1.00 0.00 H new ATOM 0 HG3 PRO A1561 -6.558 13.463 -10.326 1.00 0.00 H new ATOM 0 HD2 PRO A1561 -9.274 13.603 -9.161 1.00 0.00 H new ATOM 0 HD3 PRO A1561 -8.478 12.252 -9.943 1.00 0.00 H new ATOM 771 N GLY A1562 -5.744 12.487 -5.285 1.00 0.00 N ATOM 772 CA GLY A1562 -5.596 12.676 -3.864 1.00 0.00 C ATOM 773 C GLY A1562 -5.859 11.388 -3.134 1.00 0.00 C ATOM 774 O GLY A1562 -5.344 11.155 -2.046 1.00 0.00 O ATOM 0 H GLY A1562 -5.206 11.710 -5.668 1.00 0.00 H new ATOM 0 HA2 GLY A1562 -4.589 13.029 -3.641 1.00 0.00 H new ATOM 0 HA3 GLY A1562 -6.287 13.445 -3.519 1.00 0.00 H new ATOM 778 N VAL A1563 -6.678 10.556 -3.734 1.00 0.00 N ATOM 779 CA VAL A1563 -7.004 9.252 -3.183 1.00 0.00 C ATOM 780 C VAL A1563 -5.977 8.232 -3.686 1.00 0.00 C ATOM 781 O VAL A1563 -5.547 8.298 -4.844 1.00 0.00 O ATOM 782 CB VAL A1563 -8.440 8.823 -3.597 1.00 0.00 C ATOM 783 CG1 VAL A1563 -8.817 7.479 -3.004 1.00 0.00 C ATOM 784 CG2 VAL A1563 -9.453 9.872 -3.181 1.00 0.00 C ATOM 0 H VAL A1563 -7.140 10.760 -4.620 1.00 0.00 H new ATOM 0 HA VAL A1563 -6.972 9.301 -2.095 1.00 0.00 H new ATOM 0 HB VAL A1563 -8.448 8.728 -4.683 1.00 0.00 H new ATOM 0 HG11 VAL A1563 -9.827 7.214 -3.316 1.00 0.00 H new ATOM 0 HG12 VAL A1563 -8.118 6.719 -3.353 1.00 0.00 H new ATOM 0 HG13 VAL A1563 -8.777 7.537 -1.916 1.00 0.00 H new ATOM 0 HG21 VAL A1563 -10.451 9.552 -3.480 1.00 0.00 H new ATOM 0 HG22 VAL A1563 -9.422 9.999 -2.099 1.00 0.00 H new ATOM 0 HG23 VAL A1563 -9.215 10.819 -3.665 1.00 0.00 H new ATOM 794 N GLY A1564 -5.577 7.320 -2.828 1.00 0.00 N ATOM 795 CA GLY A1564 -4.579 6.347 -3.195 1.00 0.00 C ATOM 796 C GLY A1564 -5.164 4.983 -3.439 1.00 0.00 C ATOM 797 O GLY A1564 -4.598 4.183 -4.185 1.00 0.00 O ATOM 0 H GLY A1564 -5.928 7.234 -1.874 1.00 0.00 H new ATOM 0 HA2 GLY A1564 -4.063 6.683 -4.094 1.00 0.00 H new ATOM 0 HA3 GLY A1564 -3.832 6.282 -2.404 1.00 0.00 H new ATOM 801 N ALA A1565 -6.288 4.703 -2.823 1.00 0.00 N ATOM 802 CA ALA A1565 -6.912 3.413 -2.969 1.00 0.00 C ATOM 803 C ALA A1565 -8.422 3.543 -2.958 1.00 0.00 C ATOM 804 O ALA A1565 -8.990 4.253 -2.121 1.00 0.00 O ATOM 805 CB ALA A1565 -6.442 2.473 -1.865 1.00 0.00 C ATOM 0 H ALA A1565 -6.788 5.353 -2.216 1.00 0.00 H new ATOM 0 HA ALA A1565 -6.618 2.992 -3.930 1.00 0.00 H new ATOM 0 HB1 ALA A1565 -6.921 1.501 -1.986 1.00 0.00 H new ATOM 0 HB2 ALA A1565 -5.360 2.354 -1.924 1.00 0.00 H new ATOM 0 HB3 ALA A1565 -6.709 2.890 -0.894 1.00 0.00 H new ATOM 811 N CYS A1566 -9.062 2.880 -3.881 1.00 0.00 N ATOM 812 CA CYS A1566 -10.506 2.880 -3.977 1.00 0.00 C ATOM 813 C CYS A1566 -11.010 1.472 -4.064 1.00 0.00 C ATOM 814 O CYS A1566 -10.485 0.661 -4.828 1.00 0.00 O ATOM 815 CB CYS A1566 -10.979 3.637 -5.207 1.00 0.00 C ATOM 816 SG CYS A1566 -10.500 5.374 -5.258 1.00 0.00 S ATOM 0 H CYS A1566 -8.598 2.319 -4.595 1.00 0.00 H new ATOM 0 HA CYS A1566 -10.896 3.372 -3.086 1.00 0.00 H new ATOM 0 HB2 CYS A1566 -10.587 3.141 -6.095 1.00 0.00 H new ATOM 0 HB3 CYS A1566 -12.066 3.573 -5.260 1.00 0.00 H new ATOM 821 N PHE A1567 -12.012 1.169 -3.307 1.00 0.00 N ATOM 822 CA PHE A1567 -12.579 -0.133 -3.325 1.00 0.00 C ATOM 823 C PHE A1567 -13.776 -0.134 -4.274 1.00 0.00 C ATOM 824 O PHE A1567 -14.769 0.586 -4.052 1.00 0.00 O ATOM 825 CB PHE A1567 -12.993 -0.533 -1.902 1.00 0.00 C ATOM 826 CG PHE A1567 -13.372 -1.981 -1.739 1.00 0.00 C ATOM 827 CD1 PHE A1567 -12.397 -2.939 -1.524 1.00 0.00 C ATOM 828 CD2 PHE A1567 -14.694 -2.380 -1.783 1.00 0.00 C ATOM 829 CE1 PHE A1567 -12.731 -4.262 -1.359 1.00 0.00 C ATOM 830 CE2 PHE A1567 -15.034 -3.703 -1.620 1.00 0.00 C ATOM 831 CZ PHE A1567 -14.051 -4.649 -1.407 1.00 0.00 C ATOM 0 H PHE A1567 -12.459 1.819 -2.660 1.00 0.00 H new ATOM 0 HA PHE A1567 -11.851 -0.863 -3.679 1.00 0.00 H new ATOM 0 HB2 PHE A1567 -12.171 -0.308 -1.223 1.00 0.00 H new ATOM 0 HB3 PHE A1567 -13.837 0.086 -1.597 1.00 0.00 H new ATOM 0 HD1 PHE A1567 -11.359 -2.643 -1.485 1.00 0.00 H new ATOM 0 HD2 PHE A1567 -15.469 -1.646 -1.947 1.00 0.00 H new ATOM 0 HE1 PHE A1567 -11.958 -4.998 -1.192 1.00 0.00 H new ATOM 0 HE2 PHE A1567 -16.071 -4.002 -1.659 1.00 0.00 H new ATOM 0 HZ PHE A1567 -14.317 -5.688 -1.279 1.00 0.00 H new ATOM 841 N GLY A1568 -13.648 -0.874 -5.353 1.00 0.00 N ATOM 842 CA GLY A1568 -14.729 -1.040 -6.289 1.00 0.00 C ATOM 843 C GLY A1568 -14.843 0.092 -7.288 1.00 0.00 C ATOM 844 O GLY A1568 -14.217 1.153 -7.131 1.00 0.00 O ATOM 0 H GLY A1568 -12.795 -1.374 -5.602 1.00 0.00 H new ATOM 0 HA2 GLY A1568 -14.591 -1.977 -6.828 1.00 0.00 H new ATOM 0 HA3 GLY A1568 -15.666 -1.124 -5.738 1.00 0.00 H new ATOM 848 N GLN A1569 -15.681 -0.115 -8.300 1.00 0.00 N ATOM 849 CA GLN A1569 -15.962 0.895 -9.331 1.00 0.00 C ATOM 850 C GLN A1569 -16.778 2.020 -8.722 1.00 0.00 C ATOM 851 O GLN A1569 -16.891 3.110 -9.281 1.00 0.00 O ATOM 852 CB GLN A1569 -16.721 0.284 -10.508 1.00 0.00 C ATOM 853 CG GLN A1569 -15.953 -0.789 -11.254 1.00 0.00 C ATOM 854 CD GLN A1569 -16.759 -1.410 -12.370 1.00 0.00 C ATOM 855 OE1 GLN A1569 -17.989 -1.495 -12.302 1.00 0.00 O ATOM 856 NE2 GLN A1569 -16.096 -1.835 -13.403 1.00 0.00 N ATOM 0 H GLN A1569 -16.189 -0.989 -8.434 1.00 0.00 H new ATOM 0 HA GLN A1569 -15.014 1.283 -9.704 1.00 0.00 H new ATOM 0 HB2 GLN A1569 -17.655 -0.142 -10.141 1.00 0.00 H new ATOM 0 HB3 GLN A1569 -16.985 1.078 -11.207 1.00 0.00 H new ATOM 0 HG2 GLN A1569 -15.041 -0.358 -11.666 1.00 0.00 H new ATOM 0 HG3 GLN A1569 -15.650 -1.567 -10.553 1.00 0.00 H new ATOM 0 HE21 GLN A1569 -15.080 -1.750 -13.427 1.00 0.00 H new ATOM 0 HE22 GLN A1569 -16.592 -2.254 -14.190 1.00 0.00 H new ATOM 865 N THR A1570 -17.330 1.731 -7.553 1.00 0.00 N ATOM 866 CA THR A1570 -18.059 2.672 -6.741 1.00 0.00 C ATOM 867 C THR A1570 -17.099 3.788 -6.238 1.00 0.00 C ATOM 868 O THR A1570 -17.520 4.851 -5.793 1.00 0.00 O ATOM 869 CB THR A1570 -18.664 1.921 -5.527 1.00 0.00 C ATOM 870 OG1 THR A1570 -19.324 0.721 -5.985 1.00 0.00 O ATOM 871 CG2 THR A1570 -19.672 2.784 -4.790 1.00 0.00 C ATOM 0 H THR A1570 -17.276 0.801 -7.137 1.00 0.00 H new ATOM 0 HA THR A1570 -18.855 3.128 -7.330 1.00 0.00 H new ATOM 0 HB THR A1570 -17.851 1.674 -4.844 1.00 0.00 H new ATOM 0 HG1 THR A1570 -19.705 0.244 -5.218 1.00 0.00 H new ATOM 0 HG21 THR A1570 -20.078 2.228 -3.945 1.00 0.00 H new ATOM 0 HG22 THR A1570 -19.182 3.688 -4.429 1.00 0.00 H new ATOM 0 HG23 THR A1570 -20.482 3.056 -5.467 1.00 0.00 H new ATOM 879 N ARG A1571 -15.785 3.495 -6.346 1.00 0.00 N ATOM 880 CA ARG A1571 -14.687 4.399 -6.014 1.00 0.00 C ATOM 881 C ARG A1571 -14.683 4.776 -4.557 1.00 0.00 C ATOM 882 O ARG A1571 -14.355 5.913 -4.212 1.00 0.00 O ATOM 883 CB ARG A1571 -14.692 5.668 -6.877 1.00 0.00 C ATOM 884 CG ARG A1571 -14.563 5.433 -8.368 1.00 0.00 C ATOM 885 CD ARG A1571 -14.547 6.754 -9.108 1.00 0.00 C ATOM 886 NE ARG A1571 -15.742 7.561 -8.816 1.00 0.00 N ATOM 887 CZ ARG A1571 -15.925 8.839 -9.176 1.00 0.00 C ATOM 888 NH1 ARG A1571 -15.005 9.482 -9.885 1.00 0.00 N1+ ATOM 889 NH2 ARG A1571 -17.035 9.461 -8.827 1.00 0.00 N ATOM 0 H ARG A1571 -15.459 2.588 -6.679 1.00 0.00 H new ATOM 0 HA ARG A1571 -13.775 3.843 -6.230 1.00 0.00 H new ATOM 0 HB2 ARG A1571 -15.618 6.212 -6.690 1.00 0.00 H new ATOM 0 HB3 ARG A1571 -13.873 6.311 -6.554 1.00 0.00 H new ATOM 0 HG2 ARG A1571 -13.648 4.879 -8.578 1.00 0.00 H new ATOM 0 HG3 ARG A1571 -15.394 4.821 -8.720 1.00 0.00 H new ATOM 0 HD2 ARG A1571 -13.654 7.314 -8.831 1.00 0.00 H new ATOM 0 HD3 ARG A1571 -14.487 6.569 -10.180 1.00 0.00 H new ATOM 0 HE ARG A1571 -16.495 7.110 -8.296 1.00 0.00 H new ATOM 0 HH11 ARG A1571 -14.148 9.003 -10.162 1.00 0.00 H new ATOM 0 HH12 ARG A1571 -15.155 10.455 -10.153 1.00 0.00 H new ATOM 0 HH21 ARG A1571 -17.747 8.969 -8.287 1.00 0.00 H new ATOM 0 HH22 ARG A1571 -17.181 10.434 -9.097 1.00 0.00 H new ATOM 903 N ILE A1572 -15.035 3.834 -3.703 1.00 0.00 N ATOM 904 CA ILE A1572 -15.058 4.099 -2.283 1.00 0.00 C ATOM 905 C ILE A1572 -13.632 4.281 -1.819 1.00 0.00 C ATOM 906 O ILE A1572 -12.826 3.352 -1.899 1.00 0.00 O ATOM 907 CB ILE A1572 -15.733 2.942 -1.489 1.00 0.00 C ATOM 908 CG1 ILE A1572 -17.182 2.750 -1.966 1.00 0.00 C ATOM 909 CG2 ILE A1572 -15.692 3.220 0.020 1.00 0.00 C ATOM 910 CD1 ILE A1572 -17.920 1.604 -1.296 1.00 0.00 C ATOM 0 H ILE A1572 -15.306 2.887 -3.968 1.00 0.00 H new ATOM 0 HA ILE A1572 -15.645 4.998 -2.098 1.00 0.00 H new ATOM 0 HB ILE A1572 -15.178 2.023 -1.676 1.00 0.00 H new ATOM 0 HG12 ILE A1572 -17.734 3.673 -1.790 1.00 0.00 H new ATOM 0 HG13 ILE A1572 -17.177 2.582 -3.043 1.00 0.00 H new ATOM 0 HG21 ILE A1572 -16.169 2.399 0.554 1.00 0.00 H new ATOM 0 HG22 ILE A1572 -14.656 3.311 0.345 1.00 0.00 H new ATOM 0 HG23 ILE A1572 -16.222 4.148 0.234 1.00 0.00 H new ATOM 0 HD11 ILE A1572 -18.933 1.542 -1.693 1.00 0.00 H new ATOM 0 HD12 ILE A1572 -17.396 0.669 -1.493 1.00 0.00 H new ATOM 0 HD13 ILE A1572 -17.961 1.777 -0.221 1.00 0.00 H new ATOM 922 N SER A1573 -13.317 5.475 -1.395 1.00 0.00 N ATOM 923 CA SER A1573 -11.995 5.799 -0.962 1.00 0.00 C ATOM 924 C SER A1573 -11.606 5.012 0.283 1.00 0.00 C ATOM 925 O SER A1573 -12.238 5.130 1.336 1.00 0.00 O ATOM 926 CB SER A1573 -11.875 7.309 -0.763 1.00 0.00 C ATOM 927 OG SER A1573 -12.982 7.814 -0.027 1.00 0.00 O ATOM 0 H SER A1573 -13.977 6.251 -1.342 1.00 0.00 H new ATOM 0 HA SER A1573 -11.285 5.505 -1.735 1.00 0.00 H new ATOM 0 HB2 SER A1573 -10.948 7.538 -0.236 1.00 0.00 H new ATOM 0 HB3 SER A1573 -11.821 7.804 -1.732 1.00 0.00 H new ATOM 0 HG SER A1573 -12.883 8.782 0.090 1.00 0.00 H new ATOM 933 N VAL A1574 -10.592 4.210 0.142 1.00 0.00 N ATOM 934 CA VAL A1574 -10.101 3.388 1.212 1.00 0.00 C ATOM 935 C VAL A1574 -8.632 3.763 1.483 1.00 0.00 C ATOM 936 O VAL A1574 -7.758 2.933 1.760 1.00 0.00 O ATOM 937 CB VAL A1574 -10.319 1.857 0.896 1.00 0.00 C ATOM 938 CG1 VAL A1574 -9.578 1.394 -0.348 1.00 0.00 C ATOM 939 CG2 VAL A1574 -10.001 0.971 2.084 1.00 0.00 C ATOM 0 H VAL A1574 -10.075 4.106 -0.731 1.00 0.00 H new ATOM 0 HA VAL A1574 -10.664 3.571 2.127 1.00 0.00 H new ATOM 0 HB VAL A1574 -11.383 1.754 0.685 1.00 0.00 H new ATOM 0 HG11 VAL A1574 -9.768 0.333 -0.511 1.00 0.00 H new ATOM 0 HG12 VAL A1574 -9.926 1.962 -1.211 1.00 0.00 H new ATOM 0 HG13 VAL A1574 -8.508 1.554 -0.215 1.00 0.00 H new ATOM 0 HG21 VAL A1574 -10.167 -0.072 1.815 1.00 0.00 H new ATOM 0 HG22 VAL A1574 -8.959 1.110 2.373 1.00 0.00 H new ATOM 0 HG23 VAL A1574 -10.648 1.237 2.920 1.00 0.00 H new ATOM 949 N GLY A1575 -8.372 5.046 1.347 1.00 0.00 N ATOM 950 CA GLY A1575 -7.077 5.548 1.624 1.00 0.00 C ATOM 951 C GLY A1575 -6.702 6.735 0.775 1.00 0.00 C ATOM 952 O GLY A1575 -6.901 6.737 -0.452 1.00 0.00 O ATOM 0 H GLY A1575 -9.050 5.746 1.046 1.00 0.00 H new ATOM 0 HA2 GLY A1575 -7.022 5.831 2.675 1.00 0.00 H new ATOM 0 HA3 GLY A1575 -6.347 4.754 1.469 1.00 0.00 H new ATOM 956 N LYS A1576 -6.191 7.746 1.427 1.00 0.00 N ATOM 957 CA LYS A1576 -5.665 8.938 0.805 1.00 0.00 C ATOM 958 C LYS A1576 -4.309 8.523 0.222 1.00 0.00 C ATOM 959 O LYS A1576 -3.746 7.519 0.657 1.00 0.00 O ATOM 960 CB LYS A1576 -5.458 9.984 1.923 1.00 0.00 C ATOM 961 CG LYS A1576 -5.230 11.425 1.491 1.00 0.00 C ATOM 962 CD LYS A1576 -6.501 12.043 0.936 1.00 0.00 C ATOM 963 CE LYS A1576 -6.299 13.500 0.579 1.00 0.00 C ATOM 964 NZ LYS A1576 -7.557 14.145 0.170 1.00 0.00 N1+ ATOM 0 H LYS A1576 -6.126 7.765 2.445 1.00 0.00 H new ATOM 0 HA LYS A1576 -6.315 9.355 0.036 1.00 0.00 H new ATOM 0 HB2 LYS A1576 -6.332 9.960 2.574 1.00 0.00 H new ATOM 0 HB3 LYS A1576 -4.604 9.672 2.524 1.00 0.00 H new ATOM 0 HG2 LYS A1576 -4.880 12.010 2.341 1.00 0.00 H new ATOM 0 HG3 LYS A1576 -4.446 11.460 0.735 1.00 0.00 H new ATOM 0 HD2 LYS A1576 -6.819 11.491 0.051 1.00 0.00 H new ATOM 0 HD3 LYS A1576 -7.301 11.955 1.671 1.00 0.00 H new ATOM 0 HE2 LYS A1576 -5.882 14.029 1.436 1.00 0.00 H new ATOM 0 HE3 LYS A1576 -5.572 13.578 -0.229 1.00 0.00 H new ATOM 0 HZ1 LYS A1576 -7.375 15.141 -0.066 1.00 0.00 H new ATOM 0 HZ2 LYS A1576 -7.943 13.657 -0.663 1.00 0.00 H new ATOM 0 HZ3 LYS A1576 -8.243 14.093 0.950 1.00 0.00 H new ATOM 978 N ALA A1577 -3.810 9.243 -0.765 1.00 0.00 N ATOM 979 CA ALA A1577 -2.529 8.925 -1.398 1.00 0.00 C ATOM 980 C ALA A1577 -1.356 9.137 -0.437 1.00 0.00 C ATOM 981 O ALA A1577 -0.665 10.159 -0.480 1.00 0.00 O ATOM 982 CB ALA A1577 -2.349 9.751 -2.656 1.00 0.00 C ATOM 0 H ALA A1577 -4.274 10.064 -1.155 1.00 0.00 H new ATOM 0 HA ALA A1577 -2.540 7.869 -1.668 1.00 0.00 H new ATOM 0 HB1 ALA A1577 -1.393 9.506 -3.118 1.00 0.00 H new ATOM 0 HB2 ALA A1577 -3.157 9.531 -3.354 1.00 0.00 H new ATOM 0 HB3 ALA A1577 -2.368 10.811 -2.401 1.00 0.00 H new ATOM 988 N ASN A1578 -1.161 8.179 0.432 1.00 0.00 N ATOM 989 CA ASN A1578 -0.105 8.208 1.425 1.00 0.00 C ATOM 990 C ASN A1578 1.133 7.581 0.849 1.00 0.00 C ATOM 991 O ASN A1578 1.051 6.682 -0.002 1.00 0.00 O ATOM 992 CB ASN A1578 -0.518 7.461 2.721 1.00 0.00 C ATOM 993 CG ASN A1578 -1.582 8.172 3.584 1.00 0.00 C ATOM 994 OD1 ASN A1578 -1.612 8.017 4.804 1.00 0.00 O ATOM 995 ND2 ASN A1578 -2.448 8.929 2.986 1.00 0.00 N ATOM 0 H ASN A1578 -1.739 7.340 0.475 1.00 0.00 H new ATOM 0 HA ASN A1578 0.088 9.248 1.689 1.00 0.00 H new ATOM 0 HB2 ASN A1578 -0.895 6.476 2.448 1.00 0.00 H new ATOM 0 HB3 ASN A1578 0.373 7.304 3.329 1.00 0.00 H new ATOM 0 HD21 ASN A1578 -3.168 9.407 3.528 1.00 0.00 H new ATOM 0 HD22 ASN A1578 -2.409 9.047 1.974 1.00 0.00 H new ATOM 1002 N LYS A1579 2.264 8.046 1.274 1.00 0.00 N ATOM 1003 CA LYS A1579 3.512 7.545 0.779 1.00 0.00 C ATOM 1004 C LYS A1579 4.553 7.566 1.885 1.00 0.00 C ATOM 1005 O LYS A1579 5.751 7.753 1.661 1.00 0.00 O ATOM 1006 CB LYS A1579 3.924 8.343 -0.465 1.00 0.00 C ATOM 1007 CG LYS A1579 4.055 9.834 -0.262 1.00 0.00 C ATOM 1008 CD LYS A1579 4.098 10.542 -1.598 1.00 0.00 C ATOM 1009 CE LYS A1579 4.488 11.991 -1.449 1.00 0.00 C ATOM 1010 NZ LYS A1579 5.892 12.113 -1.049 1.00 0.00 N1+ ATOM 0 H LYS A1579 2.352 8.783 1.973 1.00 0.00 H new ATOM 0 HA LYS A1579 3.414 6.504 0.470 1.00 0.00 H new ATOM 0 HB2 LYS A1579 4.878 7.957 -0.825 1.00 0.00 H new ATOM 0 HB3 LYS A1579 3.191 8.163 -1.251 1.00 0.00 H new ATOM 0 HG2 LYS A1579 3.215 10.203 0.326 1.00 0.00 H new ATOM 0 HG3 LYS A1579 4.961 10.053 0.303 1.00 0.00 H new ATOM 0 HD2 LYS A1579 4.809 10.039 -2.254 1.00 0.00 H new ATOM 0 HD3 LYS A1579 3.121 10.475 -2.077 1.00 0.00 H new ATOM 0 HE2 LYS A1579 4.327 12.514 -2.391 1.00 0.00 H new ATOM 0 HE3 LYS A1579 3.850 12.469 -0.706 1.00 0.00 H new ATOM 0 HZ1 LYS A1579 6.236 13.068 -1.275 1.00 0.00 H new ATOM 0 HZ2 LYS A1579 5.977 11.947 -0.026 1.00 0.00 H new ATOM 0 HZ3 LYS A1579 6.461 11.410 -1.562 1.00 0.00 H new ATOM 1024 N ARG A1580 4.064 7.340 3.084 1.00 0.00 N ATOM 1025 CA ARG A1580 4.875 7.336 4.272 1.00 0.00 C ATOM 1026 C ARG A1580 5.293 5.922 4.583 1.00 0.00 C ATOM 1027 O ARG A1580 4.553 5.154 5.216 1.00 0.00 O ATOM 1028 CB ARG A1580 4.093 7.953 5.419 1.00 0.00 C ATOM 1029 CG ARG A1580 4.880 8.170 6.694 1.00 0.00 C ATOM 1030 CD ARG A1580 4.237 9.284 7.480 1.00 0.00 C ATOM 1031 NE ARG A1580 4.159 10.496 6.643 1.00 0.00 N ATOM 1032 CZ ARG A1580 3.407 11.573 6.867 1.00 0.00 C ATOM 1033 NH1 ARG A1580 2.694 11.683 7.982 1.00 0.00 N1+ ATOM 1034 NH2 ARG A1580 3.383 12.544 5.960 1.00 0.00 N ATOM 0 H ARG A1580 3.077 7.152 3.259 1.00 0.00 H new ATOM 0 HA ARG A1580 5.775 7.931 4.120 1.00 0.00 H new ATOM 0 HB2 ARG A1580 3.693 8.912 5.090 1.00 0.00 H new ATOM 0 HB3 ARG A1580 3.240 7.312 5.642 1.00 0.00 H new ATOM 0 HG2 ARG A1580 4.900 7.254 7.285 1.00 0.00 H new ATOM 0 HG3 ARG A1580 5.915 8.422 6.460 1.00 0.00 H new ATOM 0 HD2 ARG A1580 3.239 8.987 7.802 1.00 0.00 H new ATOM 0 HD3 ARG A1580 4.815 9.488 8.381 1.00 0.00 H new ATOM 0 HE ARG A1580 4.741 10.511 5.806 1.00 0.00 H new ATOM 0 HH11 ARG A1580 2.718 10.938 8.678 1.00 0.00 H new ATOM 0 HH12 ARG A1580 2.122 12.512 8.142 1.00 0.00 H new ATOM 0 HH21 ARG A1580 3.935 12.459 5.107 1.00 0.00 H new ATOM 0 HH22 ARG A1580 2.812 13.375 6.117 1.00 0.00 H new ATOM 1048 N LEU A1581 6.449 5.576 4.121 1.00 0.00 N ATOM 1049 CA LEU A1581 6.955 4.241 4.249 1.00 0.00 C ATOM 1050 C LEU A1581 7.561 4.036 5.625 1.00 0.00 C ATOM 1051 O LEU A1581 8.338 4.864 6.110 1.00 0.00 O ATOM 1052 CB LEU A1581 7.982 3.986 3.149 1.00 0.00 C ATOM 1053 CG LEU A1581 8.487 2.554 2.984 1.00 0.00 C ATOM 1054 CD1 LEU A1581 7.334 1.642 2.620 1.00 0.00 C ATOM 1055 CD2 LEU A1581 9.567 2.487 1.915 1.00 0.00 C ATOM 0 H LEU A1581 7.079 6.216 3.638 1.00 0.00 H new ATOM 0 HA LEU A1581 6.139 3.527 4.139 1.00 0.00 H new ATOM 0 HB2 LEU A1581 7.547 4.302 2.201 1.00 0.00 H new ATOM 0 HB3 LEU A1581 8.843 4.628 3.335 1.00 0.00 H new ATOM 0 HG LEU A1581 8.919 2.224 3.929 1.00 0.00 H new ATOM 0 HD11 LEU A1581 7.700 0.622 2.503 1.00 0.00 H new ATOM 0 HD12 LEU A1581 6.584 1.671 3.410 1.00 0.00 H new ATOM 0 HD13 LEU A1581 6.887 1.976 1.684 1.00 0.00 H new ATOM 0 HD21 LEU A1581 9.914 1.459 1.812 1.00 0.00 H new ATOM 0 HD22 LEU A1581 9.159 2.829 0.964 1.00 0.00 H new ATOM 0 HD23 LEU A1581 10.403 3.125 2.202 1.00 0.00 H new ATOM 1067 N ARG A1582 7.167 2.984 6.267 1.00 0.00 N ATOM 1068 CA ARG A1582 7.689 2.642 7.570 1.00 0.00 C ATOM 1069 C ARG A1582 8.503 1.385 7.453 1.00 0.00 C ATOM 1070 O ARG A1582 8.140 0.498 6.697 1.00 0.00 O ATOM 1071 CB ARG A1582 6.545 2.391 8.552 1.00 0.00 C ATOM 1072 CG ARG A1582 5.629 3.572 8.772 1.00 0.00 C ATOM 1073 CD ARG A1582 4.462 3.189 9.658 1.00 0.00 C ATOM 1074 NE ARG A1582 3.584 4.326 9.912 1.00 0.00 N ATOM 1075 CZ ARG A1582 2.321 4.257 10.345 1.00 0.00 C ATOM 1076 NH1 ARG A1582 1.711 3.079 10.491 1.00 0.00 N1+ ATOM 1077 NH2 ARG A1582 1.667 5.375 10.610 1.00 0.00 N ATOM 0 H ARG A1582 6.472 2.329 5.909 1.00 0.00 H new ATOM 0 HA ARG A1582 8.302 3.467 7.934 1.00 0.00 H new ATOM 0 HB2 ARG A1582 5.952 1.551 8.190 1.00 0.00 H new ATOM 0 HB3 ARG A1582 6.967 2.093 9.512 1.00 0.00 H new ATOM 0 HG2 ARG A1582 6.186 4.390 9.230 1.00 0.00 H new ATOM 0 HG3 ARG A1582 5.260 3.935 7.813 1.00 0.00 H new ATOM 0 HD2 ARG A1582 3.893 2.388 9.185 1.00 0.00 H new ATOM 0 HD3 ARG A1582 4.836 2.799 10.605 1.00 0.00 H new ATOM 0 HE ARG A1582 3.968 5.256 9.744 1.00 0.00 H new ATOM 0 HH11 ARG A1582 2.209 2.216 10.271 1.00 0.00 H new ATOM 0 HH12 ARG A1582 0.747 3.041 10.822 1.00 0.00 H new ATOM 0 HH21 ARG A1582 2.126 6.277 10.483 1.00 0.00 H new ATOM 0 HH22 ARG A1582 0.703 5.336 10.941 1.00 0.00 H new ATOM 1091 N TYR A1583 9.594 1.317 8.156 1.00 0.00 N ATOM 1092 CA TYR A1583 10.385 0.114 8.212 1.00 0.00 C ATOM 1093 C TYR A1583 10.258 -0.414 9.618 1.00 0.00 C ATOM 1094 O TYR A1583 10.895 0.088 10.543 1.00 0.00 O ATOM 1095 CB TYR A1583 11.853 0.421 7.842 1.00 0.00 C ATOM 1096 CG TYR A1583 12.823 -0.751 7.954 1.00 0.00 C ATOM 1097 CD1 TYR A1583 12.749 -1.848 7.101 1.00 0.00 C ATOM 1098 CD2 TYR A1583 13.823 -0.740 8.913 1.00 0.00 C ATOM 1099 CE1 TYR A1583 13.646 -2.900 7.212 1.00 0.00 C ATOM 1100 CE2 TYR A1583 14.719 -1.780 9.030 1.00 0.00 C ATOM 1101 CZ TYR A1583 14.628 -2.857 8.181 1.00 0.00 C ATOM 1102 OH TYR A1583 15.523 -3.904 8.311 1.00 0.00 O ATOM 0 H TYR A1583 9.964 2.091 8.708 1.00 0.00 H new ATOM 0 HA TYR A1583 10.039 -0.632 7.497 1.00 0.00 H new ATOM 0 HB2 TYR A1583 11.880 0.794 6.818 1.00 0.00 H new ATOM 0 HB3 TYR A1583 12.209 1.226 8.484 1.00 0.00 H new ATOM 0 HD1 TYR A1583 11.982 -1.881 6.341 1.00 0.00 H new ATOM 0 HD2 TYR A1583 13.902 0.103 9.584 1.00 0.00 H new ATOM 0 HE1 TYR A1583 13.577 -3.747 6.545 1.00 0.00 H new ATOM 0 HE2 TYR A1583 15.490 -1.749 9.786 1.00 0.00 H new ATOM 0 HH TYR A1583 16.148 -3.711 9.041 1.00 0.00 H new ATOM 1112 N VAL A1584 9.410 -1.387 9.788 1.00 0.00 N ATOM 1113 CA VAL A1584 9.111 -1.908 11.097 1.00 0.00 C ATOM 1114 C VAL A1584 9.179 -3.419 11.126 1.00 0.00 C ATOM 1115 O VAL A1584 8.475 -4.102 10.374 1.00 0.00 O ATOM 1116 CB VAL A1584 7.730 -1.407 11.633 1.00 0.00 C ATOM 1117 CG1 VAL A1584 7.798 0.068 11.999 1.00 0.00 C ATOM 1118 CG2 VAL A1584 6.621 -1.623 10.602 1.00 0.00 C ATOM 0 H VAL A1584 8.906 -1.843 9.027 1.00 0.00 H new ATOM 0 HA VAL A1584 9.881 -1.521 11.765 1.00 0.00 H new ATOM 0 HB VAL A1584 7.497 -1.990 12.524 1.00 0.00 H new ATOM 0 HG11 VAL A1584 6.827 0.396 12.370 1.00 0.00 H new ATOM 0 HG12 VAL A1584 8.551 0.216 12.773 1.00 0.00 H new ATOM 0 HG13 VAL A1584 8.065 0.650 11.117 1.00 0.00 H new ATOM 0 HG21 VAL A1584 5.674 -1.264 11.006 1.00 0.00 H new ATOM 0 HG22 VAL A1584 6.859 -1.073 9.691 1.00 0.00 H new ATOM 0 HG23 VAL A1584 6.539 -2.686 10.373 1.00 0.00 H new ATOM 1128 N ASP A1585 10.080 -3.926 11.958 1.00 0.00 N ATOM 1129 CA ASP A1585 10.292 -5.369 12.164 1.00 0.00 C ATOM 1130 C ASP A1585 10.721 -6.035 10.870 1.00 0.00 C ATOM 1131 O ASP A1585 10.294 -7.154 10.549 1.00 0.00 O ATOM 1132 CB ASP A1585 9.042 -6.061 12.764 1.00 0.00 C ATOM 1133 CG ASP A1585 8.714 -5.595 14.166 1.00 0.00 C ATOM 1134 OD1 ASP A1585 9.354 -6.072 15.133 1.00 0.00 O ATOM 1135 OD2 ASP A1585 7.801 -4.747 14.341 1.00 0.00 O1- ATOM 0 H ASP A1585 10.699 -3.343 12.522 1.00 0.00 H new ATOM 0 HA ASP A1585 11.095 -5.482 12.892 1.00 0.00 H new ATOM 0 HB2 ASP A1585 8.185 -5.873 12.117 1.00 0.00 H new ATOM 0 HB3 ASP A1585 9.203 -7.139 12.775 1.00 0.00 H new ATOM 1140 N GLN A1586 11.574 -5.318 10.128 1.00 0.00 N ATOM 1141 CA GLN A1586 12.067 -5.737 8.812 1.00 0.00 C ATOM 1142 C GLN A1586 10.917 -5.948 7.825 1.00 0.00 C ATOM 1143 O GLN A1586 10.912 -6.894 7.043 1.00 0.00 O ATOM 1144 CB GLN A1586 12.980 -6.976 8.888 1.00 0.00 C ATOM 1145 CG GLN A1586 14.264 -6.742 9.665 1.00 0.00 C ATOM 1146 CD GLN A1586 15.205 -7.932 9.652 1.00 0.00 C ATOM 1147 OE1 GLN A1586 15.250 -8.707 8.688 1.00 0.00 O ATOM 1148 NE2 GLN A1586 15.958 -8.090 10.708 1.00 0.00 N ATOM 0 H GLN A1586 11.946 -4.418 10.430 1.00 0.00 H new ATOM 0 HA GLN A1586 12.683 -4.920 8.437 1.00 0.00 H new ATOM 0 HB2 GLN A1586 12.429 -7.794 9.352 1.00 0.00 H new ATOM 0 HB3 GLN A1586 13.231 -7.294 7.876 1.00 0.00 H new ATOM 0 HG2 GLN A1586 14.779 -5.877 9.248 1.00 0.00 H new ATOM 0 HG3 GLN A1586 14.015 -6.497 10.698 1.00 0.00 H new ATOM 0 HE21 GLN A1586 15.893 -7.431 11.484 1.00 0.00 H new ATOM 0 HE22 GLN A1586 16.610 -8.873 10.757 1.00 0.00 H new ATOM 1157 N VAL A1587 9.920 -5.099 7.920 1.00 0.00 N ATOM 1158 CA VAL A1587 8.799 -5.096 7.018 1.00 0.00 C ATOM 1159 C VAL A1587 8.539 -3.653 6.641 1.00 0.00 C ATOM 1160 O VAL A1587 8.571 -2.768 7.513 1.00 0.00 O ATOM 1161 CB VAL A1587 7.503 -5.668 7.693 1.00 0.00 C ATOM 1162 CG1 VAL A1587 6.333 -5.657 6.732 1.00 0.00 C ATOM 1163 CG2 VAL A1587 7.712 -7.073 8.228 1.00 0.00 C ATOM 0 H VAL A1587 9.867 -4.379 8.641 1.00 0.00 H new ATOM 0 HA VAL A1587 9.032 -5.722 6.156 1.00 0.00 H new ATOM 0 HB VAL A1587 7.277 -5.013 8.535 1.00 0.00 H new ATOM 0 HG11 VAL A1587 5.450 -6.059 7.229 1.00 0.00 H new ATOM 0 HG12 VAL A1587 6.135 -4.634 6.412 1.00 0.00 H new ATOM 0 HG13 VAL A1587 6.571 -6.270 5.862 1.00 0.00 H new ATOM 0 HG21 VAL A1587 6.789 -7.429 8.686 1.00 0.00 H new ATOM 0 HG22 VAL A1587 7.990 -7.737 7.409 1.00 0.00 H new ATOM 0 HG23 VAL A1587 8.507 -7.064 8.973 1.00 0.00 H new ATOM 1173 N LEU A1588 8.338 -3.394 5.382 1.00 0.00 N ATOM 1174 CA LEU A1588 7.997 -2.066 4.962 1.00 0.00 C ATOM 1175 C LEU A1588 6.493 -1.937 4.996 1.00 0.00 C ATOM 1176 O LEU A1588 5.785 -2.813 4.539 1.00 0.00 O ATOM 1177 CB LEU A1588 8.548 -1.734 3.573 1.00 0.00 C ATOM 1178 CG LEU A1588 10.066 -1.670 3.424 1.00 0.00 C ATOM 1179 CD1 LEU A1588 10.428 -1.386 1.980 1.00 0.00 C ATOM 1180 CD2 LEU A1588 10.658 -0.603 4.326 1.00 0.00 C ATOM 0 H LEU A1588 8.404 -4.081 4.631 1.00 0.00 H new ATOM 0 HA LEU A1588 8.455 -1.349 5.643 1.00 0.00 H new ATOM 0 HB2 LEU A1588 8.170 -2.479 2.872 1.00 0.00 H new ATOM 0 HB3 LEU A1588 8.137 -0.772 3.267 1.00 0.00 H new ATOM 0 HG LEU A1588 10.481 -2.634 3.720 1.00 0.00 H new ATOM 0 HD11 LEU A1588 11.512 -1.341 1.879 1.00 0.00 H new ATOM 0 HD12 LEU A1588 10.037 -2.180 1.344 1.00 0.00 H new ATOM 0 HD13 LEU A1588 9.996 -0.432 1.677 1.00 0.00 H new ATOM 0 HD21 LEU A1588 11.740 -0.579 4.200 1.00 0.00 H new ATOM 0 HD22 LEU A1588 10.240 0.369 4.063 1.00 0.00 H new ATOM 0 HD23 LEU A1588 10.419 -0.831 5.365 1.00 0.00 H new ATOM 1192 N GLN A1589 6.013 -0.893 5.566 1.00 0.00 N ATOM 1193 CA GLN A1589 4.598 -0.726 5.729 1.00 0.00 C ATOM 1194 C GLN A1589 4.120 0.586 5.129 1.00 0.00 C ATOM 1195 O GLN A1589 4.715 1.650 5.374 1.00 0.00 O ATOM 1196 CB GLN A1589 4.259 -0.778 7.222 1.00 0.00 C ATOM 1197 CG GLN A1589 2.787 -0.619 7.551 1.00 0.00 C ATOM 1198 CD GLN A1589 2.544 -0.549 9.040 1.00 0.00 C ATOM 1199 OE1 GLN A1589 2.547 0.536 9.636 1.00 0.00 O ATOM 1200 NE2 GLN A1589 2.338 -1.676 9.655 1.00 0.00 N ATOM 0 H GLN A1589 6.578 -0.128 5.934 1.00 0.00 H new ATOM 0 HA GLN A1589 4.088 -1.532 5.202 1.00 0.00 H new ATOM 0 HB2 GLN A1589 4.605 -1.730 7.625 1.00 0.00 H new ATOM 0 HB3 GLN A1589 4.817 0.006 7.733 1.00 0.00 H new ATOM 0 HG2 GLN A1589 2.406 0.286 7.079 1.00 0.00 H new ATOM 0 HG3 GLN A1589 2.229 -1.456 7.132 1.00 0.00 H new ATOM 0 HE21 GLN A1589 2.343 -2.551 9.131 1.00 0.00 H new ATOM 0 HE22 GLN A1589 2.172 -1.685 10.661 1.00 0.00 H new ATOM 1209 N LEU A1590 3.080 0.500 4.332 1.00 0.00 N ATOM 1210 CA LEU A1590 2.396 1.662 3.806 1.00 0.00 C ATOM 1211 C LEU A1590 0.961 1.623 4.276 1.00 0.00 C ATOM 1212 O LEU A1590 0.251 0.639 4.058 1.00 0.00 O ATOM 1213 CB LEU A1590 2.449 1.733 2.262 1.00 0.00 C ATOM 1214 CG LEU A1590 3.793 2.135 1.634 1.00 0.00 C ATOM 1215 CD1 LEU A1590 3.729 2.052 0.116 1.00 0.00 C ATOM 1216 CD2 LEU A1590 4.152 3.552 2.041 1.00 0.00 C ATOM 0 H LEU A1590 2.680 -0.387 4.027 1.00 0.00 H new ATOM 0 HA LEU A1590 2.901 2.554 4.175 1.00 0.00 H new ATOM 0 HB2 LEU A1590 2.168 0.757 1.867 1.00 0.00 H new ATOM 0 HB3 LEU A1590 1.692 2.442 1.928 1.00 0.00 H new ATOM 0 HG LEU A1590 4.555 1.443 1.993 1.00 0.00 H new ATOM 0 HD11 LEU A1590 4.692 2.341 -0.305 1.00 0.00 H new ATOM 0 HD12 LEU A1590 3.494 1.030 -0.183 1.00 0.00 H new ATOM 0 HD13 LEU A1590 2.955 2.725 -0.253 1.00 0.00 H new ATOM 0 HD21 LEU A1590 5.106 3.829 1.592 1.00 0.00 H new ATOM 0 HD22 LEU A1590 3.377 4.237 1.698 1.00 0.00 H new ATOM 0 HD23 LEU A1590 4.232 3.610 3.127 1.00 0.00 H new ATOM 1228 N VAL A1591 0.549 2.660 4.940 1.00 0.00 N ATOM 1229 CA VAL A1591 -0.793 2.748 5.444 1.00 0.00 C ATOM 1230 C VAL A1591 -1.535 3.824 4.701 1.00 0.00 C ATOM 1231 O VAL A1591 -1.191 5.010 4.788 1.00 0.00 O ATOM 1232 CB VAL A1591 -0.832 3.052 6.970 1.00 0.00 C ATOM 1233 CG1 VAL A1591 -2.269 3.148 7.480 1.00 0.00 C ATOM 1234 CG2 VAL A1591 -0.070 1.994 7.745 1.00 0.00 C ATOM 0 H VAL A1591 1.132 3.471 5.149 1.00 0.00 H new ATOM 0 HA VAL A1591 -1.267 1.779 5.290 1.00 0.00 H new ATOM 0 HB VAL A1591 -0.351 4.018 7.128 1.00 0.00 H new ATOM 0 HG11 VAL A1591 -2.262 3.361 8.549 1.00 0.00 H new ATOM 0 HG12 VAL A1591 -2.789 3.948 6.954 1.00 0.00 H new ATOM 0 HG13 VAL A1591 -2.782 2.203 7.302 1.00 0.00 H new ATOM 0 HG21 VAL A1591 -0.109 2.224 8.810 1.00 0.00 H new ATOM 0 HG22 VAL A1591 -0.521 1.018 7.568 1.00 0.00 H new ATOM 0 HG23 VAL A1591 0.969 1.979 7.415 1.00 0.00 H new ATOM 1244 N TYR A1592 -2.516 3.416 3.966 1.00 0.00 N ATOM 1245 CA TYR A1592 -3.362 4.305 3.243 1.00 0.00 C ATOM 1246 C TYR A1592 -4.562 4.601 4.084 1.00 0.00 C ATOM 1247 O TYR A1592 -5.551 3.877 4.068 1.00 0.00 O ATOM 1248 CB TYR A1592 -3.736 3.721 1.875 1.00 0.00 C ATOM 1249 CG TYR A1592 -2.571 3.724 0.930 1.00 0.00 C ATOM 1250 CD1 TYR A1592 -1.636 2.701 0.929 1.00 0.00 C ATOM 1251 CD2 TYR A1592 -2.380 4.787 0.073 1.00 0.00 C ATOM 1252 CE1 TYR A1592 -0.548 2.746 0.091 1.00 0.00 C ATOM 1253 CE2 TYR A1592 -1.296 4.846 -0.752 1.00 0.00 C ATOM 1254 CZ TYR A1592 -0.381 3.826 -0.743 1.00 0.00 C ATOM 1255 OH TYR A1592 0.720 3.915 -1.545 1.00 0.00 O ATOM 0 H TYR A1592 -2.757 2.432 3.849 1.00 0.00 H new ATOM 0 HA TYR A1592 -2.838 5.239 3.037 1.00 0.00 H new ATOM 0 HB2 TYR A1592 -4.098 2.701 2.002 1.00 0.00 H new ATOM 0 HB3 TYR A1592 -4.554 4.298 1.445 1.00 0.00 H new ATOM 0 HD1 TYR A1592 -1.764 1.860 1.594 1.00 0.00 H new ATOM 0 HD2 TYR A1592 -3.103 5.589 0.055 1.00 0.00 H new ATOM 0 HE1 TYR A1592 0.170 1.939 0.088 1.00 0.00 H new ATOM 0 HE2 TYR A1592 -1.159 5.692 -1.409 1.00 0.00 H new ATOM 0 HH TYR A1592 1.263 4.683 -1.271 1.00 0.00 H new ATOM 1265 N LYS A1593 -4.431 5.625 4.872 1.00 0.00 N ATOM 1266 CA LYS A1593 -5.466 6.032 5.777 1.00 0.00 C ATOM 1267 C LYS A1593 -6.234 7.198 5.179 1.00 0.00 C ATOM 1268 O LYS A1593 -5.798 7.767 4.175 1.00 0.00 O ATOM 1269 CB LYS A1593 -4.853 6.410 7.138 1.00 0.00 C ATOM 1270 CG LYS A1593 -3.865 7.568 7.083 1.00 0.00 C ATOM 1271 CD LYS A1593 -3.234 7.837 8.439 1.00 0.00 C ATOM 1272 CE LYS A1593 -2.299 9.039 8.388 1.00 0.00 C ATOM 1273 NZ LYS A1593 -1.175 8.856 7.437 1.00 0.00 N1+ ATOM 0 H LYS A1593 -3.595 6.208 4.906 1.00 0.00 H new ATOM 0 HA LYS A1593 -6.161 5.207 5.936 1.00 0.00 H new ATOM 0 HB2 LYS A1593 -5.658 6.667 7.826 1.00 0.00 H new ATOM 0 HB3 LYS A1593 -4.348 5.537 7.550 1.00 0.00 H new ATOM 0 HG2 LYS A1593 -3.084 7.345 6.356 1.00 0.00 H new ATOM 0 HG3 LYS A1593 -4.376 8.466 6.736 1.00 0.00 H new ATOM 0 HD2 LYS A1593 -4.016 8.013 9.177 1.00 0.00 H new ATOM 0 HD3 LYS A1593 -2.680 6.957 8.765 1.00 0.00 H new ATOM 0 HE2 LYS A1593 -2.868 9.924 8.104 1.00 0.00 H new ATOM 0 HE3 LYS A1593 -1.899 9.224 9.385 1.00 0.00 H new ATOM 0 HZ1 LYS A1593 -0.563 9.697 7.457 1.00 0.00 H new ATOM 0 HZ2 LYS A1593 -0.622 8.019 7.710 1.00 0.00 H new ATOM 0 HZ3 LYS A1593 -1.551 8.724 6.476 1.00 0.00 H new ATOM 1287 N ASP A1594 -7.353 7.534 5.806 1.00 0.00 N ATOM 1288 CA ASP A1594 -8.255 8.629 5.397 1.00 0.00 C ATOM 1289 C ASP A1594 -8.968 8.336 4.091 1.00 0.00 C ATOM 1290 O ASP A1594 -8.458 8.598 3.002 1.00 0.00 O ATOM 1291 CB ASP A1594 -7.565 10.005 5.342 1.00 0.00 C ATOM 1292 CG ASP A1594 -8.526 11.125 4.962 1.00 0.00 C ATOM 1293 OD1 ASP A1594 -9.501 11.365 5.708 1.00 0.00 O ATOM 1294 OD2 ASP A1594 -8.304 11.822 3.951 1.00 0.00 O1- ATOM 0 H ASP A1594 -7.678 7.044 6.640 1.00 0.00 H new ATOM 0 HA ASP A1594 -9.005 8.682 6.186 1.00 0.00 H new ATOM 0 HB2 ASP A1594 -7.122 10.225 6.313 1.00 0.00 H new ATOM 0 HB3 ASP A1594 -6.749 9.970 4.620 1.00 0.00 H new ATOM 1299 N GLY A1595 -10.126 7.783 4.203 1.00 0.00 N ATOM 1300 CA GLY A1595 -10.931 7.518 3.061 1.00 0.00 C ATOM 1301 C GLY A1595 -12.341 7.924 3.343 1.00 0.00 C ATOM 1302 O GLY A1595 -12.586 9.032 3.819 1.00 0.00 O ATOM 0 H GLY A1595 -10.542 7.501 5.090 1.00 0.00 H new ATOM 0 HA2 GLY A1595 -10.549 8.064 2.199 1.00 0.00 H new ATOM 0 HA3 GLY A1595 -10.889 6.458 2.811 1.00 0.00 H new ATOM 1306 N SER A1596 -13.252 7.050 3.092 1.00 0.00 N ATOM 1307 CA SER A1596 -14.632 7.287 3.392 1.00 0.00 C ATOM 1308 C SER A1596 -14.868 6.953 4.875 1.00 0.00 C ATOM 1309 O SER A1596 -14.189 6.072 5.428 1.00 0.00 O ATOM 1310 CB SER A1596 -15.481 6.402 2.480 1.00 0.00 C ATOM 1311 OG SER A1596 -15.153 6.650 1.116 1.00 0.00 O ATOM 0 H SER A1596 -13.065 6.141 2.669 1.00 0.00 H new ATOM 0 HA SER A1596 -14.908 8.328 3.221 1.00 0.00 H new ATOM 0 HB2 SER A1596 -15.311 5.352 2.718 1.00 0.00 H new ATOM 0 HB3 SER A1596 -16.539 6.600 2.650 1.00 0.00 H new ATOM 0 HG SER A1596 -14.321 7.165 1.068 1.00 0.00 H new ATOM 1317 N PRO A1597 -15.732 7.713 5.561 1.00 0.00 N ATOM 1318 CA PRO A1597 -16.074 7.449 6.960 1.00 0.00 C ATOM 1319 C PRO A1597 -16.930 6.183 7.093 1.00 0.00 C ATOM 1320 O PRO A1597 -17.778 5.897 6.233 1.00 0.00 O ATOM 1321 CB PRO A1597 -16.871 8.692 7.377 1.00 0.00 C ATOM 1322 CG PRO A1597 -17.424 9.238 6.109 1.00 0.00 C ATOM 1323 CD PRO A1597 -16.423 8.914 5.039 1.00 0.00 C ATOM 0 HA PRO A1597 -15.195 7.277 7.582 1.00 0.00 H new ATOM 0 HB2 PRO A1597 -17.667 8.434 8.076 1.00 0.00 H new ATOM 0 HB3 PRO A1597 -16.233 9.421 7.876 1.00 0.00 H new ATOM 0 HG2 PRO A1597 -18.393 8.792 5.883 1.00 0.00 H new ATOM 0 HG3 PRO A1597 -17.579 10.314 6.184 1.00 0.00 H new ATOM 0 HD2 PRO A1597 -16.908 8.714 4.084 1.00 0.00 H new ATOM 0 HD3 PRO A1597 -15.728 9.738 4.877 1.00 0.00 H new ATOM 1331 N CYS A1598 -16.700 5.435 8.142 1.00 0.00 N ATOM 1332 CA CYS A1598 -17.410 4.188 8.377 1.00 0.00 C ATOM 1333 C CYS A1598 -18.774 4.468 8.977 1.00 0.00 C ATOM 1334 O CYS A1598 -18.870 5.023 10.067 1.00 0.00 O ATOM 1335 CB CYS A1598 -16.617 3.325 9.337 1.00 0.00 C ATOM 1336 SG CYS A1598 -14.920 3.019 8.793 1.00 0.00 S ATOM 0 H CYS A1598 -16.016 5.667 8.862 1.00 0.00 H new ATOM 0 HA CYS A1598 -17.533 3.670 7.426 1.00 0.00 H new ATOM 0 HB2 CYS A1598 -16.596 3.807 10.315 1.00 0.00 H new ATOM 0 HB3 CYS A1598 -17.128 2.371 9.463 1.00 0.00 H new ATOM 1406 N LEU A1604 -14.201 6.559 12.483 1.00 0.00 N ATOM 1407 CA LEU A1604 -13.289 5.729 11.714 1.00 0.00 C ATOM 1408 C LEU A1604 -13.455 5.962 10.228 1.00 0.00 C ATOM 1409 O LEU A1604 -14.452 6.544 9.777 1.00 0.00 O ATOM 1410 CB LEU A1604 -13.432 4.236 12.035 1.00 0.00 C ATOM 1411 CG LEU A1604 -13.018 3.780 13.433 1.00 0.00 C ATOM 1412 CD1 LEU A1604 -13.138 2.275 13.539 1.00 0.00 C ATOM 1413 CD2 LEU A1604 -11.597 4.217 13.750 1.00 0.00 C ATOM 0 HA LEU A1604 -12.284 6.030 12.009 1.00 0.00 H new ATOM 0 HB2 LEU A1604 -14.474 3.956 11.883 1.00 0.00 H new ATOM 0 HB3 LEU A1604 -12.843 3.676 11.309 1.00 0.00 H new ATOM 0 HG LEU A1604 -13.685 4.246 14.159 1.00 0.00 H new ATOM 0 HD11 LEU A1604 -12.841 1.956 14.538 1.00 0.00 H new ATOM 0 HD12 LEU A1604 -14.171 1.978 13.355 1.00 0.00 H new ATOM 0 HD13 LEU A1604 -12.488 1.805 12.800 1.00 0.00 H new ATOM 0 HD21 LEU A1604 -11.327 3.880 14.751 1.00 0.00 H new ATOM 0 HD22 LEU A1604 -10.912 3.781 13.023 1.00 0.00 H new ATOM 0 HD23 LEU A1604 -11.532 5.304 13.704 1.00 0.00 H new ATOM 1425 N SER A1605 -12.504 5.506 9.477 1.00 0.00 N ATOM 1426 CA SER A1605 -12.497 5.684 8.072 1.00 0.00 C ATOM 1427 C SER A1605 -11.884 4.436 7.452 1.00 0.00 C ATOM 1428 O SER A1605 -11.040 3.783 8.082 1.00 0.00 O ATOM 1429 CB SER A1605 -11.654 6.926 7.752 1.00 0.00 C ATOM 1430 OG SER A1605 -11.801 7.334 6.404 1.00 0.00 O ATOM 0 H SER A1605 -11.699 4.991 9.835 1.00 0.00 H new ATOM 0 HA SER A1605 -13.501 5.828 7.673 1.00 0.00 H new ATOM 0 HB2 SER A1605 -11.947 7.743 8.412 1.00 0.00 H new ATOM 0 HB3 SER A1605 -10.604 6.714 7.954 1.00 0.00 H new ATOM 0 HG SER A1605 -12.589 6.900 6.015 1.00 0.00 H new ATOM 1436 N TYR A1606 -12.355 4.085 6.263 1.00 0.00 N ATOM 1437 CA TYR A1606 -11.852 2.938 5.528 1.00 0.00 C ATOM 1438 C TYR A1606 -10.419 3.176 5.115 1.00 0.00 C ATOM 1439 O TYR A1606 -10.117 4.149 4.418 1.00 0.00 O ATOM 1440 CB TYR A1606 -12.738 2.630 4.311 1.00 0.00 C ATOM 1441 CG TYR A1606 -14.150 2.212 4.666 1.00 0.00 C ATOM 1442 CD1 TYR A1606 -14.444 0.888 4.970 1.00 0.00 C ATOM 1443 CD2 TYR A1606 -15.186 3.134 4.698 1.00 0.00 C ATOM 1444 CE1 TYR A1606 -15.725 0.499 5.299 1.00 0.00 C ATOM 1445 CE2 TYR A1606 -16.470 2.753 5.025 1.00 0.00 C ATOM 1446 CZ TYR A1606 -16.734 1.436 5.327 1.00 0.00 C ATOM 1447 OH TYR A1606 -18.014 1.053 5.654 1.00 0.00 O ATOM 0 H TYR A1606 -13.099 4.591 5.782 1.00 0.00 H new ATOM 0 HA TYR A1606 -11.882 2.066 6.181 1.00 0.00 H new ATOM 0 HB2 TYR A1606 -12.781 3.513 3.673 1.00 0.00 H new ATOM 0 HB3 TYR A1606 -12.272 1.837 3.726 1.00 0.00 H new ATOM 0 HD1 TYR A1606 -13.655 0.151 4.948 1.00 0.00 H new ATOM 0 HD2 TYR A1606 -14.983 4.168 4.463 1.00 0.00 H new ATOM 0 HE1 TYR A1606 -15.936 -0.534 5.533 1.00 0.00 H new ATOM 0 HE2 TYR A1606 -17.265 3.484 5.044 1.00 0.00 H new ATOM 0 HH TYR A1606 -18.606 1.834 5.629 1.00 0.00 H new ATOM 1457 N LYS A1607 -9.549 2.309 5.573 1.00 0.00 N ATOM 1458 CA LYS A1607 -8.135 2.429 5.344 1.00 0.00 C ATOM 1459 C LYS A1607 -7.541 1.080 4.933 1.00 0.00 C ATOM 1460 O LYS A1607 -8.122 0.008 5.208 1.00 0.00 O ATOM 1461 CB LYS A1607 -7.465 2.929 6.629 1.00 0.00 C ATOM 1462 CG LYS A1607 -7.689 2.008 7.824 1.00 0.00 C ATOM 1463 CD LYS A1607 -7.118 2.564 9.115 1.00 0.00 C ATOM 1464 CE LYS A1607 -7.792 3.868 9.515 1.00 0.00 C ATOM 1465 NZ LYS A1607 -7.355 4.313 10.847 1.00 0.00 N1+ ATOM 0 H LYS A1607 -9.810 1.490 6.122 1.00 0.00 H new ATOM 0 HA LYS A1607 -7.959 3.138 4.535 1.00 0.00 H new ATOM 0 HB2 LYS A1607 -6.394 3.033 6.455 1.00 0.00 H new ATOM 0 HB3 LYS A1607 -7.847 3.922 6.867 1.00 0.00 H new ATOM 0 HG2 LYS A1607 -8.758 1.838 7.949 1.00 0.00 H new ATOM 0 HG3 LYS A1607 -7.234 1.039 7.619 1.00 0.00 H new ATOM 0 HD2 LYS A1607 -7.242 1.831 9.912 1.00 0.00 H new ATOM 0 HD3 LYS A1607 -6.047 2.729 8.997 1.00 0.00 H new ATOM 0 HE2 LYS A1607 -7.562 4.638 8.779 1.00 0.00 H new ATOM 0 HE3 LYS A1607 -8.874 3.736 9.511 1.00 0.00 H new ATOM 0 HZ1 LYS A1607 -7.833 5.204 11.089 1.00 0.00 H new ATOM 0 HZ2 LYS A1607 -7.597 3.588 11.552 1.00 0.00 H new ATOM 0 HZ3 LYS A1607 -6.326 4.462 10.843 1.00 0.00 H new ATOM 1479 N SER A1608 -6.413 1.127 4.298 1.00 0.00 N ATOM 1480 CA SER A1608 -5.737 -0.055 3.864 1.00 0.00 C ATOM 1481 C SER A1608 -4.306 -0.062 4.403 1.00 0.00 C ATOM 1482 O SER A1608 -3.618 0.961 4.389 1.00 0.00 O ATOM 1483 CB SER A1608 -5.756 -0.131 2.327 1.00 0.00 C ATOM 1484 OG SER A1608 -5.164 -1.328 1.855 1.00 0.00 O ATOM 0 H SER A1608 -5.931 1.995 4.064 1.00 0.00 H new ATOM 0 HA SER A1608 -6.249 -0.935 4.254 1.00 0.00 H new ATOM 0 HB2 SER A1608 -6.785 -0.069 1.972 1.00 0.00 H new ATOM 0 HB3 SER A1608 -5.224 0.726 1.914 1.00 0.00 H new ATOM 0 HG SER A1608 -5.866 -1.969 1.618 1.00 0.00 H new ATOM 1490 N VAL A1609 -3.882 -1.194 4.909 1.00 0.00 N ATOM 1491 CA VAL A1609 -2.541 -1.357 5.428 1.00 0.00 C ATOM 1492 C VAL A1609 -1.821 -2.370 4.570 1.00 0.00 C ATOM 1493 O VAL A1609 -2.235 -3.531 4.496 1.00 0.00 O ATOM 1494 CB VAL A1609 -2.544 -1.836 6.916 1.00 0.00 C ATOM 1495 CG1 VAL A1609 -1.122 -2.068 7.433 1.00 0.00 C ATOM 1496 CG2 VAL A1609 -3.257 -0.828 7.802 1.00 0.00 C ATOM 0 H VAL A1609 -4.458 -2.033 4.974 1.00 0.00 H new ATOM 0 HA VAL A1609 -2.036 -0.391 5.400 1.00 0.00 H new ATOM 0 HB VAL A1609 -3.079 -2.785 6.952 1.00 0.00 H new ATOM 0 HG11 VAL A1609 -1.162 -2.400 8.470 1.00 0.00 H new ATOM 0 HG12 VAL A1609 -0.634 -2.831 6.826 1.00 0.00 H new ATOM 0 HG13 VAL A1609 -0.556 -1.138 7.371 1.00 0.00 H new ATOM 0 HG21 VAL A1609 -3.248 -1.180 8.834 1.00 0.00 H new ATOM 0 HG22 VAL A1609 -2.747 0.134 7.742 1.00 0.00 H new ATOM 0 HG23 VAL A1609 -4.288 -0.714 7.466 1.00 0.00 H new ATOM 1506 N ILE A1610 -0.787 -1.940 3.900 1.00 0.00 N ATOM 1507 CA ILE A1610 -0.027 -2.813 3.051 1.00 0.00 C ATOM 1508 C ILE A1610 1.288 -3.163 3.745 1.00 0.00 C ATOM 1509 O ILE A1610 2.093 -2.275 4.063 1.00 0.00 O ATOM 1510 CB ILE A1610 0.261 -2.168 1.671 1.00 0.00 C ATOM 1511 CG1 ILE A1610 -1.053 -1.685 1.031 1.00 0.00 C ATOM 1512 CG2 ILE A1610 0.953 -3.182 0.755 1.00 0.00 C ATOM 1513 CD1 ILE A1610 -0.870 -0.955 -0.284 1.00 0.00 C ATOM 0 H ILE A1610 -0.449 -0.978 3.927 1.00 0.00 H new ATOM 0 HA ILE A1610 -0.613 -3.715 2.875 1.00 0.00 H new ATOM 0 HB ILE A1610 0.920 -1.311 1.810 1.00 0.00 H new ATOM 0 HG12 ILE A1610 -1.703 -2.545 0.869 1.00 0.00 H new ATOM 0 HG13 ILE A1610 -1.565 -1.026 1.732 1.00 0.00 H new ATOM 0 HG21 ILE A1610 1.152 -2.722 -0.213 1.00 0.00 H new ATOM 0 HG22 ILE A1610 1.893 -3.498 1.207 1.00 0.00 H new ATOM 0 HG23 ILE A1610 0.307 -4.049 0.618 1.00 0.00 H new ATOM 0 HD11 ILE A1610 -1.843 -0.648 -0.668 1.00 0.00 H new ATOM 0 HD12 ILE A1610 -0.247 -0.074 -0.128 1.00 0.00 H new ATOM 0 HD13 ILE A1610 -0.388 -1.617 -1.004 1.00 0.00 H new ATOM 1525 N SER A1611 1.476 -4.430 4.005 1.00 0.00 N ATOM 1526 CA SER A1611 2.640 -4.922 4.688 1.00 0.00 C ATOM 1527 C SER A1611 3.569 -5.608 3.667 1.00 0.00 C ATOM 1528 O SER A1611 3.245 -6.687 3.133 1.00 0.00 O ATOM 1529 CB SER A1611 2.166 -5.911 5.774 1.00 0.00 C ATOM 1530 OG SER A1611 3.194 -6.263 6.686 1.00 0.00 O ATOM 0 H SER A1611 0.813 -5.160 3.743 1.00 0.00 H new ATOM 0 HA SER A1611 3.199 -4.114 5.160 1.00 0.00 H new ATOM 0 HB2 SER A1611 1.335 -5.469 6.324 1.00 0.00 H new ATOM 0 HB3 SER A1611 1.787 -6.814 5.296 1.00 0.00 H new ATOM 0 HG SER A1611 2.840 -6.889 7.352 1.00 0.00 H new ATOM 1536 N PHE A1612 4.686 -4.973 3.380 1.00 0.00 N ATOM 1537 CA PHE A1612 5.666 -5.472 2.426 1.00 0.00 C ATOM 1538 C PHE A1612 6.667 -6.355 3.149 1.00 0.00 C ATOM 1539 O PHE A1612 7.597 -5.866 3.792 1.00 0.00 O ATOM 1540 CB PHE A1612 6.414 -4.320 1.732 1.00 0.00 C ATOM 1541 CG PHE A1612 5.559 -3.392 0.908 1.00 0.00 C ATOM 1542 CD1 PHE A1612 4.852 -2.361 1.503 1.00 0.00 C ATOM 1543 CD2 PHE A1612 5.483 -3.540 -0.463 1.00 0.00 C ATOM 1544 CE1 PHE A1612 4.085 -1.507 0.747 1.00 0.00 C ATOM 1545 CE2 PHE A1612 4.713 -2.688 -1.227 1.00 0.00 C ATOM 1546 CZ PHE A1612 4.013 -1.669 -0.621 1.00 0.00 C ATOM 0 H PHE A1612 4.946 -4.084 3.806 1.00 0.00 H new ATOM 0 HA PHE A1612 5.137 -6.043 1.663 1.00 0.00 H new ATOM 0 HB2 PHE A1612 6.927 -3.733 2.494 1.00 0.00 H new ATOM 0 HB3 PHE A1612 7.182 -4.746 1.087 1.00 0.00 H new ATOM 0 HD1 PHE A1612 4.904 -2.226 2.573 1.00 0.00 H new ATOM 0 HD2 PHE A1612 6.034 -4.334 -0.944 1.00 0.00 H new ATOM 0 HE1 PHE A1612 3.538 -0.708 1.225 1.00 0.00 H new ATOM 0 HE2 PHE A1612 4.659 -2.820 -2.298 1.00 0.00 H new ATOM 0 HZ PHE A1612 3.409 -0.999 -1.215 1.00 0.00 H new ATOM 1556 N VAL A1613 6.469 -7.632 3.040 1.00 0.00 N ATOM 1557 CA VAL A1613 7.292 -8.610 3.712 1.00 0.00 C ATOM 1558 C VAL A1613 8.422 -9.043 2.778 1.00 0.00 C ATOM 1559 O VAL A1613 8.192 -9.272 1.575 1.00 0.00 O ATOM 1560 CB VAL A1613 6.442 -9.847 4.126 1.00 0.00 C ATOM 1561 CG1 VAL A1613 7.264 -10.864 4.906 1.00 0.00 C ATOM 1562 CG2 VAL A1613 5.225 -9.421 4.933 1.00 0.00 C ATOM 0 H VAL A1613 5.723 -8.038 2.476 1.00 0.00 H new ATOM 0 HA VAL A1613 7.711 -8.164 4.614 1.00 0.00 H new ATOM 0 HB VAL A1613 6.104 -10.328 3.208 1.00 0.00 H new ATOM 0 HG11 VAL A1613 6.634 -11.711 5.176 1.00 0.00 H new ATOM 0 HG12 VAL A1613 8.094 -11.211 4.290 1.00 0.00 H new ATOM 0 HG13 VAL A1613 7.654 -10.399 5.812 1.00 0.00 H new ATOM 0 HG21 VAL A1613 4.646 -10.302 5.211 1.00 0.00 H new ATOM 0 HG22 VAL A1613 5.550 -8.901 5.834 1.00 0.00 H new ATOM 0 HG23 VAL A1613 4.606 -8.755 4.333 1.00 0.00 H new ATOM 1572 N CYS A1614 9.621 -9.123 3.326 1.00 0.00 N ATOM 1573 CA CYS A1614 10.824 -9.498 2.591 1.00 0.00 C ATOM 1574 C CYS A1614 10.731 -10.939 2.139 1.00 0.00 C ATOM 1575 O CYS A1614 10.672 -11.851 2.972 1.00 0.00 O ATOM 1576 CB CYS A1614 12.034 -9.346 3.501 1.00 0.00 C ATOM 1577 SG CYS A1614 12.088 -7.758 4.360 1.00 0.00 S ATOM 0 H CYS A1614 9.793 -8.926 4.312 1.00 0.00 H new ATOM 0 HA CYS A1614 10.923 -8.852 1.719 1.00 0.00 H new ATOM 0 HB2 CYS A1614 12.029 -10.149 4.238 1.00 0.00 H new ATOM 0 HB3 CYS A1614 12.942 -9.462 2.909 1.00 0.00 H new ATOM 1582 N ARG A1615 10.691 -11.150 0.848 1.00 0.00 N ATOM 1583 CA ARG A1615 10.602 -12.482 0.320 1.00 0.00 C ATOM 1584 C ARG A1615 11.316 -12.556 -1.031 1.00 0.00 C ATOM 1585 O ARG A1615 10.949 -11.850 -1.956 1.00 0.00 O ATOM 1586 CB ARG A1615 9.133 -12.872 0.164 1.00 0.00 C ATOM 1587 CG ARG A1615 8.910 -14.328 -0.171 1.00 0.00 C ATOM 1588 CD ARG A1615 7.433 -14.646 -0.312 1.00 0.00 C ATOM 1589 NE ARG A1615 7.211 -16.063 -0.560 1.00 0.00 N ATOM 1590 CZ ARG A1615 6.108 -16.606 -1.078 1.00 0.00 C ATOM 1591 NH1 ARG A1615 5.078 -15.855 -1.413 1.00 0.00 N1+ ATOM 1592 NH2 ARG A1615 6.047 -17.913 -1.272 1.00 0.00 N ATOM 0 H ARG A1615 10.719 -10.413 0.144 1.00 0.00 H new ATOM 0 HA ARG A1615 11.084 -13.177 1.008 1.00 0.00 H new ATOM 0 HB2 ARG A1615 8.607 -12.639 1.090 1.00 0.00 H new ATOM 0 HB3 ARG A1615 8.687 -12.258 -0.619 1.00 0.00 H new ATOM 0 HG2 ARG A1615 9.426 -14.572 -1.100 1.00 0.00 H new ATOM 0 HG3 ARG A1615 9.345 -14.953 0.609 1.00 0.00 H new ATOM 0 HD2 ARG A1615 6.908 -14.348 0.596 1.00 0.00 H new ATOM 0 HD3 ARG A1615 7.011 -14.062 -1.130 1.00 0.00 H new ATOM 0 HE ARG A1615 7.969 -16.700 -0.315 1.00 0.00 H new ATOM 0 HH11 ARG A1615 5.118 -14.845 -1.277 1.00 0.00 H new ATOM 0 HH12 ARG A1615 4.241 -16.284 -1.808 1.00 0.00 H new ATOM 0 HH21 ARG A1615 6.842 -18.503 -1.026 1.00 0.00 H new ATOM 0 HH22 ARG A1615 5.205 -18.331 -1.668 1.00 0.00 H new ATOM 1606 N PRO A1616 12.383 -13.378 -1.136 1.00 0.00 N ATOM 1607 CA PRO A1616 13.136 -13.580 -2.400 1.00 0.00 C ATOM 1608 C PRO A1616 12.328 -14.340 -3.470 1.00 0.00 C ATOM 1609 O PRO A1616 12.667 -14.310 -4.647 1.00 0.00 O ATOM 1610 CB PRO A1616 14.351 -14.423 -1.976 1.00 0.00 C ATOM 1611 CG PRO A1616 14.413 -14.314 -0.490 1.00 0.00 C ATOM 1612 CD PRO A1616 13.001 -14.121 -0.023 1.00 0.00 C ATOM 0 HA PRO A1616 13.391 -12.624 -2.857 1.00 0.00 H new ATOM 0 HB2 PRO A1616 14.237 -15.461 -2.289 1.00 0.00 H new ATOM 0 HB3 PRO A1616 15.267 -14.050 -2.435 1.00 0.00 H new ATOM 0 HG2 PRO A1616 14.848 -15.212 -0.052 1.00 0.00 H new ATOM 0 HG3 PRO A1616 15.041 -13.476 -0.187 1.00 0.00 H new ATOM 0 HD2 PRO A1616 12.501 -15.073 0.154 1.00 0.00 H new ATOM 0 HD3 PRO A1616 12.958 -13.560 0.910 1.00 0.00 H new ATOM 1694 N ARG A1623 2.269 -9.368 -6.098 1.00 0.00 N ATOM 1695 CA ARG A1623 0.873 -9.054 -6.111 1.00 0.00 C ATOM 1696 C ARG A1623 0.434 -8.777 -4.692 1.00 0.00 C ATOM 1697 O ARG A1623 0.866 -9.474 -3.768 1.00 0.00 O ATOM 1698 CB ARG A1623 0.072 -10.255 -6.643 1.00 0.00 C ATOM 1699 CG ARG A1623 0.464 -10.724 -8.033 1.00 0.00 C ATOM 1700 CD ARG A1623 -0.311 -11.970 -8.432 1.00 0.00 C ATOM 1701 NE ARG A1623 0.073 -12.445 -9.765 1.00 0.00 N ATOM 1702 CZ ARG A1623 -0.474 -13.487 -10.413 1.00 0.00 C ATOM 1703 NH1 ARG A1623 -1.426 -14.221 -9.839 1.00 0.00 N1+ ATOM 1704 NH2 ARG A1623 -0.050 -13.800 -11.630 1.00 0.00 N ATOM 0 HA ARG A1623 0.699 -8.188 -6.750 1.00 0.00 H new ATOM 0 HB2 ARG A1623 0.190 -11.087 -5.949 1.00 0.00 H new ATOM 0 HB3 ARG A1623 -0.986 -9.993 -6.650 1.00 0.00 H new ATOM 0 HG2 ARG A1623 0.276 -9.929 -8.754 1.00 0.00 H new ATOM 0 HG3 ARG A1623 1.533 -10.933 -8.061 1.00 0.00 H new ATOM 0 HD2 ARG A1623 -0.134 -12.758 -7.700 1.00 0.00 H new ATOM 0 HD3 ARG A1623 -1.379 -11.754 -8.416 1.00 0.00 H new ATOM 0 HE ARG A1623 0.820 -11.940 -10.242 1.00 0.00 H new ATOM 0 HH11 ARG A1623 -1.747 -13.994 -8.898 1.00 0.00 H new ATOM 0 HH12 ARG A1623 -1.834 -15.010 -10.341 1.00 0.00 H new ATOM 0 HH21 ARG A1623 0.688 -13.251 -12.070 1.00 0.00 H new ATOM 0 HH22 ARG A1623 -0.462 -14.590 -12.126 1.00 0.00 H new ATOM 1718 N PRO A1624 -0.381 -7.750 -4.474 1.00 0.00 N ATOM 1719 CA PRO A1624 -0.925 -7.483 -3.156 1.00 0.00 C ATOM 1720 C PRO A1624 -2.008 -8.514 -2.826 1.00 0.00 C ATOM 1721 O PRO A1624 -2.999 -8.665 -3.570 1.00 0.00 O ATOM 1722 CB PRO A1624 -1.530 -6.082 -3.288 1.00 0.00 C ATOM 1723 CG PRO A1624 -1.815 -5.911 -4.746 1.00 0.00 C ATOM 1724 CD PRO A1624 -0.820 -6.762 -5.483 1.00 0.00 C ATOM 0 HA PRO A1624 -0.182 -7.541 -2.360 1.00 0.00 H new ATOM 0 HB2 PRO A1624 -2.440 -5.989 -2.696 1.00 0.00 H new ATOM 0 HB3 PRO A1624 -0.838 -5.319 -2.930 1.00 0.00 H new ATOM 0 HG2 PRO A1624 -2.835 -6.218 -4.980 1.00 0.00 H new ATOM 0 HG3 PRO A1624 -1.722 -4.865 -5.039 1.00 0.00 H new ATOM 0 HD2 PRO A1624 -1.273 -7.248 -6.347 1.00 0.00 H new ATOM 0 HD3 PRO A1624 0.017 -6.169 -5.852 1.00 0.00 H new ATOM 1732 N MET A1625 -1.824 -9.223 -1.751 1.00 0.00 N ATOM 1733 CA MET A1625 -2.757 -10.253 -1.369 1.00 0.00 C ATOM 1734 C MET A1625 -3.476 -9.823 -0.106 1.00 0.00 C ATOM 1735 O MET A1625 -2.840 -9.359 0.849 1.00 0.00 O ATOM 1736 CB MET A1625 -2.028 -11.594 -1.160 1.00 0.00 C ATOM 1737 CG MET A1625 -2.953 -12.792 -0.977 1.00 0.00 C ATOM 1738 SD MET A1625 -4.000 -13.085 -2.431 1.00 0.00 S ATOM 1739 CE MET A1625 -4.885 -14.564 -1.929 1.00 0.00 C ATOM 0 H MET A1625 -1.033 -9.109 -1.117 1.00 0.00 H new ATOM 0 HA MET A1625 -3.488 -10.398 -2.165 1.00 0.00 H new ATOM 0 HB2 MET A1625 -1.380 -11.779 -2.017 1.00 0.00 H new ATOM 0 HB3 MET A1625 -1.384 -11.511 -0.285 1.00 0.00 H new ATOM 0 HG2 MET A1625 -2.356 -13.682 -0.777 1.00 0.00 H new ATOM 0 HG3 MET A1625 -3.585 -12.630 -0.104 1.00 0.00 H new ATOM 0 HE1 MET A1625 -5.568 -14.866 -2.723 1.00 0.00 H new ATOM 0 HE2 MET A1625 -4.173 -15.367 -1.738 1.00 0.00 H new ATOM 0 HE3 MET A1625 -5.452 -14.358 -1.021 1.00 0.00 H new ATOM 1749 N LEU A1626 -4.784 -9.942 -0.115 1.00 0.00 N ATOM 1750 CA LEU A1626 -5.610 -9.539 0.996 1.00 0.00 C ATOM 1751 C LEU A1626 -5.517 -10.629 2.065 1.00 0.00 C ATOM 1752 O LEU A1626 -5.894 -11.784 1.823 1.00 0.00 O ATOM 1753 CB LEU A1626 -7.052 -9.375 0.496 1.00 0.00 C ATOM 1754 CG LEU A1626 -7.942 -8.353 1.218 1.00 0.00 C ATOM 1755 CD1 LEU A1626 -9.290 -8.285 0.543 1.00 0.00 C ATOM 1756 CD2 LEU A1626 -8.107 -8.678 2.685 1.00 0.00 C ATOM 0 H LEU A1626 -5.308 -10.325 -0.902 1.00 0.00 H new ATOM 0 HA LEU A1626 -5.282 -8.591 1.422 1.00 0.00 H new ATOM 0 HB2 LEU A1626 -7.013 -9.101 -0.558 1.00 0.00 H new ATOM 0 HB3 LEU A1626 -7.541 -10.347 0.555 1.00 0.00 H new ATOM 0 HG LEU A1626 -7.451 -7.382 1.156 1.00 0.00 H new ATOM 0 HD11 LEU A1626 -9.919 -7.559 1.058 1.00 0.00 H new ATOM 0 HD12 LEU A1626 -9.162 -7.982 -0.496 1.00 0.00 H new ATOM 0 HD13 LEU A1626 -9.765 -9.266 0.579 1.00 0.00 H new ATOM 0 HD21 LEU A1626 -8.744 -7.928 3.154 1.00 0.00 H new ATOM 0 HD22 LEU A1626 -8.566 -9.661 2.791 1.00 0.00 H new ATOM 0 HD23 LEU A1626 -7.131 -8.679 3.169 1.00 0.00 H new ATOM 1768 N ILE A1627 -5.001 -10.271 3.215 1.00 0.00 N ATOM 1769 CA ILE A1627 -4.773 -11.220 4.284 1.00 0.00 C ATOM 1770 C ILE A1627 -5.921 -11.206 5.294 1.00 0.00 C ATOM 1771 O ILE A1627 -6.444 -12.256 5.675 1.00 0.00 O ATOM 1772 CB ILE A1627 -3.411 -10.936 4.998 1.00 0.00 C ATOM 1773 CG1 ILE A1627 -2.240 -11.036 3.999 1.00 0.00 C ATOM 1774 CG2 ILE A1627 -3.183 -11.869 6.187 1.00 0.00 C ATOM 1775 CD1 ILE A1627 -2.097 -12.393 3.317 1.00 0.00 C ATOM 0 H ILE A1627 -4.726 -9.315 3.439 1.00 0.00 H new ATOM 0 HA ILE A1627 -4.729 -12.214 3.839 1.00 0.00 H new ATOM 0 HB ILE A1627 -3.455 -9.918 5.386 1.00 0.00 H new ATOM 0 HG12 ILE A1627 -2.368 -10.271 3.233 1.00 0.00 H new ATOM 0 HG13 ILE A1627 -1.312 -10.809 4.524 1.00 0.00 H new ATOM 0 HG21 ILE A1627 -2.226 -11.637 6.653 1.00 0.00 H new ATOM 0 HG22 ILE A1627 -3.983 -11.734 6.914 1.00 0.00 H new ATOM 0 HG23 ILE A1627 -3.177 -12.903 5.842 1.00 0.00 H new ATOM 0 HD11 ILE A1627 -1.248 -12.369 2.633 1.00 0.00 H new ATOM 0 HD12 ILE A1627 -1.934 -13.164 4.071 1.00 0.00 H new ATOM 0 HD13 ILE A1627 -3.006 -12.617 2.759 1.00 0.00 H new ATOM 1787 N SER A1628 -6.326 -10.034 5.715 1.00 0.00 N ATOM 1788 CA SER A1628 -7.378 -9.913 6.695 1.00 0.00 C ATOM 1789 C SER A1628 -8.327 -8.782 6.308 1.00 0.00 C ATOM 1790 O SER A1628 -7.890 -7.656 6.019 1.00 0.00 O ATOM 1791 CB SER A1628 -6.769 -9.656 8.081 1.00 0.00 C ATOM 1792 OG SER A1628 -5.808 -10.663 8.428 1.00 0.00 O ATOM 0 H SER A1628 -5.942 -9.146 5.393 1.00 0.00 H new ATOM 0 HA SER A1628 -7.946 -10.843 6.729 1.00 0.00 H new ATOM 0 HB2 SER A1628 -6.292 -8.676 8.094 1.00 0.00 H new ATOM 0 HB3 SER A1628 -7.561 -9.634 8.829 1.00 0.00 H new ATOM 0 HG SER A1628 -5.438 -10.470 9.315 1.00 0.00 H new ATOM 1798 N LEU A1629 -9.598 -9.094 6.248 1.00 0.00 N ATOM 1799 CA LEU A1629 -10.618 -8.125 5.919 1.00 0.00 C ATOM 1800 C LEU A1629 -11.327 -7.764 7.220 1.00 0.00 C ATOM 1801 O LEU A1629 -12.042 -8.601 7.792 1.00 0.00 O ATOM 1802 CB LEU A1629 -11.627 -8.763 4.923 1.00 0.00 C ATOM 1803 CG LEU A1629 -12.573 -7.832 4.107 1.00 0.00 C ATOM 1804 CD1 LEU A1629 -13.417 -6.910 4.970 1.00 0.00 C ATOM 1805 CD2 LEU A1629 -11.797 -7.050 3.075 1.00 0.00 C ATOM 0 H LEU A1629 -9.958 -10.032 6.427 1.00 0.00 H new ATOM 0 HA LEU A1629 -10.189 -7.237 5.456 1.00 0.00 H new ATOM 0 HB2 LEU A1629 -11.055 -9.357 4.210 1.00 0.00 H new ATOM 0 HB3 LEU A1629 -12.252 -9.456 5.486 1.00 0.00 H new ATOM 0 HG LEU A1629 -13.278 -8.489 3.598 1.00 0.00 H new ATOM 0 HD11 LEU A1629 -14.050 -6.293 4.332 1.00 0.00 H new ATOM 0 HD12 LEU A1629 -14.043 -7.506 5.635 1.00 0.00 H new ATOM 0 HD13 LEU A1629 -12.765 -6.269 5.563 1.00 0.00 H new ATOM 0 HD21 LEU A1629 -12.478 -6.407 2.518 1.00 0.00 H new ATOM 0 HD22 LEU A1629 -11.045 -6.437 3.572 1.00 0.00 H new ATOM 0 HD23 LEU A1629 -11.306 -7.740 2.389 1.00 0.00 H new ATOM 1817 N ASP A1630 -11.123 -6.570 7.703 1.00 0.00 N ATOM 1818 CA ASP A1630 -11.775 -6.154 8.924 1.00 0.00 C ATOM 1819 C ASP A1630 -12.688 -4.978 8.653 1.00 0.00 C ATOM 1820 O ASP A1630 -12.220 -3.870 8.396 1.00 0.00 O ATOM 1821 CB ASP A1630 -10.759 -5.781 9.998 1.00 0.00 C ATOM 1822 CG ASP A1630 -11.419 -5.521 11.332 1.00 0.00 C ATOM 1823 OD1 ASP A1630 -11.882 -4.408 11.575 1.00 0.00 O1- ATOM 1824 OD2 ASP A1630 -11.489 -6.457 12.160 1.00 0.00 O ATOM 0 H ASP A1630 -10.516 -5.869 7.278 1.00 0.00 H new ATOM 0 HA ASP A1630 -12.364 -6.995 9.290 1.00 0.00 H new ATOM 0 HB2 ASP A1630 -10.031 -6.585 10.104 1.00 0.00 H new ATOM 0 HB3 ASP A1630 -10.210 -4.893 9.685 1.00 0.00 H new ATOM 1829 N LYS A1631 -13.979 -5.213 8.684 1.00 0.00 N ATOM 1830 CA LYS A1631 -14.953 -4.156 8.445 1.00 0.00 C ATOM 1831 C LYS A1631 -15.244 -3.367 9.702 1.00 0.00 C ATOM 1832 O LYS A1631 -15.740 -2.250 9.624 1.00 0.00 O ATOM 1833 CB LYS A1631 -16.261 -4.706 7.869 1.00 0.00 C ATOM 1834 CG LYS A1631 -16.141 -5.262 6.461 1.00 0.00 C ATOM 1835 CD LYS A1631 -17.463 -5.833 5.951 1.00 0.00 C ATOM 1836 CE LYS A1631 -18.561 -4.774 5.850 1.00 0.00 C ATOM 1837 NZ LYS A1631 -19.835 -5.344 5.367 1.00 0.00 N1+ ATOM 0 H LYS A1631 -14.387 -6.128 8.873 1.00 0.00 H new ATOM 0 HA LYS A1631 -14.504 -3.488 7.710 1.00 0.00 H new ATOM 0 HB2 LYS A1631 -16.631 -5.492 8.527 1.00 0.00 H new ATOM 0 HB3 LYS A1631 -17.007 -3.911 7.871 1.00 0.00 H new ATOM 0 HG2 LYS A1631 -15.804 -4.473 5.788 1.00 0.00 H new ATOM 0 HG3 LYS A1631 -15.380 -6.042 6.444 1.00 0.00 H new ATOM 0 HD2 LYS A1631 -17.306 -6.283 4.971 1.00 0.00 H new ATOM 0 HD3 LYS A1631 -17.792 -6.630 6.618 1.00 0.00 H new ATOM 0 HE2 LYS A1631 -18.715 -4.317 6.828 1.00 0.00 H new ATOM 0 HE3 LYS A1631 -18.239 -3.981 5.175 1.00 0.00 H new ATOM 0 HZ1 LYS A1631 -20.553 -4.593 5.313 1.00 0.00 H new ATOM 0 HZ2 LYS A1631 -19.695 -5.758 4.423 1.00 0.00 H new ATOM 0 HZ3 LYS A1631 -20.156 -6.083 6.024 1.00 0.00 H new ATOM 1851 N GLN A1632 -14.901 -3.926 10.848 1.00 0.00 N ATOM 1852 CA GLN A1632 -15.198 -3.289 12.130 1.00 0.00 C ATOM 1853 C GLN A1632 -14.382 -2.025 12.309 1.00 0.00 C ATOM 1854 O GLN A1632 -14.923 -0.957 12.593 1.00 0.00 O ATOM 1855 CB GLN A1632 -14.973 -4.249 13.297 1.00 0.00 C ATOM 1856 CG GLN A1632 -15.901 -5.452 13.290 1.00 0.00 C ATOM 1857 CD GLN A1632 -15.694 -6.364 14.477 1.00 0.00 C ATOM 1858 OE1 GLN A1632 -14.589 -6.471 15.024 1.00 0.00 O ATOM 1859 NE2 GLN A1632 -16.729 -7.051 14.866 1.00 0.00 N ATOM 0 H GLN A1632 -14.416 -4.820 10.923 1.00 0.00 H new ATOM 0 HA GLN A1632 -16.253 -3.016 12.124 1.00 0.00 H new ATOM 0 HB2 GLN A1632 -13.941 -4.598 13.274 1.00 0.00 H new ATOM 0 HB3 GLN A1632 -15.105 -3.706 14.233 1.00 0.00 H new ATOM 0 HG2 GLN A1632 -16.935 -5.106 13.280 1.00 0.00 H new ATOM 0 HG3 GLN A1632 -15.746 -6.019 12.372 1.00 0.00 H new ATOM 0 HE21 GLN A1632 -17.625 -6.937 14.391 1.00 0.00 H new ATOM 0 HE22 GLN A1632 -16.644 -7.703 15.646 1.00 0.00 H new ATOM 1868 N THR A1633 -13.101 -2.141 12.103 1.00 0.00 N ATOM 1869 CA THR A1633 -12.218 -1.015 12.215 1.00 0.00 C ATOM 1870 C THR A1633 -11.899 -0.445 10.833 1.00 0.00 C ATOM 1871 O THR A1633 -11.073 0.477 10.685 1.00 0.00 O ATOM 1872 CB THR A1633 -10.930 -1.386 12.982 1.00 0.00 C ATOM 1873 OG1 THR A1633 -10.285 -2.525 12.373 1.00 0.00 O ATOM 1874 CG2 THR A1633 -11.256 -1.701 14.437 1.00 0.00 C ATOM 0 H THR A1633 -12.640 -3.016 11.853 1.00 0.00 H new ATOM 0 HA THR A1633 -12.725 -0.241 12.791 1.00 0.00 H new ATOM 0 HB THR A1633 -10.252 -0.534 12.941 1.00 0.00 H new ATOM 0 HG1 THR A1633 -10.865 -3.311 12.454 1.00 0.00 H new ATOM 0 HG21 THR A1633 -10.340 -1.961 14.967 1.00 0.00 H new ATOM 0 HG22 THR A1633 -11.711 -0.828 14.905 1.00 0.00 H new ATOM 0 HG23 THR A1633 -11.951 -2.540 14.481 1.00 0.00 H new ATOM 1882 N CYS A1634 -12.563 -1.034 9.827 1.00 0.00 N ATOM 1883 CA CYS A1634 -12.486 -0.635 8.417 1.00 0.00 C ATOM 1884 C CYS A1634 -11.055 -0.679 7.903 1.00 0.00 C ATOM 1885 O CYS A1634 -10.602 0.221 7.199 1.00 0.00 O ATOM 1886 CB CYS A1634 -13.054 0.762 8.227 1.00 0.00 C ATOM 1887 SG CYS A1634 -14.731 1.008 8.871 1.00 0.00 S ATOM 0 H CYS A1634 -13.188 -1.826 9.979 1.00 0.00 H new ATOM 0 HA CYS A1634 -13.079 -1.347 7.843 1.00 0.00 H new ATOM 0 HB2 CYS A1634 -12.388 1.477 8.711 1.00 0.00 H new ATOM 0 HB3 CYS A1634 -13.053 0.996 7.162 1.00 0.00 H new ATOM 1892 N THR A1635 -10.355 -1.715 8.239 1.00 0.00 N ATOM 1893 CA THR A1635 -8.987 -1.827 7.866 1.00 0.00 C ATOM 1894 C THR A1635 -8.775 -3.075 7.013 1.00 0.00 C ATOM 1895 O THR A1635 -9.022 -4.203 7.459 1.00 0.00 O ATOM 1896 CB THR A1635 -8.095 -1.864 9.127 1.00 0.00 C ATOM 1897 OG1 THR A1635 -8.420 -0.734 9.970 1.00 0.00 O ATOM 1898 CG2 THR A1635 -6.630 -1.781 8.744 1.00 0.00 C ATOM 0 H THR A1635 -10.716 -2.502 8.777 1.00 0.00 H new ATOM 0 HA THR A1635 -8.707 -0.956 7.273 1.00 0.00 H new ATOM 0 HB THR A1635 -8.274 -2.800 9.656 1.00 0.00 H new ATOM 0 HG1 THR A1635 -7.858 -0.753 10.773 1.00 0.00 H new ATOM 0 HG21 THR A1635 -6.016 -1.808 9.644 1.00 0.00 H new ATOM 0 HG22 THR A1635 -6.373 -2.625 8.104 1.00 0.00 H new ATOM 0 HG23 THR A1635 -6.446 -0.850 8.208 1.00 0.00 H new ATOM 1906 N LEU A1636 -8.382 -2.873 5.780 1.00 0.00 N ATOM 1907 CA LEU A1636 -8.093 -3.976 4.898 1.00 0.00 C ATOM 1908 C LEU A1636 -6.598 -4.221 4.889 1.00 0.00 C ATOM 1909 O LEU A1636 -5.810 -3.326 4.536 1.00 0.00 O ATOM 1910 CB LEU A1636 -8.623 -3.758 3.458 1.00 0.00 C ATOM 1911 CG LEU A1636 -10.158 -3.682 3.259 1.00 0.00 C ATOM 1912 CD1 LEU A1636 -10.761 -2.392 3.807 1.00 0.00 C ATOM 1913 CD2 LEU A1636 -10.530 -3.887 1.795 1.00 0.00 C ATOM 0 H LEU A1636 -8.255 -1.951 5.363 1.00 0.00 H new ATOM 0 HA LEU A1636 -8.617 -4.853 5.279 1.00 0.00 H new ATOM 0 HB2 LEU A1636 -8.189 -2.833 3.077 1.00 0.00 H new ATOM 0 HB3 LEU A1636 -8.244 -4.568 2.835 1.00 0.00 H new ATOM 0 HG LEU A1636 -10.590 -4.496 3.841 1.00 0.00 H new ATOM 0 HD11 LEU A1636 -11.838 -2.394 3.640 1.00 0.00 H new ATOM 0 HD12 LEU A1636 -10.560 -2.322 4.876 1.00 0.00 H new ATOM 0 HD13 LEU A1636 -10.316 -1.537 3.297 1.00 0.00 H new ATOM 0 HD21 LEU A1636 -11.613 -3.829 1.683 1.00 0.00 H new ATOM 0 HD22 LEU A1636 -10.060 -3.113 1.188 1.00 0.00 H new ATOM 0 HD23 LEU A1636 -10.183 -4.866 1.465 1.00 0.00 H new ATOM 1925 N PHE A1637 -6.209 -5.396 5.306 1.00 0.00 N ATOM 1926 CA PHE A1637 -4.811 -5.751 5.397 1.00 0.00 C ATOM 1927 C PHE A1637 -4.354 -6.470 4.139 1.00 0.00 C ATOM 1928 O PHE A1637 -4.882 -7.543 3.794 1.00 0.00 O ATOM 1929 CB PHE A1637 -4.555 -6.650 6.613 1.00 0.00 C ATOM 1930 CG PHE A1637 -4.889 -6.034 7.949 1.00 0.00 C ATOM 1931 CD1 PHE A1637 -3.943 -5.302 8.641 1.00 0.00 C ATOM 1932 CD2 PHE A1637 -6.139 -6.216 8.524 1.00 0.00 C ATOM 1933 CE1 PHE A1637 -4.236 -4.764 9.879 1.00 0.00 C ATOM 1934 CE2 PHE A1637 -6.437 -5.679 9.755 1.00 0.00 C ATOM 1935 CZ PHE A1637 -5.484 -4.955 10.435 1.00 0.00 C ATOM 0 H PHE A1637 -6.849 -6.137 5.593 1.00 0.00 H new ATOM 0 HA PHE A1637 -4.244 -4.827 5.508 1.00 0.00 H new ATOM 0 HB2 PHE A1637 -5.136 -7.565 6.497 1.00 0.00 H new ATOM 0 HB3 PHE A1637 -3.504 -6.939 6.617 1.00 0.00 H new ATOM 0 HD1 PHE A1637 -2.965 -5.149 8.210 1.00 0.00 H new ATOM 0 HD2 PHE A1637 -6.889 -6.788 7.997 1.00 0.00 H new ATOM 0 HE1 PHE A1637 -3.489 -4.194 10.411 1.00 0.00 H new ATOM 0 HE2 PHE A1637 -7.416 -5.825 10.187 1.00 0.00 H new ATOM 0 HZ PHE A1637 -5.713 -4.536 11.404 1.00 0.00 H new ATOM 1945 N PHE A1638 -3.394 -5.897 3.474 1.00 0.00 N ATOM 1946 CA PHE A1638 -2.808 -6.471 2.280 1.00 0.00 C ATOM 1947 C PHE A1638 -1.341 -6.711 2.523 1.00 0.00 C ATOM 1948 O PHE A1638 -0.682 -5.922 3.196 1.00 0.00 O ATOM 1949 CB PHE A1638 -2.958 -5.542 1.059 1.00 0.00 C ATOM 1950 CG PHE A1638 -4.354 -5.369 0.544 1.00 0.00 C ATOM 1951 CD1 PHE A1638 -5.180 -4.393 1.055 1.00 0.00 C ATOM 1952 CD2 PHE A1638 -4.831 -6.177 -0.477 1.00 0.00 C ATOM 1953 CE1 PHE A1638 -6.458 -4.220 0.566 1.00 0.00 C ATOM 1954 CE2 PHE A1638 -6.107 -6.009 -0.974 1.00 0.00 C ATOM 1955 CZ PHE A1638 -6.924 -5.029 -0.451 1.00 0.00 C ATOM 0 H PHE A1638 -2.984 -5.003 3.744 1.00 0.00 H new ATOM 0 HA PHE A1638 -3.332 -7.402 2.065 1.00 0.00 H new ATOM 0 HB2 PHE A1638 -2.563 -4.561 1.321 1.00 0.00 H new ATOM 0 HB3 PHE A1638 -2.338 -5.930 0.251 1.00 0.00 H new ATOM 0 HD1 PHE A1638 -4.822 -3.754 1.849 1.00 0.00 H new ATOM 0 HD2 PHE A1638 -4.196 -6.947 -0.888 1.00 0.00 H new ATOM 0 HE1 PHE A1638 -7.094 -3.451 0.979 1.00 0.00 H new ATOM 0 HE2 PHE A1638 -6.465 -6.644 -1.771 1.00 0.00 H new ATOM 0 HZ PHE A1638 -7.924 -4.895 -0.835 1.00 0.00 H new ATOM 1965 N SER A1639 -0.834 -7.777 2.013 1.00 0.00 N ATOM 1966 CA SER A1639 0.544 -8.047 2.121 1.00 0.00 C ATOM 1967 C SER A1639 1.128 -8.079 0.729 1.00 0.00 C ATOM 1968 O SER A1639 0.467 -8.515 -0.230 1.00 0.00 O ATOM 1969 CB SER A1639 0.794 -9.370 2.865 1.00 0.00 C ATOM 1970 OG SER A1639 2.183 -9.591 3.081 1.00 0.00 O ATOM 0 H SER A1639 -1.369 -8.484 1.509 1.00 0.00 H new ATOM 0 HA SER A1639 1.030 -7.265 2.705 1.00 0.00 H new ATOM 0 HB2 SER A1639 0.274 -9.354 3.823 1.00 0.00 H new ATOM 0 HB3 SER A1639 0.378 -10.197 2.289 1.00 0.00 H new ATOM 0 HG SER A1639 2.462 -10.404 2.611 1.00 0.00 H new ATOM 1976 N TRP A1640 2.306 -7.573 0.610 1.00 0.00 N ATOM 1977 CA TRP A1640 3.027 -7.577 -0.608 1.00 0.00 C ATOM 1978 C TRP A1640 4.348 -8.215 -0.285 1.00 0.00 C ATOM 1979 O TRP A1640 4.924 -7.948 0.768 1.00 0.00 O ATOM 1980 CB TRP A1640 3.221 -6.138 -1.109 1.00 0.00 C ATOM 1981 CG TRP A1640 3.856 -6.009 -2.484 1.00 0.00 C ATOM 1982 CD1 TRP A1640 5.114 -6.392 -2.856 1.00 0.00 C ATOM 1983 CD2 TRP A1640 3.274 -5.404 -3.642 1.00 0.00 C ATOM 1984 NE1 TRP A1640 5.328 -6.104 -4.175 1.00 0.00 N ATOM 1985 CE2 TRP A1640 4.224 -5.487 -4.680 1.00 0.00 C ATOM 1986 CE3 TRP A1640 2.043 -4.811 -3.907 1.00 0.00 C ATOM 1987 CZ2 TRP A1640 3.977 -4.998 -5.959 1.00 0.00 C ATOM 1988 CZ3 TRP A1640 1.802 -4.325 -5.174 1.00 0.00 C ATOM 1989 CH2 TRP A1640 2.764 -4.420 -6.185 1.00 0.00 C ATOM 0 H TRP A1640 2.806 -7.133 1.382 1.00 0.00 H new ATOM 0 HA TRP A1640 2.505 -8.119 -1.397 1.00 0.00 H new ATOM 0 HB2 TRP A1640 2.250 -5.643 -1.128 1.00 0.00 H new ATOM 0 HB3 TRP A1640 3.839 -5.601 -0.390 1.00 0.00 H new ATOM 0 HD1 TRP A1640 5.836 -6.856 -2.201 1.00 0.00 H new ATOM 0 HE1 TRP A1640 6.178 -6.317 -4.697 1.00 0.00 H new ATOM 0 HE3 TRP A1640 1.292 -4.733 -3.135 1.00 0.00 H new ATOM 0 HZ2 TRP A1640 4.717 -5.074 -6.742 1.00 0.00 H new ATOM 0 HZ3 TRP A1640 0.851 -3.861 -5.391 1.00 0.00 H new ATOM 0 HH2 TRP A1640 2.541 -4.027 -7.166 1.00 0.00 H new ATOM 2000 N HIS A1641 4.798 -9.082 -1.110 1.00 0.00 N ATOM 2001 CA HIS A1641 6.040 -9.734 -0.870 1.00 0.00 C ATOM 2002 C HIS A1641 7.090 -9.265 -1.831 1.00 0.00 C ATOM 2003 O HIS A1641 7.043 -9.563 -3.019 1.00 0.00 O ATOM 2004 CB HIS A1641 5.865 -11.240 -0.857 1.00 0.00 C ATOM 2005 CG HIS A1641 5.182 -11.702 0.394 1.00 0.00 C ATOM 2006 ND1 HIS A1641 5.692 -12.058 1.580 1.00 0.00 N flip ATOM 2007 CD2 HIS A1641 3.823 -11.813 0.525 1.00 0.00 C flip ATOM 2008 CE1 HIS A1641 4.652 -12.375 2.398 1.00 0.00 C flip ATOM 2009 NE2 HIS A1641 3.528 -12.217 1.735 1.00 0.00 N flip ATOM 0 H HIS A1641 4.324 -9.363 -1.968 1.00 0.00 H new ATOM 0 HA HIS A1641 6.396 -9.459 0.123 1.00 0.00 H new ATOM 0 HB2 HIS A1641 5.283 -11.547 -1.726 1.00 0.00 H new ATOM 0 HB3 HIS A1641 6.839 -11.721 -0.940 1.00 0.00 H new ATOM 0 HD2 HIS A1641 3.104 -11.600 -0.252 1.00 0.00 H new ATOM 0 HE1 HIS A1641 4.736 -12.703 3.424 1.00 0.00 H new ATOM 0 HE2 HIS A1641 2.590 -12.381 2.100 1.00 0.00 H new ATOM 2018 N THR A1642 8.023 -8.516 -1.308 1.00 0.00 N ATOM 2019 CA THR A1642 9.045 -7.915 -2.100 1.00 0.00 C ATOM 2020 C THR A1642 10.409 -8.195 -1.474 1.00 0.00 C ATOM 2021 O THR A1642 10.543 -8.276 -0.247 1.00 0.00 O ATOM 2022 CB THR A1642 8.807 -6.363 -2.240 1.00 0.00 C ATOM 2023 OG1 THR A1642 9.799 -5.777 -3.085 1.00 0.00 O ATOM 2024 CG2 THR A1642 8.831 -5.649 -0.895 1.00 0.00 C ATOM 0 H THR A1642 8.090 -8.308 -0.312 1.00 0.00 H new ATOM 0 HA THR A1642 9.016 -8.348 -3.100 1.00 0.00 H new ATOM 0 HB THR A1642 7.816 -6.242 -2.678 1.00 0.00 H new ATOM 0 HG1 THR A1642 9.429 -5.647 -3.983 1.00 0.00 H new ATOM 0 HG21 THR A1642 8.662 -4.583 -1.046 1.00 0.00 H new ATOM 0 HG22 THR A1642 8.047 -6.053 -0.254 1.00 0.00 H new ATOM 0 HG23 THR A1642 9.801 -5.799 -0.421 1.00 0.00 H new ATOM 2032 N PRO A1643 11.434 -8.403 -2.298 1.00 0.00 N ATOM 2033 CA PRO A1643 12.791 -8.615 -1.825 1.00 0.00 C ATOM 2034 C PRO A1643 13.499 -7.278 -1.557 1.00 0.00 C ATOM 2035 O PRO A1643 14.664 -7.243 -1.158 1.00 0.00 O ATOM 2036 CB PRO A1643 13.438 -9.360 -2.990 1.00 0.00 C ATOM 2037 CG PRO A1643 12.758 -8.824 -4.198 1.00 0.00 C ATOM 2038 CD PRO A1643 11.349 -8.503 -3.783 1.00 0.00 C ATOM 0 HA PRO A1643 12.842 -9.160 -0.882 1.00 0.00 H new ATOM 0 HB2 PRO A1643 14.513 -9.182 -3.027 1.00 0.00 H new ATOM 0 HB3 PRO A1643 13.297 -10.437 -2.900 1.00 0.00 H new ATOM 0 HG2 PRO A1643 13.267 -7.934 -4.567 1.00 0.00 H new ATOM 0 HG3 PRO A1643 12.768 -9.555 -5.006 1.00 0.00 H new ATOM 0 HD2 PRO A1643 11.003 -7.570 -4.228 1.00 0.00 H new ATOM 0 HD3 PRO A1643 10.653 -9.282 -4.093 1.00 0.00 H new ATOM 2046 N LEU A1644 12.774 -6.185 -1.778 1.00 0.00 N ATOM 2047 CA LEU A1644 13.298 -4.844 -1.607 1.00 0.00 C ATOM 2048 C LEU A1644 13.032 -4.319 -0.201 1.00 0.00 C ATOM 2049 O LEU A1644 13.504 -3.251 0.166 1.00 0.00 O ATOM 2050 CB LEU A1644 12.675 -3.897 -2.639 1.00 0.00 C ATOM 2051 CG LEU A1644 12.976 -4.203 -4.110 1.00 0.00 C ATOM 2052 CD1 LEU A1644 12.201 -3.259 -5.017 1.00 0.00 C ATOM 2053 CD2 LEU A1644 14.470 -4.090 -4.392 1.00 0.00 C ATOM 0 H LEU A1644 11.801 -6.211 -2.083 1.00 0.00 H new ATOM 0 HA LEU A1644 14.377 -4.887 -1.757 1.00 0.00 H new ATOM 0 HB2 LEU A1644 11.594 -3.905 -2.502 1.00 0.00 H new ATOM 0 HB3 LEU A1644 13.016 -2.884 -2.424 1.00 0.00 H new ATOM 0 HG LEU A1644 12.662 -5.227 -4.315 1.00 0.00 H new ATOM 0 HD11 LEU A1644 12.426 -3.489 -6.059 1.00 0.00 H new ATOM 0 HD12 LEU A1644 11.132 -3.381 -4.841 1.00 0.00 H new ATOM 0 HD13 LEU A1644 12.489 -2.230 -4.802 1.00 0.00 H new ATOM 0 HD21 LEU A1644 14.660 -4.312 -5.442 1.00 0.00 H new ATOM 0 HD22 LEU A1644 14.807 -3.078 -4.168 1.00 0.00 H new ATOM 0 HD23 LEU A1644 15.013 -4.800 -3.768 1.00 0.00 H new ATOM 2065 N ALA A1645 12.289 -5.083 0.584 1.00 0.00 N ATOM 2066 CA ALA A1645 11.944 -4.662 1.942 1.00 0.00 C ATOM 2067 C ALA A1645 13.093 -4.904 2.911 1.00 0.00 C ATOM 2068 O ALA A1645 13.140 -4.340 3.998 1.00 0.00 O ATOM 2069 CB ALA A1645 10.671 -5.348 2.408 1.00 0.00 C ATOM 0 H ALA A1645 11.914 -5.991 0.312 1.00 0.00 H new ATOM 0 HA ALA A1645 11.761 -3.588 1.924 1.00 0.00 H new ATOM 0 HB1 ALA A1645 10.431 -5.022 3.420 1.00 0.00 H new ATOM 0 HB2 ALA A1645 9.851 -5.087 1.739 1.00 0.00 H new ATOM 0 HB3 ALA A1645 10.816 -6.428 2.400 1.00 0.00 H new ATOM 2075 N CYS A1646 14.010 -5.732 2.500 1.00 0.00 N ATOM 2076 CA CYS A1646 15.171 -6.059 3.280 1.00 0.00 C ATOM 2077 C CYS A1646 16.387 -5.923 2.414 1.00 0.00 C ATOM 2078 O CYS A1646 16.285 -5.972 1.176 1.00 0.00 O ATOM 2079 CB CYS A1646 15.080 -7.489 3.843 1.00 0.00 C ATOM 2080 SG CYS A1646 13.912 -7.710 5.230 1.00 0.00 S ATOM 0 H CYS A1646 13.972 -6.207 1.598 1.00 0.00 H new ATOM 0 HA CYS A1646 15.234 -5.375 4.126 1.00 0.00 H new ATOM 0 HB2 CYS A1646 14.791 -8.162 3.036 1.00 0.00 H new ATOM 0 HB3 CYS A1646 16.073 -7.795 4.173 1.00 0.00 H new