USER MOD reduce.3.24.130724 H: found=0, std=0, add=926, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 928 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: A1631 THR OG1 : rot -112:sc= 0.974 USER MOD Set 1.2: A1638 ASN : amide:sc= 0.709 K(o=1.7,f=0.97) USER MOD Set 2.1: A1550 ASN : amide:sc= 1.44 K(o=3.9,f=-3.1!) USER MOD Set 2.2: A1552 SER OG : rot 95:sc= 1.2 USER MOD Set 2.3: A1573 LYS NZ :NH3+ 153:sc= 1.3 (180deg=1.05) USER MOD Set 3.1: A1546 ASN : amide:sc= 0.4 K(o=0.67,f=-5.6!) USER MOD Set 3.2: A1549 LYS NZ :NH3+ -148:sc= 0.266 (180deg=0) USER MOD Set 4.1: A1536 ASN : amide:sc= 0.794 K(o=-1.1,f=-12!) USER MOD Set 4.2: A1539 THR OG1 : rot -148:sc= -1.91! USER MOD Single : A1531 ASN : amide:sc=-0.00397 K(o=-0.004,f=-0.86) USER MOD Single : A1533 GLN :FLIP amide:sc= -0.234 F(o=-1.8!,f=-0.23) USER MOD Single : A1535 THR OG1 : rot 180:sc= -0.757 USER MOD Single : A1541 HIS : no HD1:sc= 0 X(o=0,f=-0.018) USER MOD Single : A1547 SER OG : rot 180:sc= 0.00291 USER MOD Single : A1554 TYR OH : rot 30:sc= 1.23 USER MOD Single : A1555 SER OG : rot -85:sc= 0.451 USER MOD Single : A1558 TYR OH : rot 180:sc= 0 USER MOD Single : A1559 SER OG : rot 180:sc= 0.0315 USER MOD Single : A1561 LYS NZ :NH3+ 169:sc=-0.00893 (180deg=-0.164) USER MOD Single : A1565 TYR OH : rot 180:sc= 0 USER MOD Single : A1572 THR OG1 : rot 61:sc= -0.896! USER MOD Single : A1574 ASN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A1577 SER OG : rot 35:sc= 0.0759 USER MOD Single : A1586 THR OG1 : rot -91:sc= -0.0285 USER MOD Single : A1587 LYS NZ :NH3+ 166:sc= -0.0261 (180deg=-0.245) USER MOD Single : A1589 ASN : amide:sc= -2.51! C(o=-2.5!,f=-3.4!) USER MOD Single : A1592 SER OG : rot 124:sc= 1.11 USER MOD Single : A1594 ASN : amide:sc= -0.581 X(o=-0.58,f=-1) USER MOD Single : A1595 SER OG : rot 170:sc= 0 USER MOD Single : A1596 GLN : amide:sc= -0.16 X(o=-0.16,f=-0.061) USER MOD Single : A1598 MET CE :methyl -154:sc= -0.357 (180deg=-1.39) USER MOD Single : A1599 TYR OH : rot -149:sc= -0.498 USER MOD Single : A1602 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1605 GLN :FLIP amide:sc= 0 F(o=-2.7,f=0) USER MOD Single : A1608 TYR OH : rot -117:sc= 1.63 USER MOD Single : A1621 LYS NZ :NH3+ -162:sc= -0.051 (180deg=-0.343) USER MOD Single : A1622 TYR OH : rot 180:sc= 0 USER MOD Single : A1623 LYS NZ :NH3+ -171:sc= 1.24 (180deg=1.15) USER MOD Single : A1624 SER OG : rot 70:sc= -0.0735 USER MOD Single : A1627 SER OG : rot -5:sc= 0.921 USER MOD Single : A1632 HIS : no HD1:sc= 0 X(o=0,f=-0.013) USER MOD Single : A1634 SER OG : rot 180:sc= 0 USER MOD Single : A1637 ASN : amide:sc= -0.71 K(o=-0.71,f=-3.1!) USER MOD Single : A1639 LYS NZ :NH3+ -167:sc= -0.0171 (180deg=-0.17) USER MOD Single : A1644 SER OG : rot 180:sc= 0 USER MOD Single : A1647 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1648 GLN :FLIP amide:sc= -0.101 F(o=-1.7!,f=-0.1) USER MOD Single : A1649 THR OG1 : rot -24:sc= 0.985 USER MOD Single : A1651 THR OG1 : rot 88:sc= -1.55! USER MOD Single : A1653 TYR OH : rot 180:sc= 0 USER MOD Single : A1655 SER OG : rot 174:sc= -1.82! USER MOD Single : A1657 HIS : no HD1:sc=-0.00143 X(o=-0.0014,f=0) USER MOD Single : A1658 THR OG1 : rot 65:sc= -1.58! USER MOD ----------------------------------------------------------------- ATOM 115 N ASN A1531 -6.101 -2.768 -11.161 1.00 0.00 N ATOM 116 CA ASN A1531 -5.378 -1.522 -11.467 1.00 0.00 C ATOM 117 C ASN A1531 -5.656 -0.474 -10.388 1.00 0.00 C ATOM 118 O ASN A1531 -6.425 0.475 -10.592 1.00 0.00 O ATOM 119 CB ASN A1531 -5.760 -0.928 -12.844 1.00 0.00 C ATOM 120 CG ASN A1531 -4.883 0.269 -13.227 1.00 0.00 C ATOM 121 OD1 ASN A1531 -3.707 0.348 -12.856 1.00 0.00 O ATOM 122 ND2 ASN A1531 -5.437 1.208 -13.937 1.00 0.00 N ATOM 0 HA ASN A1531 -4.319 -1.779 -11.494 1.00 0.00 H new ATOM 0 HB2 ASN A1531 -5.669 -1.700 -13.608 1.00 0.00 H new ATOM 0 HB3 ASN A1531 -6.805 -0.618 -12.826 1.00 0.00 H new ATOM 0 HD21 ASN A1531 -4.899 2.033 -14.200 1.00 0.00 H new ATOM 0 HD22 ASN A1531 -6.410 1.119 -14.231 1.00 0.00 H new ATOM 129 N CYS A1532 -5.104 -0.717 -9.213 1.00 0.00 N ATOM 130 CA CYS A1532 -5.186 0.187 -8.052 1.00 0.00 C ATOM 131 C CYS A1532 -6.635 0.317 -7.594 1.00 0.00 C ATOM 132 O CYS A1532 -7.047 1.327 -7.015 1.00 0.00 O ATOM 133 CB CYS A1532 -4.610 1.565 -8.401 1.00 0.00 C ATOM 134 SG CYS A1532 -3.930 2.436 -6.978 1.00 0.00 S ATOM 0 H CYS A1532 -4.571 -1.565 -9.023 1.00 0.00 H new ATOM 0 HA CYS A1532 -4.596 -0.234 -7.238 1.00 0.00 H new ATOM 0 HB2 CYS A1532 -3.829 1.445 -9.152 1.00 0.00 H new ATOM 0 HB3 CYS A1532 -5.393 2.175 -8.851 1.00 0.00 H new ATOM 139 N GLN A1533 -7.385 -0.727 -7.821 1.00 0.00 N ATOM 140 CA GLN A1533 -8.768 -0.752 -7.507 1.00 0.00 C ATOM 141 C GLN A1533 -9.180 -2.180 -7.226 1.00 0.00 C ATOM 142 O GLN A1533 -8.589 -3.118 -7.793 1.00 0.00 O ATOM 143 CB GLN A1533 -9.557 -0.108 -8.644 1.00 0.00 C ATOM 144 CG GLN A1533 -9.434 -0.793 -9.979 1.00 0.00 C ATOM 145 CD GLN A1533 -9.915 0.080 -11.110 1.00 0.00 C ATOM 146 OE1 GLN A1533 -9.765 1.372 -10.973 1.00 0.00 O flip ATOM 147 NE2 GLN A1533 -10.423 -0.401 -12.110 1.00 0.00 N flip ATOM 0 H GLN A1533 -7.037 -1.592 -8.236 1.00 0.00 H new ATOM 0 HA GLN A1533 -8.982 -0.172 -6.609 1.00 0.00 H new ATOM 0 HB2 GLN A1533 -10.610 -0.080 -8.364 1.00 0.00 H new ATOM 0 HB3 GLN A1533 -9.229 0.926 -8.753 1.00 0.00 H new ATOM 0 HG2 GLN A1533 -8.393 -1.067 -10.151 1.00 0.00 H new ATOM 0 HG3 GLN A1533 -10.010 -1.718 -9.966 1.00 0.00 H new ATOM 0 HE21 GLN A1533 -10.529 -1.412 -12.192 1.00 0.00 H new ATOM 0 HE22 GLN A1533 -10.742 0.208 -12.863 1.00 0.00 H new ATOM 156 N VAL A1534 -10.112 -2.350 -6.323 1.00 0.00 N ATOM 157 CA VAL A1534 -10.545 -3.666 -5.899 1.00 0.00 C ATOM 158 C VAL A1534 -12.034 -3.685 -5.698 1.00 0.00 C ATOM 159 O VAL A1534 -12.588 -2.801 -5.096 1.00 0.00 O ATOM 160 CB VAL A1534 -9.820 -4.112 -4.592 1.00 0.00 C ATOM 161 CG1 VAL A1534 -10.005 -3.129 -3.452 1.00 0.00 C ATOM 162 CG2 VAL A1534 -10.266 -5.474 -4.146 1.00 0.00 C ATOM 0 H VAL A1534 -10.595 -1.582 -5.858 1.00 0.00 H new ATOM 0 HA VAL A1534 -10.282 -4.373 -6.686 1.00 0.00 H new ATOM 0 HB VAL A1534 -8.760 -4.144 -4.845 1.00 0.00 H new ATOM 0 HG11 VAL A1534 -9.479 -3.492 -2.569 1.00 0.00 H new ATOM 0 HG12 VAL A1534 -9.603 -2.158 -3.740 1.00 0.00 H new ATOM 0 HG13 VAL A1534 -11.067 -3.030 -3.226 1.00 0.00 H new ATOM 0 HG21 VAL A1534 -9.738 -5.749 -3.233 1.00 0.00 H new ATOM 0 HG22 VAL A1534 -11.339 -5.461 -3.955 1.00 0.00 H new ATOM 0 HG23 VAL A1534 -10.045 -6.203 -4.926 1.00 0.00 H new ATOM 172 N THR A1535 -12.665 -4.643 -6.243 1.00 0.00 N ATOM 173 CA THR A1535 -14.073 -4.765 -6.094 1.00 0.00 C ATOM 174 C THR A1535 -14.364 -5.706 -4.922 1.00 0.00 C ATOM 175 O THR A1535 -13.815 -6.809 -4.840 1.00 0.00 O ATOM 176 CB THR A1535 -14.662 -5.318 -7.389 1.00 0.00 C ATOM 177 OG1 THR A1535 -14.226 -4.492 -8.482 1.00 0.00 O ATOM 178 CG2 THR A1535 -16.181 -5.326 -7.346 1.00 0.00 C ATOM 0 H THR A1535 -12.230 -5.372 -6.808 1.00 0.00 H new ATOM 0 HA THR A1535 -14.525 -3.794 -5.890 1.00 0.00 H new ATOM 0 HB THR A1535 -14.320 -6.345 -7.517 1.00 0.00 H new ATOM 0 HG1 THR A1535 -14.596 -4.837 -9.321 1.00 0.00 H new ATOM 0 HG21 THR A1535 -16.569 -5.725 -8.283 1.00 0.00 H new ATOM 0 HG22 THR A1535 -16.518 -5.950 -6.518 1.00 0.00 H new ATOM 0 HG23 THR A1535 -16.546 -4.309 -7.206 1.00 0.00 H new ATOM 186 N ASN A1536 -15.157 -5.222 -3.994 1.00 0.00 N ATOM 187 CA ASN A1536 -15.562 -5.980 -2.813 1.00 0.00 C ATOM 188 C ASN A1536 -16.398 -7.170 -3.235 1.00 0.00 C ATOM 189 O ASN A1536 -17.445 -6.994 -3.849 1.00 0.00 O ATOM 190 CB ASN A1536 -16.453 -5.134 -1.902 1.00 0.00 C ATOM 191 CG ASN A1536 -16.731 -5.780 -0.526 1.00 0.00 C ATOM 192 OD1 ASN A1536 -16.648 -6.982 -0.345 1.00 0.00 O ATOM 193 ND2 ASN A1536 -17.157 -5.011 0.394 1.00 0.00 N ATOM 0 H ASN A1536 -15.548 -4.281 -4.030 1.00 0.00 H new ATOM 0 HA ASN A1536 -14.654 -6.283 -2.292 1.00 0.00 H new ATOM 0 HB2 ASN A1536 -15.982 -4.163 -1.748 1.00 0.00 H new ATOM 0 HB3 ASN A1536 -17.402 -4.952 -2.406 1.00 0.00 H new ATOM 0 HD21 ASN A1536 -17.434 -5.399 1.296 1.00 0.00 H new ATOM 0 HD22 ASN A1536 -17.222 -4.006 0.230 1.00 0.00 H new ATOM 200 N PRO A1537 -15.990 -8.377 -2.870 1.00 0.00 N ATOM 201 CA PRO A1537 -16.750 -9.587 -3.163 1.00 0.00 C ATOM 202 C PRO A1537 -18.147 -9.618 -2.488 1.00 0.00 C ATOM 203 O PRO A1537 -18.986 -10.438 -2.853 1.00 0.00 O ATOM 204 CB PRO A1537 -15.874 -10.711 -2.594 1.00 0.00 C ATOM 205 CG PRO A1537 -14.976 -10.042 -1.615 1.00 0.00 C ATOM 206 CD PRO A1537 -14.729 -8.680 -2.164 1.00 0.00 C ATOM 0 HA PRO A1537 -16.953 -9.669 -4.231 1.00 0.00 H new ATOM 0 HB2 PRO A1537 -16.480 -11.479 -2.113 1.00 0.00 H new ATOM 0 HB3 PRO A1537 -15.303 -11.203 -3.381 1.00 0.00 H new ATOM 0 HG2 PRO A1537 -15.440 -9.989 -0.630 1.00 0.00 H new ATOM 0 HG3 PRO A1537 -14.043 -10.593 -1.499 1.00 0.00 H new ATOM 0 HD2 PRO A1537 -14.524 -7.957 -1.375 1.00 0.00 H new ATOM 0 HD3 PRO A1537 -13.874 -8.665 -2.840 1.00 0.00 H new ATOM 214 N ALA A1538 -18.415 -8.719 -1.543 1.00 0.00 N ATOM 215 CA ALA A1538 -19.672 -8.766 -0.829 1.00 0.00 C ATOM 216 C ALA A1538 -20.682 -7.803 -1.408 1.00 0.00 C ATOM 217 O ALA A1538 -21.891 -8.016 -1.305 1.00 0.00 O ATOM 218 CB ALA A1538 -19.453 -8.457 0.636 1.00 0.00 C ATOM 0 H ALA A1538 -17.787 -7.966 -1.263 1.00 0.00 H new ATOM 0 HA ALA A1538 -20.071 -9.775 -0.934 1.00 0.00 H new ATOM 0 HB1 ALA A1538 -20.407 -8.496 1.162 1.00 0.00 H new ATOM 0 HB2 ALA A1538 -18.772 -9.192 1.065 1.00 0.00 H new ATOM 0 HB3 ALA A1538 -19.023 -7.461 0.737 1.00 0.00 H new ATOM 224 N THR A1539 -20.203 -6.746 -1.996 1.00 0.00 N ATOM 225 CA THR A1539 -21.077 -5.708 -2.485 1.00 0.00 C ATOM 226 C THR A1539 -20.966 -5.546 -3.979 1.00 0.00 C ATOM 227 O THR A1539 -21.954 -5.277 -4.672 1.00 0.00 O ATOM 228 CB THR A1539 -20.726 -4.381 -1.790 1.00 0.00 C ATOM 229 OG1 THR A1539 -19.329 -4.124 -1.989 1.00 0.00 O ATOM 230 CG2 THR A1539 -20.993 -4.483 -0.303 1.00 0.00 C ATOM 0 H THR A1539 -19.209 -6.575 -2.151 1.00 0.00 H new ATOM 0 HA THR A1539 -22.105 -5.991 -2.258 1.00 0.00 H new ATOM 0 HB THR A1539 -21.334 -3.579 -2.208 1.00 0.00 H new ATOM 0 HG1 THR A1539 -18.971 -3.642 -1.214 1.00 0.00 H new ATOM 0 HG21 THR A1539 -20.741 -3.538 0.178 1.00 0.00 H new ATOM 0 HG22 THR A1539 -22.047 -4.704 -0.137 1.00 0.00 H new ATOM 0 HG23 THR A1539 -20.383 -5.280 0.122 1.00 0.00 H new ATOM 238 N GLY A1540 -19.785 -5.774 -4.477 1.00 0.00 N ATOM 239 CA GLY A1540 -19.486 -5.492 -5.830 1.00 0.00 C ATOM 240 C GLY A1540 -19.039 -4.062 -5.949 1.00 0.00 C ATOM 241 O GLY A1540 -18.940 -3.513 -7.040 1.00 0.00 O ATOM 0 H GLY A1540 -19.007 -6.163 -3.945 1.00 0.00 H new ATOM 0 HA2 GLY A1540 -18.704 -6.161 -6.189 1.00 0.00 H new ATOM 0 HA3 GLY A1540 -20.364 -5.664 -6.453 1.00 0.00 H new ATOM 245 N HIS A1541 -18.791 -3.451 -4.808 1.00 0.00 N ATOM 246 CA HIS A1541 -18.312 -2.087 -4.751 1.00 0.00 C ATOM 247 C HIS A1541 -16.816 -2.011 -5.025 1.00 0.00 C ATOM 248 O HIS A1541 -16.009 -2.586 -4.298 1.00 0.00 O ATOM 249 CB HIS A1541 -18.668 -1.447 -3.395 1.00 0.00 C ATOM 250 CG HIS A1541 -17.981 -0.150 -3.104 1.00 0.00 C ATOM 251 ND1 HIS A1541 -17.022 -0.035 -2.138 1.00 0.00 N ATOM 252 CD2 HIS A1541 -18.104 1.071 -3.658 1.00 0.00 C ATOM 253 CE1 HIS A1541 -16.576 1.200 -2.111 1.00 0.00 C ATOM 254 NE2 HIS A1541 -17.219 1.891 -3.024 1.00 0.00 N ATOM 0 H HIS A1541 -18.916 -3.887 -3.895 1.00 0.00 H new ATOM 0 HA HIS A1541 -18.812 -1.519 -5.536 1.00 0.00 H new ATOM 0 HB2 HIS A1541 -19.745 -1.285 -3.359 1.00 0.00 H new ATOM 0 HB3 HIS A1541 -18.425 -2.155 -2.602 1.00 0.00 H new ATOM 0 HD2 HIS A1541 -18.778 1.349 -4.455 1.00 0.00 H new ATOM 0 HE1 HIS A1541 -15.811 1.582 -1.451 1.00 0.00 H new ATOM 0 HE2 HIS A1541 -17.079 2.881 -3.226 1.00 0.00 H new ATOM 263 N LEU A1542 -16.481 -1.331 -6.086 1.00 0.00 N ATOM 264 CA LEU A1542 -15.128 -1.064 -6.464 1.00 0.00 C ATOM 265 C LEU A1542 -14.511 -0.002 -5.534 1.00 0.00 C ATOM 266 O LEU A1542 -15.121 1.028 -5.227 1.00 0.00 O ATOM 267 CB LEU A1542 -15.121 -0.634 -7.956 1.00 0.00 C ATOM 268 CG LEU A1542 -13.776 -0.388 -8.681 1.00 0.00 C ATOM 269 CD1 LEU A1542 -13.135 0.946 -8.334 1.00 0.00 C ATOM 270 CD2 LEU A1542 -12.820 -1.530 -8.438 1.00 0.00 C ATOM 0 H LEU A1542 -17.167 -0.936 -6.730 1.00 0.00 H new ATOM 0 HA LEU A1542 -14.509 -1.955 -6.358 1.00 0.00 H new ATOM 0 HB2 LEU A1542 -15.657 -1.399 -8.517 1.00 0.00 H new ATOM 0 HB3 LEU A1542 -15.704 0.284 -8.032 1.00 0.00 H new ATOM 0 HG LEU A1542 -14.007 -0.341 -9.745 1.00 0.00 H new ATOM 0 HD11 LEU A1542 -12.196 1.051 -8.878 1.00 0.00 H new ATOM 0 HD12 LEU A1542 -13.808 1.757 -8.612 1.00 0.00 H new ATOM 0 HD13 LEU A1542 -12.940 0.988 -7.262 1.00 0.00 H new ATOM 0 HD21 LEU A1542 -11.881 -1.336 -8.957 1.00 0.00 H new ATOM 0 HD22 LEU A1542 -12.630 -1.625 -7.369 1.00 0.00 H new ATOM 0 HD23 LEU A1542 -13.257 -2.456 -8.812 1.00 0.00 H new ATOM 282 N PHE A1543 -13.340 -0.300 -5.093 1.00 0.00 N ATOM 283 CA PHE A1543 -12.526 0.545 -4.253 1.00 0.00 C ATOM 284 C PHE A1543 -11.425 1.042 -5.111 1.00 0.00 C ATOM 285 O PHE A1543 -10.976 0.305 -5.962 1.00 0.00 O ATOM 286 CB PHE A1543 -11.916 -0.231 -3.095 1.00 0.00 C ATOM 287 CG PHE A1543 -12.862 -0.707 -2.037 1.00 0.00 C ATOM 288 CD1 PHE A1543 -13.205 0.122 -0.997 1.00 0.00 C ATOM 289 CD2 PHE A1543 -13.370 -1.991 -2.058 1.00 0.00 C ATOM 290 CE1 PHE A1543 -14.040 -0.303 0.003 1.00 0.00 C ATOM 291 CE2 PHE A1543 -14.206 -2.430 -1.056 1.00 0.00 C ATOM 292 CZ PHE A1543 -14.544 -1.583 -0.022 1.00 0.00 C ATOM 0 H PHE A1543 -12.888 -1.187 -5.314 1.00 0.00 H new ATOM 0 HA PHE A1543 -13.136 1.344 -3.832 1.00 0.00 H new ATOM 0 HB2 PHE A1543 -11.395 -1.098 -3.502 1.00 0.00 H new ATOM 0 HB3 PHE A1543 -11.163 0.399 -2.621 1.00 0.00 H new ATOM 0 HD1 PHE A1543 -12.810 1.127 -0.967 1.00 0.00 H new ATOM 0 HD2 PHE A1543 -13.109 -2.657 -2.868 1.00 0.00 H new ATOM 0 HE1 PHE A1543 -14.302 0.366 0.810 1.00 0.00 H new ATOM 0 HE2 PHE A1543 -14.597 -3.437 -1.080 1.00 0.00 H new ATOM 0 HZ PHE A1543 -15.201 -1.923 0.765 1.00 0.00 H new ATOM 302 N ASP A1544 -10.961 2.230 -4.897 1.00 0.00 N ATOM 303 CA ASP A1544 -10.011 2.805 -5.804 1.00 0.00 C ATOM 304 C ASP A1544 -9.016 3.675 -5.086 1.00 0.00 C ATOM 305 O ASP A1544 -9.393 4.542 -4.297 1.00 0.00 O ATOM 306 CB ASP A1544 -10.759 3.628 -6.825 1.00 0.00 C ATOM 307 CG ASP A1544 -9.862 4.204 -7.872 1.00 0.00 C ATOM 308 OD1 ASP A1544 -9.349 5.312 -7.680 1.00 0.00 O ATOM 309 OD2 ASP A1544 -9.648 3.557 -8.922 1.00 0.00 O1- ATOM 0 H ASP A1544 -11.220 2.822 -4.108 1.00 0.00 H new ATOM 0 HA ASP A1544 -9.458 2.000 -6.287 1.00 0.00 H new ATOM 0 HB2 ASP A1544 -11.516 3.006 -7.303 1.00 0.00 H new ATOM 0 HB3 ASP A1544 -11.285 4.437 -6.318 1.00 0.00 H new ATOM 314 N LEU A1545 -7.756 3.453 -5.365 1.00 0.00 N ATOM 315 CA LEU A1545 -6.690 4.219 -4.771 1.00 0.00 C ATOM 316 C LEU A1545 -6.058 5.110 -5.808 1.00 0.00 C ATOM 317 O LEU A1545 -5.075 5.795 -5.533 1.00 0.00 O ATOM 318 CB LEU A1545 -5.641 3.297 -4.236 1.00 0.00 C ATOM 319 CG LEU A1545 -6.106 2.280 -3.254 1.00 0.00 C ATOM 320 CD1 LEU A1545 -5.044 1.271 -3.018 1.00 0.00 C ATOM 321 CD2 LEU A1545 -6.500 2.897 -1.955 1.00 0.00 C ATOM 0 H LEU A1545 -7.440 2.732 -6.014 1.00 0.00 H new ATOM 0 HA LEU A1545 -7.104 4.824 -3.964 1.00 0.00 H new ATOM 0 HB2 LEU A1545 -5.179 2.778 -5.076 1.00 0.00 H new ATOM 0 HB3 LEU A1545 -4.863 3.898 -3.766 1.00 0.00 H new ATOM 0 HG LEU A1545 -6.986 1.799 -3.681 1.00 0.00 H new ATOM 0 HD11 LEU A1545 -5.397 0.533 -2.298 1.00 0.00 H new ATOM 0 HD12 LEU A1545 -4.799 0.774 -3.957 1.00 0.00 H new ATOM 0 HD13 LEU A1545 -4.154 1.764 -2.626 1.00 0.00 H new ATOM 0 HD21 LEU A1545 -6.833 2.118 -1.268 1.00 0.00 H new ATOM 0 HD22 LEU A1545 -5.644 3.418 -1.525 1.00 0.00 H new ATOM 0 HD23 LEU A1545 -7.311 3.606 -2.120 1.00 0.00 H new ATOM 333 N ASN A1546 -6.646 5.145 -6.998 1.00 0.00 N ATOM 334 CA ASN A1546 -6.129 5.976 -8.084 1.00 0.00 C ATOM 335 C ASN A1546 -6.270 7.441 -7.702 1.00 0.00 C ATOM 336 O ASN A1546 -5.539 8.304 -8.185 1.00 0.00 O ATOM 337 CB ASN A1546 -6.812 5.686 -9.450 1.00 0.00 C ATOM 338 CG ASN A1546 -6.397 4.360 -10.102 1.00 0.00 C ATOM 339 OD1 ASN A1546 -5.423 4.305 -10.850 1.00 0.00 O ATOM 340 ND2 ASN A1546 -7.145 3.306 -9.883 1.00 0.00 N ATOM 0 H ASN A1546 -7.480 4.609 -7.237 1.00 0.00 H new ATOM 0 HA ASN A1546 -5.076 5.728 -8.221 1.00 0.00 H new ATOM 0 HB2 ASN A1546 -7.893 5.684 -9.308 1.00 0.00 H new ATOM 0 HB3 ASN A1546 -6.583 6.501 -10.137 1.00 0.00 H new ATOM 0 HD21 ASN A1546 -6.923 2.420 -10.337 1.00 0.00 H new ATOM 0 HD22 ASN A1546 -7.949 3.372 -9.259 1.00 0.00 H new ATOM 347 N SER A1547 -7.187 7.690 -6.782 1.00 0.00 N ATOM 348 CA SER A1547 -7.422 9.000 -6.219 1.00 0.00 C ATOM 349 C SER A1547 -6.210 9.473 -5.366 1.00 0.00 C ATOM 350 O SER A1547 -5.975 10.671 -5.213 1.00 0.00 O ATOM 351 CB SER A1547 -8.667 8.922 -5.341 1.00 0.00 C ATOM 352 OG SER A1547 -9.720 8.247 -6.027 1.00 0.00 O ATOM 0 H SER A1547 -7.799 6.969 -6.401 1.00 0.00 H new ATOM 0 HA SER A1547 -7.560 9.719 -7.027 1.00 0.00 H new ATOM 0 HB2 SER A1547 -8.434 8.397 -4.414 1.00 0.00 H new ATOM 0 HB3 SER A1547 -8.989 9.926 -5.066 1.00 0.00 H new ATOM 0 HG SER A1547 -10.511 8.204 -5.450 1.00 0.00 H new ATOM 358 N LEU A1548 -5.434 8.528 -4.838 1.00 0.00 N ATOM 359 CA LEU A1548 -4.313 8.854 -3.957 1.00 0.00 C ATOM 360 C LEU A1548 -3.029 9.028 -4.728 1.00 0.00 C ATOM 361 O LEU A1548 -2.000 9.374 -4.156 1.00 0.00 O ATOM 362 CB LEU A1548 -4.109 7.751 -2.934 1.00 0.00 C ATOM 363 CG LEU A1548 -5.290 7.429 -2.066 1.00 0.00 C ATOM 364 CD1 LEU A1548 -4.936 6.289 -1.146 1.00 0.00 C ATOM 365 CD2 LEU A1548 -5.695 8.654 -1.288 1.00 0.00 C ATOM 0 H LEU A1548 -5.561 7.530 -5.005 1.00 0.00 H new ATOM 0 HA LEU A1548 -4.560 9.793 -3.462 1.00 0.00 H new ATOM 0 HB2 LEU A1548 -3.814 6.844 -3.462 1.00 0.00 H new ATOM 0 HB3 LEU A1548 -3.276 8.031 -2.290 1.00 0.00 H new ATOM 0 HG LEU A1548 -6.136 7.124 -2.682 1.00 0.00 H new ATOM 0 HD11 LEU A1548 -5.792 6.052 -0.514 1.00 0.00 H new ATOM 0 HD12 LEU A1548 -4.669 5.413 -1.738 1.00 0.00 H new ATOM 0 HD13 LEU A1548 -4.091 6.576 -0.520 1.00 0.00 H new ATOM 0 HD21 LEU A1548 -6.553 8.418 -0.658 1.00 0.00 H new ATOM 0 HD22 LEU A1548 -4.864 8.979 -0.662 1.00 0.00 H new ATOM 0 HD23 LEU A1548 -5.962 9.453 -1.980 1.00 0.00 H new ATOM 377 N LYS A1549 -3.084 8.769 -6.002 1.00 0.00 N ATOM 378 CA LYS A1549 -1.976 8.845 -6.845 1.00 0.00 C ATOM 379 C LYS A1549 -1.622 10.284 -7.113 1.00 0.00 C ATOM 380 O LYS A1549 -2.262 10.963 -7.931 1.00 0.00 O ATOM 381 CB LYS A1549 -2.281 8.126 -8.126 1.00 0.00 C ATOM 382 CG LYS A1549 -2.634 6.665 -7.963 1.00 0.00 C ATOM 383 CD LYS A1549 -2.465 5.902 -9.263 1.00 0.00 C ATOM 384 CE LYS A1549 -3.211 6.544 -10.407 1.00 0.00 C ATOM 385 NZ LYS A1549 -2.970 5.821 -11.671 1.00 0.00 N1+ ATOM 0 H LYS A1549 -3.942 8.491 -6.478 1.00 0.00 H new ATOM 0 HA LYS A1549 -1.119 8.371 -6.365 1.00 0.00 H new ATOM 0 HB2 LYS A1549 -3.109 8.632 -8.623 1.00 0.00 H new ATOM 0 HB3 LYS A1549 -1.417 8.205 -8.786 1.00 0.00 H new ATOM 0 HG2 LYS A1549 -2.001 6.221 -7.195 1.00 0.00 H new ATOM 0 HG3 LYS A1549 -3.664 6.575 -7.619 1.00 0.00 H new ATOM 0 HD2 LYS A1549 -1.405 5.843 -9.511 1.00 0.00 H new ATOM 0 HD3 LYS A1549 -2.819 4.880 -9.130 1.00 0.00 H new ATOM 0 HE2 LYS A1549 -4.279 6.555 -10.188 1.00 0.00 H new ATOM 0 HE3 LYS A1549 -2.897 7.582 -10.513 1.00 0.00 H new ATOM 0 HZ1 LYS A1549 -2.996 6.492 -12.465 1.00 0.00 H new ATOM 0 HZ2 LYS A1549 -2.037 5.362 -11.636 1.00 0.00 H new ATOM 0 HZ3 LYS A1549 -3.706 5.099 -11.803 1.00 0.00 H new ATOM 399 N ASN A1550 -0.657 10.742 -6.396 1.00 0.00 N ATOM 400 CA ASN A1550 -0.173 12.062 -6.485 1.00 0.00 C ATOM 401 C ASN A1550 1.344 11.988 -6.514 1.00 0.00 C ATOM 402 O ASN A1550 1.950 11.071 -5.942 1.00 0.00 O ATOM 403 CB ASN A1550 -0.671 12.897 -5.300 1.00 0.00 C ATOM 404 CG ASN A1550 -0.298 14.362 -5.410 1.00 0.00 C ATOM 405 OD1 ASN A1550 0.770 14.774 -4.983 1.00 0.00 O ATOM 406 ND2 ASN A1550 -1.182 15.165 -5.946 1.00 0.00 N ATOM 0 H ASN A1550 -0.166 10.177 -5.703 1.00 0.00 H new ATOM 0 HA ASN A1550 -0.538 12.550 -7.389 1.00 0.00 H new ATOM 0 HB2 ASN A1550 -1.755 12.808 -5.230 1.00 0.00 H new ATOM 0 HB3 ASN A1550 -0.257 12.491 -4.377 1.00 0.00 H new ATOM 0 HD21 ASN A1550 -0.988 16.164 -6.016 1.00 0.00 H new ATOM 0 HD22 ASN A1550 -2.065 14.792 -6.294 1.00 0.00 H new ATOM 413 N ASP A1551 1.918 12.944 -7.153 1.00 0.00 N ATOM 414 CA ASP A1551 3.354 13.006 -7.472 1.00 0.00 C ATOM 415 C ASP A1551 4.213 13.232 -6.245 1.00 0.00 C ATOM 416 O ASP A1551 5.391 12.847 -6.228 1.00 0.00 O ATOM 417 CB ASP A1551 3.638 14.128 -8.484 1.00 0.00 C ATOM 418 CG ASP A1551 3.552 15.518 -7.882 1.00 0.00 C ATOM 419 OD1 ASP A1551 2.455 15.945 -7.482 1.00 0.00 O1- ATOM 420 OD2 ASP A1551 4.599 16.199 -7.772 1.00 0.00 O ATOM 0 H ASP A1551 1.402 13.754 -7.496 1.00 0.00 H new ATOM 0 HA ASP A1551 3.613 12.037 -7.899 1.00 0.00 H new ATOM 0 HB2 ASP A1551 4.633 13.984 -8.906 1.00 0.00 H new ATOM 0 HB3 ASP A1551 2.928 14.052 -9.308 1.00 0.00 H new ATOM 425 N SER A1552 3.648 13.875 -5.239 1.00 0.00 N ATOM 426 CA SER A1552 4.314 14.156 -4.041 1.00 0.00 C ATOM 427 C SER A1552 4.789 12.875 -3.383 1.00 0.00 C ATOM 428 O SER A1552 5.956 12.749 -3.017 1.00 0.00 O ATOM 429 CB SER A1552 3.359 14.914 -3.174 1.00 0.00 C ATOM 430 OG SER A1552 2.852 16.046 -3.877 1.00 0.00 O ATOM 0 H SER A1552 2.686 14.213 -5.262 1.00 0.00 H new ATOM 0 HA SER A1552 5.207 14.757 -4.216 1.00 0.00 H new ATOM 0 HB2 SER A1552 2.537 14.265 -2.872 1.00 0.00 H new ATOM 0 HB3 SER A1552 3.861 15.237 -2.262 1.00 0.00 H new ATOM 0 HG SER A1552 1.998 15.814 -4.298 1.00 0.00 H new ATOM 436 N GLY A1553 3.918 11.913 -3.303 1.00 0.00 N ATOM 437 CA GLY A1553 4.286 10.667 -2.740 1.00 0.00 C ATOM 438 C GLY A1553 4.086 10.651 -1.270 1.00 0.00 C ATOM 439 O GLY A1553 3.797 11.678 -0.651 1.00 0.00 O ATOM 0 H GLY A1553 2.951 11.976 -3.622 1.00 0.00 H new ATOM 0 HA2 GLY A1553 3.696 9.872 -3.197 1.00 0.00 H new ATOM 0 HA3 GLY A1553 5.331 10.459 -2.968 1.00 0.00 H new ATOM 443 N TYR A1554 4.247 9.517 -0.713 1.00 0.00 N ATOM 444 CA TYR A1554 3.978 9.297 0.675 1.00 0.00 C ATOM 445 C TYR A1554 5.226 8.851 1.388 1.00 0.00 C ATOM 446 O TYR A1554 6.253 8.582 0.753 1.00 0.00 O ATOM 447 CB TYR A1554 2.814 8.299 0.800 1.00 0.00 C ATOM 448 CG TYR A1554 1.581 8.860 0.124 1.00 0.00 C ATOM 449 CD1 TYR A1554 1.337 8.628 -1.227 1.00 0.00 C ATOM 450 CD2 TYR A1554 0.711 9.689 0.810 1.00 0.00 C ATOM 451 CE1 TYR A1554 0.272 9.208 -1.864 1.00 0.00 C ATOM 452 CE2 TYR A1554 -0.372 10.258 0.180 1.00 0.00 C ATOM 453 CZ TYR A1554 -0.583 10.021 -1.156 1.00 0.00 C ATOM 454 OH TYR A1554 -1.642 10.613 -1.795 1.00 0.00 O ATOM 0 H TYR A1554 4.576 8.688 -1.208 1.00 0.00 H new ATOM 0 HA TYR A1554 3.673 10.224 1.161 1.00 0.00 H new ATOM 0 HB2 TYR A1554 3.088 7.348 0.344 1.00 0.00 H new ATOM 0 HB3 TYR A1554 2.605 8.100 1.851 1.00 0.00 H new ATOM 0 HD1 TYR A1554 1.999 7.980 -1.782 1.00 0.00 H new ATOM 0 HD2 TYR A1554 0.885 9.893 1.856 1.00 0.00 H new ATOM 0 HE1 TYR A1554 0.104 9.028 -2.916 1.00 0.00 H new ATOM 0 HE2 TYR A1554 -1.053 10.888 0.734 1.00 0.00 H new ATOM 0 HH TYR A1554 -1.941 10.040 -2.532 1.00 0.00 H new ATOM 464 N SER A1555 5.168 8.815 2.678 1.00 0.00 N ATOM 465 CA SER A1555 6.299 8.466 3.505 1.00 0.00 C ATOM 466 C SER A1555 5.826 7.885 4.817 1.00 0.00 C ATOM 467 O SER A1555 4.740 8.220 5.306 1.00 0.00 O ATOM 468 CB SER A1555 7.167 9.692 3.777 1.00 0.00 C ATOM 469 OG SER A1555 7.565 10.321 2.556 1.00 0.00 O ATOM 0 H SER A1555 4.322 9.030 3.206 1.00 0.00 H new ATOM 0 HA SER A1555 6.893 7.723 2.972 1.00 0.00 H new ATOM 0 HB2 SER A1555 6.616 10.402 4.393 1.00 0.00 H new ATOM 0 HB3 SER A1555 8.051 9.398 4.343 1.00 0.00 H new ATOM 0 HG SER A1555 8.365 9.877 2.205 1.00 0.00 H new ATOM 475 N VAL A1556 6.633 7.030 5.372 1.00 0.00 N ATOM 476 CA VAL A1556 6.352 6.338 6.592 1.00 0.00 C ATOM 477 C VAL A1556 7.625 6.211 7.380 1.00 0.00 C ATOM 478 O VAL A1556 8.451 5.362 7.091 1.00 0.00 O ATOM 479 CB VAL A1556 5.769 4.908 6.304 1.00 0.00 C ATOM 480 CG1 VAL A1556 5.689 4.088 7.567 1.00 0.00 C ATOM 481 CG2 VAL A1556 4.390 4.993 5.689 1.00 0.00 C ATOM 0 H VAL A1556 7.539 6.787 4.971 1.00 0.00 H new ATOM 0 HA VAL A1556 5.610 6.902 7.157 1.00 0.00 H new ATOM 0 HB VAL A1556 6.448 4.425 5.602 1.00 0.00 H new ATOM 0 HG11 VAL A1556 5.282 3.104 7.336 1.00 0.00 H new ATOM 0 HG12 VAL A1556 6.686 3.978 7.993 1.00 0.00 H new ATOM 0 HG13 VAL A1556 5.041 4.589 8.286 1.00 0.00 H new ATOM 0 HG21 VAL A1556 4.013 3.988 5.501 1.00 0.00 H new ATOM 0 HG22 VAL A1556 3.718 5.511 6.373 1.00 0.00 H new ATOM 0 HG23 VAL A1556 4.444 5.542 4.749 1.00 0.00 H new ATOM 491 N ALA A1557 7.834 7.147 8.261 1.00 0.00 N ATOM 492 CA ALA A1557 8.941 7.105 9.207 1.00 0.00 C ATOM 493 C ALA A1557 9.074 5.730 9.864 1.00 0.00 C ATOM 494 O ALA A1557 8.108 5.201 10.441 1.00 0.00 O ATOM 495 CB ALA A1557 8.793 8.172 10.268 1.00 0.00 C ATOM 0 H ALA A1557 7.243 7.973 8.354 1.00 0.00 H new ATOM 0 HA ALA A1557 9.851 7.299 8.638 1.00 0.00 H new ATOM 0 HB1 ALA A1557 9.634 8.116 10.960 1.00 0.00 H new ATOM 0 HB2 ALA A1557 8.776 9.154 9.796 1.00 0.00 H new ATOM 0 HB3 ALA A1557 7.863 8.016 10.814 1.00 0.00 H new ATOM 501 N TYR A1558 10.254 5.157 9.765 1.00 0.00 N ATOM 502 CA TYR A1558 10.509 3.844 10.320 1.00 0.00 C ATOM 503 C TYR A1558 11.032 4.014 11.750 1.00 0.00 C ATOM 504 O TYR A1558 11.502 5.103 12.130 1.00 0.00 O ATOM 505 CB TYR A1558 11.506 3.070 9.415 1.00 0.00 C ATOM 506 CG TYR A1558 11.767 1.606 9.760 1.00 0.00 C ATOM 507 CD1 TYR A1558 10.939 0.606 9.285 1.00 0.00 C ATOM 508 CD2 TYR A1558 12.863 1.231 10.523 1.00 0.00 C ATOM 509 CE1 TYR A1558 11.192 -0.723 9.558 1.00 0.00 C ATOM 510 CE2 TYR A1558 13.117 -0.093 10.806 1.00 0.00 C ATOM 511 CZ TYR A1558 12.280 -1.068 10.318 1.00 0.00 C ATOM 512 OH TYR A1558 12.538 -2.399 10.592 1.00 0.00 O ATOM 0 H TYR A1558 11.057 5.583 9.302 1.00 0.00 H new ATOM 0 HA TYR A1558 9.593 3.255 10.357 1.00 0.00 H new ATOM 0 HB2 TYR A1558 11.138 3.115 8.390 1.00 0.00 H new ATOM 0 HB3 TYR A1558 12.460 3.597 9.435 1.00 0.00 H new ATOM 0 HD1 TYR A1558 10.078 0.870 8.689 1.00 0.00 H new ATOM 0 HD2 TYR A1558 13.530 1.991 10.902 1.00 0.00 H new ATOM 0 HE1 TYR A1558 10.535 -1.489 9.174 1.00 0.00 H new ATOM 0 HE2 TYR A1558 13.971 -0.364 11.409 1.00 0.00 H new ATOM 0 HH TYR A1558 13.347 -2.469 11.141 1.00 0.00 H new ATOM 522 N SER A1559 10.951 2.961 12.514 1.00 0.00 N ATOM 523 CA SER A1559 11.278 2.933 13.927 1.00 0.00 C ATOM 524 C SER A1559 12.768 3.261 14.264 1.00 0.00 C ATOM 525 O SER A1559 13.096 3.531 15.426 1.00 0.00 O ATOM 526 CB SER A1559 10.928 1.539 14.429 1.00 0.00 C ATOM 527 OG SER A1559 9.667 1.134 13.893 1.00 0.00 O ATOM 0 H SER A1559 10.643 2.055 12.161 1.00 0.00 H new ATOM 0 HA SER A1559 10.706 3.720 14.419 1.00 0.00 H new ATOM 0 HB2 SER A1559 11.703 0.831 14.134 1.00 0.00 H new ATOM 0 HB3 SER A1559 10.889 1.534 15.518 1.00 0.00 H new ATOM 0 HG SER A1559 9.447 0.236 14.217 1.00 0.00 H new ATOM 533 N GLU A1560 13.657 3.247 13.287 1.00 0.00 N ATOM 534 CA GLU A1560 15.061 3.460 13.599 1.00 0.00 C ATOM 535 C GLU A1560 15.530 4.893 13.369 1.00 0.00 C ATOM 536 O GLU A1560 15.573 5.687 14.309 1.00 0.00 O ATOM 537 CB GLU A1560 15.967 2.461 12.896 1.00 0.00 C ATOM 538 CG GLU A1560 15.686 1.026 13.267 1.00 0.00 C ATOM 539 CD GLU A1560 16.626 0.073 12.600 1.00 0.00 C ATOM 540 OE1 GLU A1560 16.360 -0.335 11.463 1.00 0.00 O ATOM 541 OE2 GLU A1560 17.659 -0.295 13.204 1.00 0.00 O1- ATOM 0 H GLU A1560 13.444 3.096 12.301 1.00 0.00 H new ATOM 0 HA GLU A1560 15.142 3.284 14.672 1.00 0.00 H new ATOM 0 HB2 GLU A1560 15.855 2.577 11.818 1.00 0.00 H new ATOM 0 HB3 GLU A1560 17.005 2.693 13.136 1.00 0.00 H new ATOM 0 HG2 GLU A1560 15.762 0.911 14.348 1.00 0.00 H new ATOM 0 HG3 GLU A1560 14.662 0.776 12.991 1.00 0.00 H new ATOM 548 N LYS A1561 15.856 5.242 12.134 1.00 0.00 N ATOM 549 CA LYS A1561 16.419 6.570 11.871 1.00 0.00 C ATOM 550 C LYS A1561 16.009 7.151 10.519 1.00 0.00 C ATOM 551 O LYS A1561 16.455 8.232 10.146 1.00 0.00 O ATOM 552 CB LYS A1561 17.965 6.603 12.005 1.00 0.00 C ATOM 553 CG LYS A1561 18.741 5.799 10.967 1.00 0.00 C ATOM 554 CD LYS A1561 18.574 4.315 11.154 1.00 0.00 C ATOM 555 CE LYS A1561 19.331 3.522 10.096 1.00 0.00 C ATOM 556 NZ LYS A1561 20.792 3.771 10.144 1.00 0.00 N1+ ATOM 0 H LYS A1561 15.747 4.647 11.313 1.00 0.00 H new ATOM 0 HA LYS A1561 15.988 7.202 12.647 1.00 0.00 H new ATOM 0 HB2 LYS A1561 18.293 7.641 11.951 1.00 0.00 H new ATOM 0 HB3 LYS A1561 18.232 6.235 12.996 1.00 0.00 H new ATOM 0 HG2 LYS A1561 18.404 6.078 9.968 1.00 0.00 H new ATOM 0 HG3 LYS A1561 19.799 6.054 11.029 1.00 0.00 H new ATOM 0 HD2 LYS A1561 18.930 4.031 12.144 1.00 0.00 H new ATOM 0 HD3 LYS A1561 17.515 4.060 11.111 1.00 0.00 H new ATOM 0 HE2 LYS A1561 19.141 2.458 10.238 1.00 0.00 H new ATOM 0 HE3 LYS A1561 18.952 3.785 9.108 1.00 0.00 H new ATOM 0 HZ1 LYS A1561 21.282 3.080 9.541 1.00 0.00 H new ATOM 0 HZ2 LYS A1561 20.992 4.733 9.802 1.00 0.00 H new ATOM 0 HZ3 LYS A1561 21.128 3.675 11.123 1.00 0.00 H new ATOM 570 N GLY A1562 15.162 6.465 9.805 1.00 0.00 N ATOM 571 CA GLY A1562 14.754 6.918 8.525 1.00 0.00 C ATOM 572 C GLY A1562 13.361 6.482 8.263 1.00 0.00 C ATOM 573 O GLY A1562 12.814 5.726 9.037 1.00 0.00 O ATOM 0 H GLY A1562 14.743 5.583 10.100 1.00 0.00 H new ATOM 0 HA2 GLY A1562 14.821 8.005 8.474 1.00 0.00 H new ATOM 0 HA3 GLY A1562 15.420 6.522 7.759 1.00 0.00 H new ATOM 577 N LEU A1563 12.811 6.936 7.205 1.00 0.00 N ATOM 578 CA LEU A1563 11.464 6.646 6.816 1.00 0.00 C ATOM 579 C LEU A1563 11.448 5.696 5.627 1.00 0.00 C ATOM 580 O LEU A1563 12.504 5.256 5.140 1.00 0.00 O ATOM 581 CB LEU A1563 10.730 7.983 6.505 1.00 0.00 C ATOM 582 CG LEU A1563 11.134 8.776 5.250 1.00 0.00 C ATOM 583 CD1 LEU A1563 10.455 8.212 4.038 1.00 0.00 C ATOM 584 CD2 LEU A1563 10.789 10.235 5.414 1.00 0.00 C ATOM 0 H LEU A1563 13.297 7.548 6.549 1.00 0.00 H new ATOM 0 HA LEU A1563 10.938 6.145 7.629 1.00 0.00 H new ATOM 0 HB2 LEU A1563 9.665 7.765 6.429 1.00 0.00 H new ATOM 0 HB3 LEU A1563 10.860 8.639 7.366 1.00 0.00 H new ATOM 0 HG LEU A1563 12.212 8.689 5.117 1.00 0.00 H new ATOM 0 HD11 LEU A1563 10.750 8.783 3.157 1.00 0.00 H new ATOM 0 HD12 LEU A1563 10.747 7.170 3.910 1.00 0.00 H new ATOM 0 HD13 LEU A1563 9.374 8.273 4.165 1.00 0.00 H new ATOM 0 HD21 LEU A1563 11.082 10.781 4.517 1.00 0.00 H new ATOM 0 HD22 LEU A1563 9.715 10.340 5.569 1.00 0.00 H new ATOM 0 HD23 LEU A1563 11.321 10.640 6.275 1.00 0.00 H new ATOM 596 N ILE A1564 10.263 5.365 5.201 1.00 0.00 N ATOM 597 CA ILE A1564 10.017 4.552 4.053 1.00 0.00 C ATOM 598 C ILE A1564 9.056 5.320 3.124 1.00 0.00 C ATOM 599 O ILE A1564 7.962 5.656 3.521 1.00 0.00 O ATOM 600 CB ILE A1564 9.339 3.236 4.481 1.00 0.00 C ATOM 601 CG1 ILE A1564 10.094 2.564 5.635 1.00 0.00 C ATOM 602 CG2 ILE A1564 9.246 2.305 3.301 1.00 0.00 C ATOM 603 CD1 ILE A1564 9.439 1.301 6.141 1.00 0.00 C ATOM 0 H ILE A1564 9.408 5.669 5.667 1.00 0.00 H new ATOM 0 HA ILE A1564 10.956 4.327 3.548 1.00 0.00 H new ATOM 0 HB ILE A1564 8.336 3.469 4.837 1.00 0.00 H new ATOM 0 HG12 ILE A1564 11.107 2.330 5.306 1.00 0.00 H new ATOM 0 HG13 ILE A1564 10.182 3.271 6.460 1.00 0.00 H new ATOM 0 HG21 ILE A1564 8.766 1.376 3.608 1.00 0.00 H new ATOM 0 HG22 ILE A1564 8.657 2.774 2.513 1.00 0.00 H new ATOM 0 HG23 ILE A1564 10.247 2.090 2.927 1.00 0.00 H new ATOM 0 HD11 ILE A1564 10.032 0.885 6.956 1.00 0.00 H new ATOM 0 HD12 ILE A1564 8.436 1.531 6.502 1.00 0.00 H new ATOM 0 HD13 ILE A1564 9.375 0.574 5.331 1.00 0.00 H new ATOM 615 N TYR A1565 9.498 5.634 1.942 1.00 0.00 N ATOM 616 CA TYR A1565 8.700 6.379 0.985 1.00 0.00 C ATOM 617 C TYR A1565 7.737 5.441 0.301 1.00 0.00 C ATOM 618 O TYR A1565 8.059 4.272 0.065 1.00 0.00 O ATOM 619 CB TYR A1565 9.566 7.061 -0.080 1.00 0.00 C ATOM 620 CG TYR A1565 10.509 8.122 0.427 1.00 0.00 C ATOM 621 CD1 TYR A1565 10.052 9.394 0.725 1.00 0.00 C ATOM 622 CD2 TYR A1565 11.861 7.863 0.580 1.00 0.00 C ATOM 623 CE1 TYR A1565 10.912 10.377 1.167 1.00 0.00 C ATOM 624 CE2 TYR A1565 12.727 8.842 1.026 1.00 0.00 C ATOM 625 CZ TYR A1565 12.250 10.093 1.314 1.00 0.00 C ATOM 626 OH TYR A1565 13.116 11.071 1.762 1.00 0.00 O ATOM 0 H TYR A1565 10.427 5.384 1.603 1.00 0.00 H new ATOM 0 HA TYR A1565 8.165 7.154 1.534 1.00 0.00 H new ATOM 0 HB2 TYR A1565 10.150 6.296 -0.592 1.00 0.00 H new ATOM 0 HB3 TYR A1565 8.908 7.511 -0.824 1.00 0.00 H new ATOM 0 HD1 TYR A1565 9.002 9.621 0.609 1.00 0.00 H new ATOM 0 HD2 TYR A1565 12.244 6.880 0.347 1.00 0.00 H new ATOM 0 HE1 TYR A1565 10.538 11.364 1.396 1.00 0.00 H new ATOM 0 HE2 TYR A1565 13.777 8.622 1.147 1.00 0.00 H new ATOM 0 HH TYR A1565 14.024 10.706 1.811 1.00 0.00 H new ATOM 636 N ILE A1566 6.568 5.935 -0.003 1.00 0.00 N ATOM 637 CA ILE A1566 5.550 5.138 -0.638 1.00 0.00 C ATOM 638 C ILE A1566 4.957 5.880 -1.847 1.00 0.00 C ATOM 639 O ILE A1566 4.720 7.089 -1.789 1.00 0.00 O ATOM 640 CB ILE A1566 4.396 4.834 0.368 1.00 0.00 C ATOM 641 CG1 ILE A1566 4.885 3.989 1.553 1.00 0.00 C ATOM 642 CG2 ILE A1566 3.212 4.171 -0.318 1.00 0.00 C ATOM 643 CD1 ILE A1566 3.796 3.661 2.550 1.00 0.00 C ATOM 0 H ILE A1566 6.293 6.900 0.181 1.00 0.00 H new ATOM 0 HA ILE A1566 6.012 4.208 -0.969 1.00 0.00 H new ATOM 0 HB ILE A1566 4.058 5.793 0.760 1.00 0.00 H new ATOM 0 HG12 ILE A1566 5.312 3.060 1.175 1.00 0.00 H new ATOM 0 HG13 ILE A1566 5.686 4.523 2.064 1.00 0.00 H new ATOM 0 HG21 ILE A1566 2.430 3.975 0.415 1.00 0.00 H new ATOM 0 HG22 ILE A1566 2.825 4.831 -1.094 1.00 0.00 H new ATOM 0 HG23 ILE A1566 3.532 3.231 -0.767 1.00 0.00 H new ATOM 0 HD11 ILE A1566 4.213 3.062 3.360 1.00 0.00 H new ATOM 0 HD12 ILE A1566 3.384 4.585 2.956 1.00 0.00 H new ATOM 0 HD13 ILE A1566 3.005 3.099 2.053 1.00 0.00 H new ATOM 655 N GLY A1567 4.776 5.171 -2.920 1.00 0.00 N ATOM 656 CA GLY A1567 4.064 5.670 -4.056 1.00 0.00 C ATOM 657 C GLY A1567 2.880 4.771 -4.282 1.00 0.00 C ATOM 658 O GLY A1567 3.033 3.550 -4.320 1.00 0.00 O ATOM 0 H GLY A1567 5.123 4.218 -3.032 1.00 0.00 H new ATOM 0 HA2 GLY A1567 3.738 6.696 -3.883 1.00 0.00 H new ATOM 0 HA3 GLY A1567 4.708 5.684 -4.936 1.00 0.00 H new ATOM 662 N ILE A1568 1.715 5.327 -4.413 1.00 0.00 N ATOM 663 CA ILE A1568 0.517 4.505 -4.530 1.00 0.00 C ATOM 664 C ILE A1568 0.164 4.323 -5.985 1.00 0.00 C ATOM 665 O ILE A1568 -0.378 5.228 -6.602 1.00 0.00 O ATOM 666 CB ILE A1568 -0.681 5.143 -3.744 1.00 0.00 C ATOM 667 CG1 ILE A1568 -0.348 5.251 -2.250 1.00 0.00 C ATOM 668 CG2 ILE A1568 -1.978 4.337 -3.927 1.00 0.00 C ATOM 669 CD1 ILE A1568 -0.116 3.909 -1.575 1.00 0.00 C ATOM 0 H ILE A1568 1.553 6.334 -4.443 1.00 0.00 H new ATOM 0 HA ILE A1568 0.719 3.529 -4.090 1.00 0.00 H new ATOM 0 HB ILE A1568 -0.840 6.140 -4.154 1.00 0.00 H new ATOM 0 HG12 ILE A1568 0.543 5.867 -2.129 1.00 0.00 H new ATOM 0 HG13 ILE A1568 -1.163 5.767 -1.742 1.00 0.00 H new ATOM 0 HG21 ILE A1568 -2.784 4.812 -3.367 1.00 0.00 H new ATOM 0 HG22 ILE A1568 -2.241 4.306 -4.984 1.00 0.00 H new ATOM 0 HG23 ILE A1568 -1.830 3.321 -3.560 1.00 0.00 H new ATOM 0 HD11 ILE A1568 0.114 4.067 -0.521 1.00 0.00 H new ATOM 0 HD12 ILE A1568 -1.014 3.298 -1.663 1.00 0.00 H new ATOM 0 HD13 ILE A1568 0.719 3.399 -2.056 1.00 0.00 H new ATOM 681 N CYS A1569 0.593 3.174 -6.555 1.00 0.00 N ATOM 682 CA CYS A1569 0.299 2.773 -7.943 1.00 0.00 C ATOM 683 C CYS A1569 0.824 3.788 -8.959 1.00 0.00 C ATOM 684 O CYS A1569 0.488 3.731 -10.155 1.00 0.00 O ATOM 685 CB CYS A1569 -1.201 2.634 -8.140 1.00 0.00 C ATOM 686 SG CYS A1569 -2.064 1.670 -6.870 1.00 0.00 S ATOM 0 H CYS A1569 1.161 2.492 -6.053 1.00 0.00 H new ATOM 0 HA CYS A1569 0.801 1.820 -8.109 1.00 0.00 H new ATOM 0 HB2 CYS A1569 -1.640 3.631 -8.176 1.00 0.00 H new ATOM 0 HB3 CYS A1569 -1.382 2.171 -9.110 1.00 0.00 H new ATOM 691 N GLY A1570 1.657 4.666 -8.520 1.00 0.00 N ATOM 692 CA GLY A1570 2.103 5.721 -9.354 1.00 0.00 C ATOM 693 C GLY A1570 3.423 6.233 -8.925 1.00 0.00 C ATOM 694 O GLY A1570 3.891 5.919 -7.831 1.00 0.00 O ATOM 0 H GLY A1570 2.046 4.672 -7.577 1.00 0.00 H new ATOM 0 HA2 GLY A1570 2.165 5.370 -10.384 1.00 0.00 H new ATOM 0 HA3 GLY A1570 1.375 6.532 -9.337 1.00 0.00 H new ATOM 698 N GLY A1571 4.043 6.983 -9.790 1.00 0.00 N ATOM 699 CA GLY A1571 5.344 7.492 -9.527 1.00 0.00 C ATOM 700 C GLY A1571 5.307 8.694 -8.640 1.00 0.00 C ATOM 701 O GLY A1571 4.361 9.488 -8.679 1.00 0.00 O ATOM 0 H GLY A1571 3.656 7.254 -10.694 1.00 0.00 H new ATOM 0 HA2 GLY A1571 5.949 6.715 -9.060 1.00 0.00 H new ATOM 0 HA3 GLY A1571 5.829 7.751 -10.468 1.00 0.00 H new ATOM 705 N THR A1572 6.298 8.820 -7.849 1.00 0.00 N ATOM 706 CA THR A1572 6.456 9.916 -6.975 1.00 0.00 C ATOM 707 C THR A1572 7.838 10.502 -7.167 1.00 0.00 C ATOM 708 O THR A1572 8.673 9.913 -7.845 1.00 0.00 O ATOM 709 CB THR A1572 6.133 9.566 -5.467 1.00 0.00 C ATOM 710 OG1 THR A1572 6.772 10.467 -4.542 1.00 0.00 O ATOM 711 CG2 THR A1572 6.478 8.133 -5.135 1.00 0.00 C ATOM 0 H THR A1572 7.053 8.137 -7.788 1.00 0.00 H new ATOM 0 HA THR A1572 5.716 10.674 -7.232 1.00 0.00 H new ATOM 0 HB THR A1572 5.056 9.691 -5.354 1.00 0.00 H new ATOM 0 HG1 THR A1572 6.449 11.379 -4.698 1.00 0.00 H new ATOM 0 HG21 THR A1572 6.241 7.934 -4.090 1.00 0.00 H new ATOM 0 HG22 THR A1572 5.901 7.463 -5.772 1.00 0.00 H new ATOM 0 HG23 THR A1572 7.542 7.967 -5.303 1.00 0.00 H new ATOM 719 N LYS A1573 8.045 11.672 -6.674 1.00 0.00 N ATOM 720 CA LYS A1573 9.329 12.297 -6.723 1.00 0.00 C ATOM 721 C LYS A1573 10.123 11.960 -5.463 1.00 0.00 C ATOM 722 O LYS A1573 11.314 12.241 -5.361 1.00 0.00 O ATOM 723 CB LYS A1573 9.141 13.791 -6.888 1.00 0.00 C ATOM 724 CG LYS A1573 8.347 14.457 -5.774 1.00 0.00 C ATOM 725 CD LYS A1573 7.624 15.657 -6.311 1.00 0.00 C ATOM 726 CE LYS A1573 6.814 16.365 -5.249 1.00 0.00 C ATOM 727 NZ LYS A1573 5.974 17.425 -5.833 1.00 0.00 N1+ ATOM 0 H LYS A1573 7.323 12.232 -6.220 1.00 0.00 H new ATOM 0 HA LYS A1573 9.899 11.925 -7.574 1.00 0.00 H new ATOM 0 HB2 LYS A1573 10.122 14.263 -6.949 1.00 0.00 H new ATOM 0 HB3 LYS A1573 8.638 13.978 -7.837 1.00 0.00 H new ATOM 0 HG2 LYS A1573 7.633 13.750 -5.351 1.00 0.00 H new ATOM 0 HG3 LYS A1573 9.016 14.755 -4.967 1.00 0.00 H new ATOM 0 HD2 LYS A1573 8.347 16.353 -6.737 1.00 0.00 H new ATOM 0 HD3 LYS A1573 6.964 15.348 -7.121 1.00 0.00 H new ATOM 0 HE2 LYS A1573 6.184 15.644 -4.729 1.00 0.00 H new ATOM 0 HE3 LYS A1573 7.484 16.797 -4.506 1.00 0.00 H new ATOM 0 HZ1 LYS A1573 5.138 17.575 -5.233 1.00 0.00 H new ATOM 0 HZ2 LYS A1573 6.521 18.308 -5.893 1.00 0.00 H new ATOM 0 HZ3 LYS A1573 5.670 17.141 -6.786 1.00 0.00 H new ATOM 741 N ASN A1574 9.441 11.368 -4.504 1.00 0.00 N ATOM 742 CA ASN A1574 10.051 10.979 -3.252 1.00 0.00 C ATOM 743 C ASN A1574 10.510 9.534 -3.293 1.00 0.00 C ATOM 744 O ASN A1574 11.390 9.138 -2.536 1.00 0.00 O ATOM 745 CB ASN A1574 9.093 11.196 -2.073 1.00 0.00 C ATOM 746 CG ASN A1574 8.931 12.656 -1.673 1.00 0.00 C ATOM 747 OD1 ASN A1574 9.032 13.569 -2.499 1.00 0.00 O ATOM 748 ND2 ASN A1574 8.677 12.893 -0.406 1.00 0.00 N ATOM 0 H ASN A1574 8.448 11.144 -4.572 1.00 0.00 H new ATOM 0 HA ASN A1574 10.924 11.616 -3.106 1.00 0.00 H new ATOM 0 HB2 ASN A1574 8.115 10.789 -2.332 1.00 0.00 H new ATOM 0 HB3 ASN A1574 9.456 10.632 -1.214 1.00 0.00 H new ATOM 0 HD21 ASN A1574 8.557 13.852 -0.081 1.00 0.00 H new ATOM 0 HD22 ASN A1574 8.599 12.118 0.252 1.00 0.00 H new ATOM 755 N CYS A1575 9.943 8.769 -4.180 1.00 0.00 N ATOM 756 CA CYS A1575 10.302 7.378 -4.331 1.00 0.00 C ATOM 757 C CYS A1575 10.405 7.144 -5.832 1.00 0.00 C ATOM 758 O CYS A1575 9.600 7.695 -6.582 1.00 0.00 O ATOM 759 CB CYS A1575 9.200 6.512 -3.682 1.00 0.00 C ATOM 760 SG CYS A1575 9.663 4.792 -3.305 1.00 0.00 S ATOM 0 H CYS A1575 9.217 9.087 -4.822 1.00 0.00 H new ATOM 0 HA CYS A1575 11.243 7.117 -3.846 1.00 0.00 H new ATOM 0 HB2 CYS A1575 8.883 6.994 -2.757 1.00 0.00 H new ATOM 0 HB3 CYS A1575 8.336 6.498 -4.347 1.00 0.00 H new ATOM 765 N PRO A1576 11.371 6.338 -6.288 1.00 0.00 N ATOM 766 CA PRO A1576 11.661 6.165 -7.713 1.00 0.00 C ATOM 767 C PRO A1576 10.527 5.613 -8.568 1.00 0.00 C ATOM 768 O PRO A1576 9.629 4.910 -8.099 1.00 0.00 O ATOM 769 CB PRO A1576 12.804 5.185 -7.749 1.00 0.00 C ATOM 770 CG PRO A1576 13.355 5.114 -6.370 1.00 0.00 C ATOM 771 CD PRO A1576 12.269 5.541 -5.446 1.00 0.00 C ATOM 0 HA PRO A1576 11.862 7.148 -8.139 1.00 0.00 H new ATOM 0 HB2 PRO A1576 12.462 4.204 -8.079 1.00 0.00 H new ATOM 0 HB3 PRO A1576 13.569 5.510 -8.454 1.00 0.00 H new ATOM 0 HG2 PRO A1576 13.683 4.101 -6.137 1.00 0.00 H new ATOM 0 HG3 PRO A1576 14.225 5.762 -6.268 1.00 0.00 H new ATOM 0 HD2 PRO A1576 11.753 4.683 -5.015 1.00 0.00 H new ATOM 0 HD3 PRO A1576 12.661 6.128 -4.615 1.00 0.00 H new ATOM 779 N SER A1577 10.581 5.947 -9.830 1.00 0.00 N ATOM 780 CA SER A1577 9.703 5.412 -10.806 1.00 0.00 C ATOM 781 C SER A1577 9.990 3.912 -10.956 1.00 0.00 C ATOM 782 O SER A1577 11.155 3.501 -11.065 1.00 0.00 O ATOM 783 CB SER A1577 9.939 6.173 -12.095 1.00 0.00 C ATOM 784 OG SER A1577 11.320 6.149 -12.467 1.00 0.00 O ATOM 0 H SER A1577 11.256 6.614 -10.204 1.00 0.00 H new ATOM 0 HA SER A1577 8.656 5.519 -10.523 1.00 0.00 H new ATOM 0 HB2 SER A1577 9.338 5.737 -12.893 1.00 0.00 H new ATOM 0 HB3 SER A1577 9.610 7.205 -11.976 1.00 0.00 H new ATOM 0 HG SER A1577 11.713 5.289 -12.209 1.00 0.00 H new ATOM 790 N GLY A1578 8.956 3.106 -10.906 1.00 0.00 N ATOM 791 CA GLY A1578 9.144 1.673 -10.948 1.00 0.00 C ATOM 792 C GLY A1578 9.255 1.119 -9.546 1.00 0.00 C ATOM 793 O GLY A1578 9.361 -0.093 -9.331 1.00 0.00 O ATOM 0 H GLY A1578 7.985 3.412 -10.837 1.00 0.00 H new ATOM 0 HA2 GLY A1578 8.308 1.204 -11.467 1.00 0.00 H new ATOM 0 HA3 GLY A1578 10.044 1.434 -11.514 1.00 0.00 H new ATOM 797 N VAL A1579 9.201 2.000 -8.589 1.00 0.00 N ATOM 798 CA VAL A1579 9.300 1.650 -7.218 1.00 0.00 C ATOM 799 C VAL A1579 8.009 2.020 -6.509 1.00 0.00 C ATOM 800 O VAL A1579 7.560 3.154 -6.583 1.00 0.00 O ATOM 801 CB VAL A1579 10.483 2.375 -6.583 1.00 0.00 C ATOM 802 CG1 VAL A1579 10.468 2.163 -5.116 1.00 0.00 C ATOM 803 CG2 VAL A1579 11.791 1.860 -7.164 1.00 0.00 C ATOM 0 H VAL A1579 9.084 3.000 -8.753 1.00 0.00 H new ATOM 0 HA VAL A1579 9.461 0.576 -7.125 1.00 0.00 H new ATOM 0 HB VAL A1579 10.400 3.441 -6.796 1.00 0.00 H new ATOM 0 HG11 VAL A1579 11.314 2.682 -4.665 1.00 0.00 H new ATOM 0 HG12 VAL A1579 9.539 2.554 -4.701 1.00 0.00 H new ATOM 0 HG13 VAL A1579 10.540 1.097 -4.902 1.00 0.00 H new ATOM 0 HG21 VAL A1579 12.626 2.386 -6.702 1.00 0.00 H new ATOM 0 HG22 VAL A1579 11.881 0.792 -6.967 1.00 0.00 H new ATOM 0 HG23 VAL A1579 11.804 2.033 -8.240 1.00 0.00 H new ATOM 813 N GLY A1580 7.403 1.049 -5.875 1.00 0.00 N ATOM 814 CA GLY A1580 6.163 1.292 -5.195 1.00 0.00 C ATOM 815 C GLY A1580 6.401 1.804 -3.800 1.00 0.00 C ATOM 816 O GLY A1580 5.696 2.661 -3.316 1.00 0.00 O ATOM 0 H GLY A1580 7.747 0.091 -5.817 1.00 0.00 H new ATOM 0 HA2 GLY A1580 5.573 2.017 -5.756 1.00 0.00 H new ATOM 0 HA3 GLY A1580 5.581 0.371 -5.153 1.00 0.00 H new ATOM 820 N VAL A1581 7.407 1.264 -3.164 1.00 0.00 N ATOM 821 CA VAL A1581 7.783 1.620 -1.805 1.00 0.00 C ATOM 822 C VAL A1581 9.279 1.535 -1.716 1.00 0.00 C ATOM 823 O VAL A1581 9.865 0.669 -2.343 1.00 0.00 O ATOM 824 CB VAL A1581 7.126 0.644 -0.770 1.00 0.00 C ATOM 825 CG1 VAL A1581 7.747 0.770 0.603 1.00 0.00 C ATOM 826 CG2 VAL A1581 5.657 0.929 -0.645 1.00 0.00 C ATOM 0 H VAL A1581 8.005 0.549 -3.577 1.00 0.00 H new ATOM 0 HA VAL A1581 7.436 2.626 -1.571 1.00 0.00 H new ATOM 0 HB VAL A1581 7.293 -0.366 -1.143 1.00 0.00 H new ATOM 0 HG11 VAL A1581 7.261 0.075 1.288 1.00 0.00 H new ATOM 0 HG12 VAL A1581 8.810 0.537 0.544 1.00 0.00 H new ATOM 0 HG13 VAL A1581 7.619 1.789 0.968 1.00 0.00 H new ATOM 0 HG21 VAL A1581 5.214 0.244 0.077 1.00 0.00 H new ATOM 0 HG22 VAL A1581 5.513 1.955 -0.307 1.00 0.00 H new ATOM 0 HG23 VAL A1581 5.177 0.795 -1.614 1.00 0.00 H new ATOM 836 N CYS A1582 9.893 2.421 -0.990 1.00 0.00 N ATOM 837 CA CYS A1582 11.346 2.429 -0.868 1.00 0.00 C ATOM 838 C CYS A1582 11.797 3.017 0.456 1.00 0.00 C ATOM 839 O CYS A1582 11.231 3.972 0.924 1.00 0.00 O ATOM 840 CB CYS A1582 11.967 3.214 -2.037 1.00 0.00 C ATOM 841 SG CYS A1582 11.376 4.943 -2.196 1.00 0.00 S ATOM 0 H CYS A1582 9.420 3.157 -0.465 1.00 0.00 H new ATOM 0 HA CYS A1582 11.689 1.395 -0.902 1.00 0.00 H new ATOM 0 HB2 CYS A1582 13.050 3.224 -1.916 1.00 0.00 H new ATOM 0 HB3 CYS A1582 11.755 2.685 -2.966 1.00 0.00 H new ATOM 846 N PHE A1583 12.796 2.410 1.085 1.00 0.00 N ATOM 847 CA PHE A1583 13.376 2.982 2.283 1.00 0.00 C ATOM 848 C PHE A1583 14.018 4.300 1.937 1.00 0.00 C ATOM 849 O PHE A1583 14.547 4.470 0.853 1.00 0.00 O ATOM 850 CB PHE A1583 14.397 2.045 2.950 1.00 0.00 C ATOM 851 CG PHE A1583 13.786 0.944 3.776 1.00 0.00 C ATOM 852 CD1 PHE A1583 13.282 -0.200 3.188 1.00 0.00 C ATOM 853 CD2 PHE A1583 13.725 1.065 5.155 1.00 0.00 C ATOM 854 CE1 PHE A1583 12.726 -1.201 3.957 1.00 0.00 C ATOM 855 CE2 PHE A1583 13.172 0.066 5.930 1.00 0.00 C ATOM 856 CZ PHE A1583 12.672 -1.069 5.329 1.00 0.00 C ATOM 0 H PHE A1583 13.215 1.530 0.785 1.00 0.00 H new ATOM 0 HA PHE A1583 12.575 3.132 3.007 1.00 0.00 H new ATOM 0 HB2 PHE A1583 15.021 1.598 2.176 1.00 0.00 H new ATOM 0 HB3 PHE A1583 15.054 2.638 3.586 1.00 0.00 H new ATOM 0 HD1 PHE A1583 13.324 -0.312 2.115 1.00 0.00 H new ATOM 0 HD2 PHE A1583 14.115 1.953 5.630 1.00 0.00 H new ATOM 0 HE1 PHE A1583 12.333 -2.089 3.485 1.00 0.00 H new ATOM 0 HE2 PHE A1583 13.131 0.173 7.004 1.00 0.00 H new ATOM 0 HZ PHE A1583 12.239 -1.854 5.931 1.00 0.00 H new ATOM 866 N GLY A1584 13.962 5.199 2.842 1.00 0.00 N ATOM 867 CA GLY A1584 14.433 6.528 2.600 1.00 0.00 C ATOM 868 C GLY A1584 15.865 6.707 2.924 1.00 0.00 C ATOM 869 O GLY A1584 16.615 7.294 2.147 1.00 0.00 O ATOM 0 H GLY A1584 13.589 5.045 3.779 1.00 0.00 H new ATOM 0 HA2 GLY A1584 14.270 6.779 1.552 1.00 0.00 H new ATOM 0 HA3 GLY A1584 13.843 7.229 3.191 1.00 0.00 H new ATOM 873 N LEU A1585 16.246 6.179 4.052 1.00 0.00 N ATOM 874 CA LEU A1585 17.571 6.296 4.572 1.00 0.00 C ATOM 875 C LEU A1585 18.556 5.632 3.629 1.00 0.00 C ATOM 876 O LEU A1585 19.421 6.284 3.044 1.00 0.00 O ATOM 877 CB LEU A1585 17.607 5.634 5.973 1.00 0.00 C ATOM 878 CG LEU A1585 18.646 6.158 6.980 1.00 0.00 C ATOM 879 CD1 LEU A1585 20.078 5.921 6.522 1.00 0.00 C ATOM 880 CD2 LEU A1585 18.393 7.627 7.232 1.00 0.00 C ATOM 0 H LEU A1585 15.621 5.639 4.651 1.00 0.00 H new ATOM 0 HA LEU A1585 17.854 7.345 4.663 1.00 0.00 H new ATOM 0 HB2 LEU A1585 16.620 5.742 6.422 1.00 0.00 H new ATOM 0 HB3 LEU A1585 17.780 4.566 5.836 1.00 0.00 H new ATOM 0 HG LEU A1585 18.530 5.598 7.908 1.00 0.00 H new ATOM 0 HD11 LEU A1585 20.768 6.310 7.270 1.00 0.00 H new ATOM 0 HD12 LEU A1585 20.247 4.852 6.394 1.00 0.00 H new ATOM 0 HD13 LEU A1585 20.246 6.431 5.573 1.00 0.00 H new ATOM 0 HD21 LEU A1585 19.126 8.005 7.945 1.00 0.00 H new ATOM 0 HD22 LEU A1585 18.481 8.177 6.295 1.00 0.00 H new ATOM 0 HD23 LEU A1585 17.390 7.759 7.638 1.00 0.00 H new ATOM 892 N THR A1586 18.376 4.365 3.443 1.00 0.00 N ATOM 893 CA THR A1586 19.276 3.574 2.697 1.00 0.00 C ATOM 894 C THR A1586 18.778 3.293 1.270 1.00 0.00 C ATOM 895 O THR A1586 19.392 2.536 0.523 1.00 0.00 O ATOM 896 CB THR A1586 19.493 2.307 3.502 1.00 0.00 C ATOM 897 OG1 THR A1586 18.196 1.942 4.041 1.00 0.00 O ATOM 898 CG2 THR A1586 20.428 2.568 4.671 1.00 0.00 C ATOM 0 H THR A1586 17.580 3.848 3.817 1.00 0.00 H new ATOM 0 HA THR A1586 20.218 4.101 2.546 1.00 0.00 H new ATOM 0 HB THR A1586 19.927 1.529 2.874 1.00 0.00 H new ATOM 0 HG1 THR A1586 18.081 2.353 4.923 1.00 0.00 H new ATOM 0 HG21 THR A1586 20.571 1.647 5.236 1.00 0.00 H new ATOM 0 HG22 THR A1586 21.390 2.917 4.296 1.00 0.00 H new ATOM 0 HG23 THR A1586 19.995 3.328 5.321 1.00 0.00 H new ATOM 906 N LYS A1587 17.684 3.958 0.910 1.00 0.00 N ATOM 907 CA LYS A1587 17.060 3.905 -0.435 1.00 0.00 C ATOM 908 C LYS A1587 16.863 2.492 -0.971 1.00 0.00 C ATOM 909 O LYS A1587 17.244 2.168 -2.109 1.00 0.00 O ATOM 910 CB LYS A1587 17.771 4.814 -1.444 1.00 0.00 C ATOM 911 CG LYS A1587 17.569 6.300 -1.185 1.00 0.00 C ATOM 912 CD LYS A1587 16.091 6.674 -1.274 1.00 0.00 C ATOM 913 CE LYS A1587 15.862 8.168 -1.090 1.00 0.00 C ATOM 914 NZ LYS A1587 16.549 8.966 -2.128 1.00 0.00 N1+ ATOM 0 H LYS A1587 17.183 4.570 1.554 1.00 0.00 H new ATOM 0 HA LYS A1587 16.054 4.302 -0.297 1.00 0.00 H new ATOM 0 HB2 LYS A1587 18.838 4.594 -1.427 1.00 0.00 H new ATOM 0 HB3 LYS A1587 17.413 4.578 -2.446 1.00 0.00 H new ATOM 0 HG2 LYS A1587 17.954 6.557 -0.198 1.00 0.00 H new ATOM 0 HG3 LYS A1587 18.139 6.880 -1.910 1.00 0.00 H new ATOM 0 HD2 LYS A1587 15.698 6.365 -2.242 1.00 0.00 H new ATOM 0 HD3 LYS A1587 15.533 6.127 -0.514 1.00 0.00 H new ATOM 0 HE2 LYS A1587 14.793 8.377 -1.121 1.00 0.00 H new ATOM 0 HE3 LYS A1587 16.218 8.471 -0.105 1.00 0.00 H new ATOM 0 HZ1 LYS A1587 16.184 9.940 -2.115 1.00 0.00 H new ATOM 0 HZ2 LYS A1587 17.571 8.977 -1.938 1.00 0.00 H new ATOM 0 HZ3 LYS A1587 16.375 8.544 -3.062 1.00 0.00 H new ATOM 928 N ILE A1588 16.279 1.666 -0.150 1.00 0.00 N ATOM 929 CA ILE A1588 16.031 0.276 -0.486 1.00 0.00 C ATOM 930 C ILE A1588 14.567 0.087 -0.804 1.00 0.00 C ATOM 931 O ILE A1588 13.742 0.099 0.103 1.00 0.00 O ATOM 932 CB ILE A1588 16.361 -0.589 0.712 1.00 0.00 C ATOM 933 CG1 ILE A1588 17.713 -0.204 1.244 1.00 0.00 C ATOM 934 CG2 ILE A1588 16.390 -2.036 0.263 1.00 0.00 C ATOM 935 CD1 ILE A1588 17.976 -0.700 2.620 1.00 0.00 C ATOM 0 H ILE A1588 15.956 1.932 0.780 1.00 0.00 H new ATOM 0 HA ILE A1588 16.644 0.000 -1.344 1.00 0.00 H new ATOM 0 HB ILE A1588 15.614 -0.453 1.494 1.00 0.00 H new ATOM 0 HG12 ILE A1588 18.481 -0.591 0.575 1.00 0.00 H new ATOM 0 HG13 ILE A1588 17.801 0.882 1.236 1.00 0.00 H new ATOM 0 HG21 ILE A1588 16.626 -2.676 1.113 1.00 0.00 H new ATOM 0 HG22 ILE A1588 15.415 -2.312 -0.139 1.00 0.00 H new ATOM 0 HG23 ILE A1588 17.149 -2.162 -0.509 1.00 0.00 H new ATOM 0 HD11 ILE A1588 18.970 -0.384 2.937 1.00 0.00 H new ATOM 0 HD12 ILE A1588 17.230 -0.292 3.303 1.00 0.00 H new ATOM 0 HD13 ILE A1588 17.921 -1.789 2.631 1.00 0.00 H new ATOM 947 N ASN A1589 14.228 0.033 -2.067 1.00 0.00 N ATOM 948 CA ASN A1589 12.862 -0.161 -2.477 1.00 0.00 C ATOM 949 C ASN A1589 12.210 -1.407 -1.882 1.00 0.00 C ATOM 950 O ASN A1589 12.484 -2.521 -2.244 1.00 0.00 O ATOM 951 CB ASN A1589 12.681 -0.033 -3.994 1.00 0.00 C ATOM 952 CG ASN A1589 13.255 -1.093 -4.876 1.00 0.00 C ATOM 953 OD1 ASN A1589 14.430 -1.049 -5.226 1.00 0.00 O ATOM 954 ND2 ASN A1589 12.428 -1.968 -5.345 1.00 0.00 N ATOM 0 H ASN A1589 14.890 0.122 -2.838 1.00 0.00 H new ATOM 0 HA ASN A1589 12.303 0.667 -2.041 1.00 0.00 H new ATOM 0 HB2 ASN A1589 11.611 0.022 -4.196 1.00 0.00 H new ATOM 0 HB3 ASN A1589 13.112 0.920 -4.299 1.00 0.00 H new ATOM 0 HD21 ASN A1589 12.745 -2.653 -6.030 1.00 0.00 H new ATOM 0 HD22 ASN A1589 11.458 -1.973 -5.030 1.00 0.00 H new ATOM 961 N ALA A1590 11.297 -1.169 -0.997 1.00 0.00 N ATOM 962 CA ALA A1590 10.639 -2.196 -0.244 1.00 0.00 C ATOM 963 C ALA A1590 9.422 -2.744 -0.979 1.00 0.00 C ATOM 964 O ALA A1590 8.590 -3.416 -0.398 1.00 0.00 O ATOM 965 CB ALA A1590 10.243 -1.643 1.101 1.00 0.00 C ATOM 0 H ALA A1590 10.977 -0.228 -0.769 1.00 0.00 H new ATOM 0 HA ALA A1590 11.331 -3.028 -0.112 1.00 0.00 H new ATOM 0 HB1 ALA A1590 9.742 -2.419 1.680 1.00 0.00 H new ATOM 0 HB2 ALA A1590 11.134 -1.311 1.634 1.00 0.00 H new ATOM 0 HB3 ALA A1590 9.567 -0.799 0.963 1.00 0.00 H new ATOM 971 N GLY A1591 9.346 -2.461 -2.246 1.00 0.00 N ATOM 972 CA GLY A1591 8.292 -2.959 -3.053 1.00 0.00 C ATOM 973 C GLY A1591 8.378 -2.384 -4.426 1.00 0.00 C ATOM 974 O GLY A1591 8.790 -1.222 -4.593 1.00 0.00 O ATOM 0 H GLY A1591 10.019 -1.876 -2.742 1.00 0.00 H new ATOM 0 HA2 GLY A1591 8.345 -4.047 -3.102 1.00 0.00 H new ATOM 0 HA3 GLY A1591 7.331 -2.707 -2.605 1.00 0.00 H new ATOM 978 N SER A1592 8.041 -3.153 -5.405 1.00 0.00 N ATOM 979 CA SER A1592 8.082 -2.676 -6.748 1.00 0.00 C ATOM 980 C SER A1592 6.719 -2.146 -7.161 1.00 0.00 C ATOM 981 O SER A1592 5.698 -2.666 -6.728 1.00 0.00 O ATOM 982 CB SER A1592 8.592 -3.767 -7.677 1.00 0.00 C ATOM 983 OG SER A1592 9.911 -4.147 -7.293 1.00 0.00 O ATOM 0 H SER A1592 7.732 -4.120 -5.301 1.00 0.00 H new ATOM 0 HA SER A1592 8.781 -1.843 -6.818 1.00 0.00 H new ATOM 0 HB2 SER A1592 7.928 -4.631 -7.638 1.00 0.00 H new ATOM 0 HB3 SER A1592 8.591 -3.411 -8.707 1.00 0.00 H new ATOM 0 HG SER A1592 9.938 -5.112 -7.126 1.00 0.00 H new ATOM 989 N TRP A1593 6.752 -1.061 -7.927 1.00 0.00 N ATOM 990 CA TRP A1593 5.586 -0.331 -8.479 1.00 0.00 C ATOM 991 C TRP A1593 4.506 -1.288 -8.951 1.00 0.00 C ATOM 992 O TRP A1593 4.766 -2.123 -9.811 1.00 0.00 O ATOM 993 CB TRP A1593 6.091 0.365 -9.709 1.00 0.00 C ATOM 994 CG TRP A1593 5.622 1.739 -9.955 1.00 0.00 C ATOM 995 CD1 TRP A1593 5.936 2.838 -9.234 1.00 0.00 C ATOM 996 CD2 TRP A1593 4.830 2.179 -11.048 1.00 0.00 C ATOM 997 NE1 TRP A1593 5.394 3.938 -9.798 1.00 0.00 N ATOM 998 CE2 TRP A1593 4.689 3.562 -10.920 1.00 0.00 C ATOM 999 CE3 TRP A1593 4.214 1.533 -12.119 1.00 0.00 C ATOM 1000 CZ2 TRP A1593 3.964 4.322 -11.830 1.00 0.00 C ATOM 1001 CZ3 TRP A1593 3.493 2.286 -13.016 1.00 0.00 C ATOM 1002 CH2 TRP A1593 3.374 3.665 -12.867 1.00 0.00 C ATOM 0 H TRP A1593 7.636 -0.633 -8.202 1.00 0.00 H new ATOM 0 HA TRP A1593 5.173 0.331 -7.718 1.00 0.00 H new ATOM 0 HB2 TRP A1593 7.180 0.385 -9.661 1.00 0.00 H new ATOM 0 HB3 TRP A1593 5.821 -0.242 -10.573 1.00 0.00 H new ATOM 0 HD1 TRP A1593 6.535 2.836 -8.335 1.00 0.00 H new ATOM 0 HE1 TRP A1593 5.491 4.892 -9.450 1.00 0.00 H new ATOM 0 HE3 TRP A1593 4.301 0.464 -12.242 1.00 0.00 H new ATOM 0 HZ2 TRP A1593 3.872 5.392 -11.719 1.00 0.00 H new ATOM 0 HZ3 TRP A1593 3.011 1.799 -13.851 1.00 0.00 H new ATOM 0 HH2 TRP A1593 2.801 4.227 -13.590 1.00 0.00 H new ATOM 1013 N ASN A1594 3.315 -1.155 -8.414 1.00 0.00 N ATOM 1014 CA ASN A1594 2.195 -2.006 -8.800 1.00 0.00 C ATOM 1015 C ASN A1594 0.916 -1.284 -8.561 1.00 0.00 C ATOM 1016 O ASN A1594 0.893 -0.246 -7.924 1.00 0.00 O ATOM 1017 CB ASN A1594 2.117 -3.328 -7.993 1.00 0.00 C ATOM 1018 CG ASN A1594 3.058 -4.427 -8.389 1.00 0.00 C ATOM 1019 OD1 ASN A1594 3.448 -4.563 -9.548 1.00 0.00 O ATOM 1020 ND2 ASN A1594 3.352 -5.269 -7.439 1.00 0.00 N ATOM 0 H ASN A1594 3.088 -0.461 -7.702 1.00 0.00 H new ATOM 0 HA ASN A1594 2.353 -2.246 -9.851 1.00 0.00 H new ATOM 0 HB2 ASN A1594 2.293 -3.094 -6.943 1.00 0.00 H new ATOM 0 HB3 ASN A1594 1.099 -3.711 -8.068 1.00 0.00 H new ATOM 0 HD21 ASN A1594 3.930 -6.085 -7.641 1.00 0.00 H new ATOM 0 HD22 ASN A1594 3.004 -5.112 -6.493 1.00 0.00 H new ATOM 1027 N SER A1595 -0.133 -1.850 -9.058 1.00 0.00 N ATOM 1028 CA SER A1595 -1.468 -1.392 -8.842 1.00 0.00 C ATOM 1029 C SER A1595 -2.249 -2.618 -8.342 1.00 0.00 C ATOM 1030 O SER A1595 -3.463 -2.762 -8.555 1.00 0.00 O ATOM 1031 CB SER A1595 -2.041 -0.893 -10.170 1.00 0.00 C ATOM 1032 OG SER A1595 -1.096 -0.059 -10.856 1.00 0.00 O ATOM 0 H SER A1595 -0.083 -2.679 -9.651 1.00 0.00 H new ATOM 0 HA SER A1595 -1.522 -0.573 -8.125 1.00 0.00 H new ATOM 0 HB2 SER A1595 -2.305 -1.743 -10.799 1.00 0.00 H new ATOM 0 HB3 SER A1595 -2.959 -0.335 -9.987 1.00 0.00 H new ATOM 0 HG SER A1595 -1.414 0.116 -11.766 1.00 0.00 H new ATOM 1038 N GLN A1596 -1.518 -3.488 -7.660 1.00 0.00 N ATOM 1039 CA GLN A1596 -2.027 -4.747 -7.151 1.00 0.00 C ATOM 1040 C GLN A1596 -2.835 -4.513 -5.904 1.00 0.00 C ATOM 1041 O GLN A1596 -2.288 -4.521 -4.800 1.00 0.00 O ATOM 1042 CB GLN A1596 -0.882 -5.715 -6.826 1.00 0.00 C ATOM 1043 CG GLN A1596 -0.011 -6.102 -7.986 1.00 0.00 C ATOM 1044 CD GLN A1596 -0.797 -6.829 -9.001 1.00 0.00 C ATOM 1045 OE1 GLN A1596 -0.932 -8.036 -8.944 1.00 0.00 O ATOM 1046 NE2 GLN A1596 -1.289 -6.128 -9.952 1.00 0.00 N ATOM 0 H GLN A1596 -0.534 -3.332 -7.442 1.00 0.00 H new ATOM 0 HA GLN A1596 -2.655 -5.188 -7.925 1.00 0.00 H new ATOM 0 HB2 GLN A1596 -0.254 -5.262 -6.058 1.00 0.00 H new ATOM 0 HB3 GLN A1596 -1.308 -6.622 -6.396 1.00 0.00 H new ATOM 0 HG2 GLN A1596 0.431 -5.210 -8.430 1.00 0.00 H new ATOM 0 HG3 GLN A1596 0.812 -6.727 -7.638 1.00 0.00 H new ATOM 0 HE21 GLN A1596 -1.153 -5.117 -9.963 1.00 0.00 H new ATOM 0 HE22 GLN A1596 -1.817 -6.580 -10.699 1.00 0.00 H new ATOM 1055 N LEU A1597 -4.104 -4.265 -6.076 1.00 0.00 N ATOM 1056 CA LEU A1597 -4.962 -3.987 -4.971 1.00 0.00 C ATOM 1057 C LEU A1597 -5.952 -5.086 -4.767 1.00 0.00 C ATOM 1058 O LEU A1597 -6.523 -5.600 -5.717 1.00 0.00 O ATOM 1059 CB LEU A1597 -5.705 -2.698 -5.172 1.00 0.00 C ATOM 1060 CG LEU A1597 -6.582 -2.298 -4.002 1.00 0.00 C ATOM 1061 CD1 LEU A1597 -5.761 -2.046 -2.754 1.00 0.00 C ATOM 1062 CD2 LEU A1597 -7.373 -1.111 -4.353 1.00 0.00 C ATOM 0 H LEU A1597 -4.566 -4.251 -6.985 1.00 0.00 H new ATOM 0 HA LEU A1597 -4.327 -3.904 -4.089 1.00 0.00 H new ATOM 0 HB2 LEU A1597 -4.985 -1.902 -5.361 1.00 0.00 H new ATOM 0 HB3 LEU A1597 -6.325 -2.784 -6.064 1.00 0.00 H new ATOM 0 HG LEU A1597 -7.259 -3.124 -3.785 1.00 0.00 H new ATOM 0 HD11 LEU A1597 -6.422 -1.761 -1.935 1.00 0.00 H new ATOM 0 HD12 LEU A1597 -5.220 -2.953 -2.485 1.00 0.00 H new ATOM 0 HD13 LEU A1597 -5.050 -1.242 -2.943 1.00 0.00 H new ATOM 0 HD21 LEU A1597 -8.001 -0.829 -3.508 1.00 0.00 H new ATOM 0 HD22 LEU A1597 -6.703 -0.287 -4.598 1.00 0.00 H new ATOM 0 HD23 LEU A1597 -8.003 -1.335 -5.214 1.00 0.00 H new ATOM 1074 N MET A1598 -6.135 -5.429 -3.537 1.00 0.00 N ATOM 1075 CA MET A1598 -7.081 -6.443 -3.125 1.00 0.00 C ATOM 1076 C MET A1598 -7.840 -5.957 -1.914 1.00 0.00 C ATOM 1077 O MET A1598 -7.639 -4.840 -1.482 1.00 0.00 O ATOM 1078 CB MET A1598 -6.365 -7.753 -2.848 1.00 0.00 C ATOM 1079 CG MET A1598 -5.820 -8.405 -4.110 1.00 0.00 C ATOM 1080 SD MET A1598 -4.141 -9.026 -3.881 1.00 0.00 S ATOM 1081 CE MET A1598 -3.295 -7.478 -3.499 1.00 0.00 C ATOM 0 H MET A1598 -5.624 -5.009 -2.761 1.00 0.00 H new ATOM 0 HA MET A1598 -7.795 -6.627 -3.928 1.00 0.00 H new ATOM 0 HB2 MET A1598 -5.544 -7.573 -2.154 1.00 0.00 H new ATOM 0 HB3 MET A1598 -7.053 -8.441 -2.357 1.00 0.00 H new ATOM 0 HG2 MET A1598 -6.473 -9.227 -4.404 1.00 0.00 H new ATOM 0 HG3 MET A1598 -5.831 -7.681 -4.925 1.00 0.00 H new ATOM 0 HE1 MET A1598 -2.244 -7.560 -3.775 1.00 0.00 H new ATOM 0 HE2 MET A1598 -3.755 -6.664 -4.060 1.00 0.00 H new ATOM 0 HE3 MET A1598 -3.375 -7.273 -2.431 1.00 0.00 H new ATOM 1091 N TYR A1599 -8.705 -6.779 -1.391 1.00 0.00 N ATOM 1092 CA TYR A1599 -9.560 -6.435 -0.284 1.00 0.00 C ATOM 1093 C TYR A1599 -9.614 -7.644 0.614 1.00 0.00 C ATOM 1094 O TYR A1599 -10.231 -8.652 0.288 1.00 0.00 O ATOM 1095 CB TYR A1599 -10.963 -6.081 -0.799 1.00 0.00 C ATOM 1096 CG TYR A1599 -11.898 -5.577 0.263 1.00 0.00 C ATOM 1097 CD1 TYR A1599 -11.630 -4.397 0.925 1.00 0.00 C ATOM 1098 CD2 TYR A1599 -13.035 -6.283 0.606 1.00 0.00 C ATOM 1099 CE1 TYR A1599 -12.469 -3.920 1.906 1.00 0.00 C ATOM 1100 CE2 TYR A1599 -13.892 -5.818 1.592 1.00 0.00 C ATOM 1101 CZ TYR A1599 -13.604 -4.632 2.239 1.00 0.00 C ATOM 1102 OH TYR A1599 -14.443 -4.163 3.237 1.00 0.00 O ATOM 0 H TYR A1599 -8.841 -7.732 -1.729 1.00 0.00 H new ATOM 0 HA TYR A1599 -9.180 -5.569 0.258 1.00 0.00 H new ATOM 0 HB2 TYR A1599 -10.872 -5.323 -1.577 1.00 0.00 H new ATOM 0 HB3 TYR A1599 -11.401 -6.964 -1.264 1.00 0.00 H new ATOM 0 HD1 TYR A1599 -10.744 -3.836 0.668 1.00 0.00 H new ATOM 0 HD2 TYR A1599 -13.259 -7.210 0.099 1.00 0.00 H new ATOM 0 HE1 TYR A1599 -12.241 -2.994 2.413 1.00 0.00 H new ATOM 0 HE2 TYR A1599 -14.778 -6.379 1.852 1.00 0.00 H new ATOM 0 HH TYR A1599 -14.870 -4.921 3.688 1.00 0.00 H new ATOM 1112 N VAL A1600 -8.919 -7.564 1.673 1.00 0.00 N ATOM 1113 CA VAL A1600 -8.769 -8.640 2.592 1.00 0.00 C ATOM 1114 C VAL A1600 -8.918 -8.123 4.007 1.00 0.00 C ATOM 1115 O VAL A1600 -8.245 -7.160 4.401 1.00 0.00 O ATOM 1116 CB VAL A1600 -7.385 -9.328 2.365 1.00 0.00 C ATOM 1117 CG1 VAL A1600 -6.265 -8.302 2.215 1.00 0.00 C ATOM 1118 CG2 VAL A1600 -7.070 -10.322 3.475 1.00 0.00 C ATOM 0 H VAL A1600 -8.415 -6.720 1.946 1.00 0.00 H new ATOM 0 HA VAL A1600 -9.545 -9.388 2.429 1.00 0.00 H new ATOM 0 HB VAL A1600 -7.451 -9.883 1.429 1.00 0.00 H new ATOM 0 HG11 VAL A1600 -5.318 -8.818 2.059 1.00 0.00 H new ATOM 0 HG12 VAL A1600 -6.473 -7.658 1.360 1.00 0.00 H new ATOM 0 HG13 VAL A1600 -6.203 -7.696 3.119 1.00 0.00 H new ATOM 0 HG21 VAL A1600 -6.100 -10.783 3.286 1.00 0.00 H new ATOM 0 HG22 VAL A1600 -7.045 -9.802 4.433 1.00 0.00 H new ATOM 0 HG23 VAL A1600 -7.839 -11.094 3.501 1.00 0.00 H new ATOM 1128 N ASP A1601 -9.859 -8.711 4.738 1.00 0.00 N ATOM 1129 CA ASP A1601 -10.160 -8.345 6.128 1.00 0.00 C ATOM 1130 C ASP A1601 -10.715 -6.954 6.239 1.00 0.00 C ATOM 1131 O ASP A1601 -10.413 -6.234 7.196 1.00 0.00 O ATOM 1132 CB ASP A1601 -8.929 -8.463 7.023 1.00 0.00 C ATOM 1133 CG ASP A1601 -8.662 -9.854 7.488 1.00 0.00 C ATOM 1134 OD1 ASP A1601 -9.206 -10.246 8.530 1.00 0.00 O1- ATOM 1135 OD2 ASP A1601 -7.899 -10.590 6.832 1.00 0.00 O ATOM 0 H ASP A1601 -10.445 -9.466 4.382 1.00 0.00 H new ATOM 0 HA ASP A1601 -10.917 -9.053 6.466 1.00 0.00 H new ATOM 0 HB2 ASP A1601 -8.058 -8.097 6.479 1.00 0.00 H new ATOM 0 HB3 ASP A1601 -9.058 -7.817 7.891 1.00 0.00 H new ATOM 1140 N GLN A1602 -11.561 -6.589 5.275 1.00 0.00 N ATOM 1141 CA GLN A1602 -12.200 -5.259 5.204 1.00 0.00 C ATOM 1142 C GLN A1602 -11.161 -4.169 4.975 1.00 0.00 C ATOM 1143 O GLN A1602 -11.424 -2.977 5.140 1.00 0.00 O ATOM 1144 CB GLN A1602 -13.045 -4.970 6.455 1.00 0.00 C ATOM 1145 CG GLN A1602 -14.187 -5.944 6.654 1.00 0.00 C ATOM 1146 CD GLN A1602 -14.980 -5.661 7.900 1.00 0.00 C ATOM 1147 OE1 GLN A1602 -14.681 -6.178 8.976 1.00 0.00 O ATOM 1148 NE2 GLN A1602 -15.983 -4.841 7.780 1.00 0.00 N ATOM 0 H GLN A1602 -11.829 -7.209 4.511 1.00 0.00 H new ATOM 0 HA GLN A1602 -12.878 -5.263 4.350 1.00 0.00 H new ATOM 0 HB2 GLN A1602 -12.400 -4.996 7.333 1.00 0.00 H new ATOM 0 HB3 GLN A1602 -13.448 -3.960 6.385 1.00 0.00 H new ATOM 0 HG2 GLN A1602 -14.849 -5.903 5.789 1.00 0.00 H new ATOM 0 HG3 GLN A1602 -13.790 -6.958 6.703 1.00 0.00 H new ATOM 0 HE21 GLN A1602 -16.201 -4.432 6.872 1.00 0.00 H new ATOM 0 HE22 GLN A1602 -16.551 -4.608 8.594 1.00 0.00 H new ATOM 1157 N VAL A1603 -10.005 -4.596 4.558 1.00 0.00 N ATOM 1158 CA VAL A1603 -8.886 -3.743 4.314 1.00 0.00 C ATOM 1159 C VAL A1603 -8.396 -3.924 2.874 1.00 0.00 C ATOM 1160 O VAL A1603 -8.281 -5.046 2.388 1.00 0.00 O ATOM 1161 CB VAL A1603 -7.768 -4.101 5.332 1.00 0.00 C ATOM 1162 CG1 VAL A1603 -6.465 -3.514 4.936 1.00 0.00 C ATOM 1163 CG2 VAL A1603 -8.115 -3.556 6.688 1.00 0.00 C ATOM 0 H VAL A1603 -9.812 -5.580 4.373 1.00 0.00 H new ATOM 0 HA VAL A1603 -9.169 -2.698 4.440 1.00 0.00 H new ATOM 0 HB VAL A1603 -7.689 -5.188 5.353 1.00 0.00 H new ATOM 0 HG11 VAL A1603 -5.706 -3.784 5.670 1.00 0.00 H new ATOM 0 HG12 VAL A1603 -6.176 -3.897 3.957 1.00 0.00 H new ATOM 0 HG13 VAL A1603 -6.554 -2.429 4.889 1.00 0.00 H new ATOM 0 HG21 VAL A1603 -7.326 -3.811 7.396 1.00 0.00 H new ATOM 0 HG22 VAL A1603 -8.214 -2.472 6.630 1.00 0.00 H new ATOM 0 HG23 VAL A1603 -9.057 -3.989 7.024 1.00 0.00 H new ATOM 1173 N LEU A1604 -8.147 -2.826 2.192 1.00 0.00 N ATOM 1174 CA LEU A1604 -7.640 -2.881 0.828 1.00 0.00 C ATOM 1175 C LEU A1604 -6.161 -3.246 0.977 1.00 0.00 C ATOM 1176 O LEU A1604 -5.513 -2.804 1.930 1.00 0.00 O ATOM 1177 CB LEU A1604 -7.735 -1.488 0.146 1.00 0.00 C ATOM 1178 CG LEU A1604 -8.968 -0.608 0.410 1.00 0.00 C ATOM 1179 CD1 LEU A1604 -9.044 0.472 -0.609 1.00 0.00 C ATOM 1180 CD2 LEU A1604 -10.261 -1.355 0.444 1.00 0.00 C ATOM 0 H LEU A1604 -8.286 -1.883 2.555 1.00 0.00 H new ATOM 0 HA LEU A1604 -8.206 -3.589 0.223 1.00 0.00 H new ATOM 0 HB2 LEU A1604 -6.855 -0.917 0.441 1.00 0.00 H new ATOM 0 HB3 LEU A1604 -7.667 -1.644 -0.931 1.00 0.00 H new ATOM 0 HG LEU A1604 -8.830 -0.194 1.409 1.00 0.00 H new ATOM 0 HD11 LEU A1604 -9.919 1.092 -0.417 1.00 0.00 H new ATOM 0 HD12 LEU A1604 -8.145 1.086 -0.556 1.00 0.00 H new ATOM 0 HD13 LEU A1604 -9.123 0.030 -1.602 1.00 0.00 H new ATOM 0 HD21 LEU A1604 -11.078 -0.659 0.635 1.00 0.00 H new ATOM 0 HD22 LEU A1604 -10.421 -1.848 -0.515 1.00 0.00 H new ATOM 0 HD23 LEU A1604 -10.228 -2.103 1.236 1.00 0.00 H new ATOM 1192 N GLN A1605 -5.632 -4.053 0.120 1.00 0.00 N ATOM 1193 CA GLN A1605 -4.273 -4.466 0.283 1.00 0.00 C ATOM 1194 C GLN A1605 -3.485 -4.208 -0.970 1.00 0.00 C ATOM 1195 O GLN A1605 -3.856 -4.689 -2.033 1.00 0.00 O ATOM 1196 CB GLN A1605 -4.232 -5.961 0.576 1.00 0.00 C ATOM 1197 CG GLN A1605 -2.942 -6.449 1.176 1.00 0.00 C ATOM 1198 CD GLN A1605 -2.894 -6.297 2.693 1.00 0.00 C ATOM 1199 OE1 GLN A1605 -3.617 -5.346 3.238 1.00 0.00 O flip ATOM 1200 NE2 GLN A1605 -2.227 -7.067 3.377 1.00 0.00 N flip ATOM 0 H GLN A1605 -6.111 -4.438 -0.694 1.00 0.00 H new ATOM 0 HA GLN A1605 -3.838 -3.899 1.106 1.00 0.00 H new ATOM 0 HB2 GLN A1605 -5.049 -6.207 1.255 1.00 0.00 H new ATOM 0 HB3 GLN A1605 -4.414 -6.504 -0.351 1.00 0.00 H new ATOM 0 HG2 GLN A1605 -2.802 -7.498 0.917 1.00 0.00 H new ATOM 0 HG3 GLN A1605 -2.111 -5.898 0.735 1.00 0.00 H new ATOM 0 HE21 GLN A1605 -1.674 -7.798 2.930 1.00 0.00 H new ATOM 0 HE22 GLN A1605 -2.226 -6.976 4.393 1.00 0.00 H new ATOM 1209 N LEU A1606 -2.447 -3.429 -0.862 1.00 0.00 N ATOM 1210 CA LEU A1606 -1.512 -3.299 -1.952 1.00 0.00 C ATOM 1211 C LEU A1606 -0.326 -4.152 -1.625 1.00 0.00 C ATOM 1212 O LEU A1606 0.264 -4.010 -0.554 1.00 0.00 O ATOM 1213 CB LEU A1606 -1.051 -1.851 -2.194 1.00 0.00 C ATOM 1214 CG LEU A1606 -2.057 -0.885 -2.817 1.00 0.00 C ATOM 1215 CD1 LEU A1606 -1.427 0.480 -2.989 1.00 0.00 C ATOM 1216 CD2 LEU A1606 -2.526 -1.400 -4.157 1.00 0.00 C ATOM 0 H LEU A1606 -2.224 -2.875 -0.035 1.00 0.00 H new ATOM 0 HA LEU A1606 -2.010 -3.614 -2.869 1.00 0.00 H new ATOM 0 HB2 LEU A1606 -0.733 -1.435 -1.238 1.00 0.00 H new ATOM 0 HB3 LEU A1606 -0.171 -1.881 -2.837 1.00 0.00 H new ATOM 0 HG LEU A1606 -2.916 -0.805 -2.151 1.00 0.00 H new ATOM 0 HD11 LEU A1606 -2.152 1.162 -3.434 1.00 0.00 H new ATOM 0 HD12 LEU A1606 -1.118 0.863 -2.017 1.00 0.00 H new ATOM 0 HD13 LEU A1606 -0.557 0.400 -3.641 1.00 0.00 H new ATOM 0 HD21 LEU A1606 -3.242 -0.699 -4.586 1.00 0.00 H new ATOM 0 HD22 LEU A1606 -1.672 -1.502 -4.827 1.00 0.00 H new ATOM 0 HD23 LEU A1606 -3.003 -2.372 -4.027 1.00 0.00 H new ATOM 1228 N VAL A1607 0.002 -5.038 -2.515 1.00 0.00 N ATOM 1229 CA VAL A1607 1.110 -5.947 -2.318 1.00 0.00 C ATOM 1230 C VAL A1607 2.171 -5.701 -3.378 1.00 0.00 C ATOM 1231 O VAL A1607 2.038 -6.109 -4.547 1.00 0.00 O ATOM 1232 CB VAL A1607 0.649 -7.433 -2.348 1.00 0.00 C ATOM 1233 CG1 VAL A1607 1.847 -8.382 -2.205 1.00 0.00 C ATOM 1234 CG2 VAL A1607 -0.352 -7.707 -1.229 1.00 0.00 C ATOM 0 H VAL A1607 -0.486 -5.158 -3.402 1.00 0.00 H new ATOM 0 HA VAL A1607 1.531 -5.756 -1.331 1.00 0.00 H new ATOM 0 HB VAL A1607 0.170 -7.612 -3.311 1.00 0.00 H new ATOM 0 HG11 VAL A1607 1.498 -9.414 -2.229 1.00 0.00 H new ATOM 0 HG12 VAL A1607 2.543 -8.215 -3.027 1.00 0.00 H new ATOM 0 HG13 VAL A1607 2.351 -8.191 -1.258 1.00 0.00 H new ATOM 0 HG21 VAL A1607 -0.663 -8.751 -1.266 1.00 0.00 H new ATOM 0 HG22 VAL A1607 0.114 -7.501 -0.265 1.00 0.00 H new ATOM 0 HG23 VAL A1607 -1.223 -7.064 -1.355 1.00 0.00 H new ATOM 1244 N TYR A1608 3.151 -4.958 -2.995 1.00 0.00 N ATOM 1245 CA TYR A1608 4.280 -4.665 -3.840 1.00 0.00 C ATOM 1246 C TYR A1608 5.360 -5.713 -3.590 1.00 0.00 C ATOM 1247 O TYR A1608 6.157 -5.566 -2.678 1.00 0.00 O ATOM 1248 CB TYR A1608 4.857 -3.273 -3.546 1.00 0.00 C ATOM 1249 CG TYR A1608 3.945 -2.088 -3.794 1.00 0.00 C ATOM 1250 CD1 TYR A1608 3.327 -1.900 -5.013 1.00 0.00 C ATOM 1251 CD2 TYR A1608 3.764 -1.121 -2.823 1.00 0.00 C ATOM 1252 CE1 TYR A1608 2.555 -0.785 -5.260 1.00 0.00 C ATOM 1253 CE2 TYR A1608 2.982 -0.007 -3.062 1.00 0.00 C ATOM 1254 CZ TYR A1608 2.385 0.155 -4.284 1.00 0.00 C ATOM 1255 OH TYR A1608 1.634 1.277 -4.542 1.00 0.00 O ATOM 0 H TYR A1608 3.201 -4.525 -2.073 1.00 0.00 H new ATOM 0 HA TYR A1608 3.949 -4.683 -4.878 1.00 0.00 H new ATOM 0 HB2 TYR A1608 5.169 -3.248 -2.502 1.00 0.00 H new ATOM 0 HB3 TYR A1608 5.755 -3.143 -4.150 1.00 0.00 H new ATOM 0 HD1 TYR A1608 3.450 -2.641 -5.789 1.00 0.00 H new ATOM 0 HD2 TYR A1608 4.242 -1.238 -1.861 1.00 0.00 H new ATOM 0 HE1 TYR A1608 2.085 -0.655 -6.224 1.00 0.00 H new ATOM 0 HE2 TYR A1608 2.842 0.733 -2.288 1.00 0.00 H new ATOM 0 HH TYR A1608 2.202 2.073 -4.477 1.00 0.00 H new ATOM 1265 N ASP A1609 5.336 -6.775 -4.348 1.00 0.00 N ATOM 1266 CA ASP A1609 6.269 -7.891 -4.190 1.00 0.00 C ATOM 1267 C ASP A1609 7.501 -7.697 -5.053 1.00 0.00 C ATOM 1268 O ASP A1609 7.556 -6.774 -5.879 1.00 0.00 O ATOM 1269 CB ASP A1609 5.548 -9.233 -4.507 1.00 0.00 C ATOM 1270 CG ASP A1609 6.367 -10.502 -4.293 1.00 0.00 C ATOM 1271 OD1 ASP A1609 6.433 -11.003 -3.164 1.00 0.00 O1- ATOM 1272 OD2 ASP A1609 6.956 -11.025 -5.256 1.00 0.00 O ATOM 0 H ASP A1609 4.666 -6.905 -5.106 1.00 0.00 H new ATOM 0 HA ASP A1609 6.608 -7.924 -3.155 1.00 0.00 H new ATOM 0 HB2 ASP A1609 4.652 -9.295 -3.890 1.00 0.00 H new ATOM 0 HB3 ASP A1609 5.219 -9.208 -5.546 1.00 0.00 H new ATOM 1277 N ASP A1610 8.469 -8.561 -4.823 1.00 0.00 N ATOM 1278 CA ASP A1610 9.782 -8.590 -5.493 1.00 0.00 C ATOM 1279 C ASP A1610 10.403 -7.209 -5.582 1.00 0.00 C ATOM 1280 O ASP A1610 10.516 -6.623 -6.657 1.00 0.00 O ATOM 1281 CB ASP A1610 9.726 -9.297 -6.871 1.00 0.00 C ATOM 1282 CG ASP A1610 11.090 -9.456 -7.539 1.00 0.00 C ATOM 1283 OD1 ASP A1610 11.887 -10.318 -7.108 1.00 0.00 O ATOM 1284 OD2 ASP A1610 11.366 -8.768 -8.541 1.00 0.00 O1- ATOM 0 H ASP A1610 8.370 -9.305 -4.132 1.00 0.00 H new ATOM 0 HA ASP A1610 10.439 -9.192 -4.866 1.00 0.00 H new ATOM 0 HB2 ASP A1610 9.277 -10.282 -6.745 1.00 0.00 H new ATOM 0 HB3 ASP A1610 9.072 -8.730 -7.533 1.00 0.00 H new ATOM 1289 N GLY A1611 10.642 -6.632 -4.430 1.00 0.00 N ATOM 1290 CA GLY A1611 11.284 -5.349 -4.357 1.00 0.00 C ATOM 1291 C GLY A1611 12.792 -5.469 -4.369 1.00 0.00 C ATOM 1292 O GLY A1611 13.360 -6.321 -5.057 1.00 0.00 O ATOM 0 H GLY A1611 10.398 -7.037 -3.526 1.00 0.00 H new ATOM 0 HA2 GLY A1611 10.962 -4.734 -5.198 1.00 0.00 H new ATOM 0 HA3 GLY A1611 10.968 -4.837 -3.448 1.00 0.00 H new ATOM 1296 N ALA A1612 13.428 -4.635 -3.609 1.00 0.00 N ATOM 1297 CA ALA A1612 14.864 -4.599 -3.511 1.00 0.00 C ATOM 1298 C ALA A1612 15.342 -5.649 -2.508 1.00 0.00 C ATOM 1299 O ALA A1612 14.517 -6.188 -1.739 1.00 0.00 O ATOM 1300 CB ALA A1612 15.301 -3.217 -3.067 1.00 0.00 C ATOM 0 H ALA A1612 12.959 -3.943 -3.024 1.00 0.00 H new ATOM 0 HA ALA A1612 15.302 -4.820 -4.484 1.00 0.00 H new ATOM 0 HB1 ALA A1612 16.388 -3.186 -2.992 1.00 0.00 H new ATOM 0 HB2 ALA A1612 14.966 -2.478 -3.795 1.00 0.00 H new ATOM 0 HB3 ALA A1612 14.863 -2.992 -2.094 1.00 0.00 H new ATOM 1306 N PRO A1613 16.659 -5.956 -2.474 1.00 0.00 N ATOM 1307 CA PRO A1613 17.192 -6.935 -1.558 1.00 0.00 C ATOM 1308 C PRO A1613 17.052 -6.478 -0.115 1.00 0.00 C ATOM 1309 O PRO A1613 17.444 -5.358 0.256 1.00 0.00 O ATOM 1310 CB PRO A1613 18.664 -7.096 -1.953 1.00 0.00 C ATOM 1311 CG PRO A1613 19.002 -5.888 -2.748 1.00 0.00 C ATOM 1312 CD PRO A1613 17.717 -5.353 -3.312 1.00 0.00 C ATOM 0 HA PRO A1613 16.653 -7.880 -1.619 1.00 0.00 H new ATOM 0 HB2 PRO A1613 19.300 -7.175 -1.071 1.00 0.00 H new ATOM 0 HB3 PRO A1613 18.816 -8.004 -2.537 1.00 0.00 H new ATOM 0 HG2 PRO A1613 19.489 -5.140 -2.122 1.00 0.00 H new ATOM 0 HG3 PRO A1613 19.699 -6.137 -3.548 1.00 0.00 H new ATOM 0 HD2 PRO A1613 17.687 -4.264 -3.265 1.00 0.00 H new ATOM 0 HD3 PRO A1613 17.599 -5.630 -4.359 1.00 0.00 H new ATOM 1320 N CYS A1614 16.485 -7.339 0.660 1.00 0.00 N ATOM 1321 CA CYS A1614 16.182 -7.123 2.034 1.00 0.00 C ATOM 1322 C CYS A1614 17.345 -7.537 2.915 1.00 0.00 C ATOM 1323 O CYS A1614 17.593 -8.706 3.084 1.00 0.00 O ATOM 1324 CB CYS A1614 14.937 -7.940 2.387 1.00 0.00 C ATOM 1325 SG CYS A1614 14.576 -8.077 4.161 1.00 0.00 S ATOM 0 H CYS A1614 16.205 -8.264 0.333 1.00 0.00 H new ATOM 0 HA CYS A1614 15.998 -6.062 2.204 1.00 0.00 H new ATOM 0 HB2 CYS A1614 14.076 -7.492 1.891 1.00 0.00 H new ATOM 0 HB3 CYS A1614 15.053 -8.944 1.978 1.00 0.00 H new ATOM 1401 N LEU A1620 16.229 -12.391 0.962 1.00 0.00 N ATOM 1402 CA LEU A1620 14.918 -12.158 0.422 1.00 0.00 C ATOM 1403 C LEU A1620 14.790 -10.764 -0.085 1.00 0.00 C ATOM 1404 O LEU A1620 15.678 -9.935 0.114 1.00 0.00 O ATOM 1405 CB LEU A1620 13.787 -12.456 1.401 1.00 0.00 C ATOM 1406 CG LEU A1620 13.679 -13.883 1.934 1.00 0.00 C ATOM 1407 CD1 LEU A1620 14.644 -14.149 3.078 1.00 0.00 C ATOM 1408 CD2 LEU A1620 12.266 -14.158 2.334 1.00 0.00 C ATOM 0 HA LEU A1620 14.815 -12.863 -0.403 1.00 0.00 H new ATOM 0 HB2 LEU A1620 13.893 -11.785 2.253 1.00 0.00 H new ATOM 0 HB3 LEU A1620 12.845 -12.206 0.914 1.00 0.00 H new ATOM 0 HG LEU A1620 13.965 -14.568 1.135 1.00 0.00 H new ATOM 0 HD11 LEU A1620 14.527 -15.177 3.421 1.00 0.00 H new ATOM 0 HD12 LEU A1620 15.667 -13.995 2.734 1.00 0.00 H new ATOM 0 HD13 LEU A1620 14.431 -13.466 3.900 1.00 0.00 H new ATOM 0 HD21 LEU A1620 12.187 -15.176 2.715 1.00 0.00 H new ATOM 0 HD22 LEU A1620 11.965 -13.456 3.111 1.00 0.00 H new ATOM 0 HD23 LEU A1620 11.614 -14.043 1.468 1.00 0.00 H new ATOM 1420 N LYS A1621 13.691 -10.496 -0.712 1.00 0.00 N ATOM 1421 CA LYS A1621 13.428 -9.203 -1.247 1.00 0.00 C ATOM 1422 C LYS A1621 12.379 -8.570 -0.402 1.00 0.00 C ATOM 1423 O LYS A1621 11.640 -9.269 0.297 1.00 0.00 O ATOM 1424 CB LYS A1621 12.905 -9.244 -2.692 1.00 0.00 C ATOM 1425 CG LYS A1621 13.863 -9.720 -3.790 1.00 0.00 C ATOM 1426 CD LYS A1621 13.600 -11.165 -4.239 1.00 0.00 C ATOM 1427 CE LYS A1621 14.204 -12.212 -3.321 1.00 0.00 C ATOM 1428 NZ LYS A1621 15.682 -12.147 -3.311 1.00 0.00 N1+ ATOM 0 H LYS A1621 12.946 -11.175 -0.868 1.00 0.00 H new ATOM 0 HA LYS A1621 14.366 -8.648 -1.251 1.00 0.00 H new ATOM 0 HB2 LYS A1621 12.027 -9.890 -2.711 1.00 0.00 H new ATOM 0 HB3 LYS A1621 12.568 -8.241 -2.954 1.00 0.00 H new ATOM 0 HG2 LYS A1621 13.776 -9.057 -4.651 1.00 0.00 H new ATOM 0 HG3 LYS A1621 14.888 -9.640 -3.428 1.00 0.00 H new ATOM 0 HD2 LYS A1621 12.524 -11.326 -4.300 1.00 0.00 H new ATOM 0 HD3 LYS A1621 14.000 -11.302 -5.244 1.00 0.00 H new ATOM 0 HE2 LYS A1621 13.827 -12.069 -2.308 1.00 0.00 H new ATOM 0 HE3 LYS A1621 13.886 -13.204 -3.642 1.00 0.00 H new ATOM 0 HZ1 LYS A1621 16.066 -13.037 -2.934 1.00 0.00 H new ATOM 0 HZ2 LYS A1621 16.030 -12.003 -4.280 1.00 0.00 H new ATOM 0 HZ3 LYS A1621 15.991 -11.356 -2.711 1.00 0.00 H new ATOM 1442 N TYR A1622 12.307 -7.287 -0.435 1.00 0.00 N ATOM 1443 CA TYR A1622 11.270 -6.602 0.282 1.00 0.00 C ATOM 1444 C TYR A1622 9.962 -6.640 -0.476 1.00 0.00 C ATOM 1445 O TYR A1622 9.941 -6.632 -1.712 1.00 0.00 O ATOM 1446 CB TYR A1622 11.627 -5.162 0.555 1.00 0.00 C ATOM 1447 CG TYR A1622 12.580 -4.915 1.683 1.00 0.00 C ATOM 1448 CD1 TYR A1622 12.255 -5.298 2.971 1.00 0.00 C ATOM 1449 CD2 TYR A1622 13.775 -4.264 1.475 1.00 0.00 C ATOM 1450 CE1 TYR A1622 13.093 -5.049 4.023 1.00 0.00 C ATOM 1451 CE2 TYR A1622 14.624 -4.002 2.526 1.00 0.00 C ATOM 1452 CZ TYR A1622 14.275 -4.401 3.800 1.00 0.00 C ATOM 1453 OH TYR A1622 15.110 -4.142 4.852 1.00 0.00 O ATOM 0 H TYR A1622 12.949 -6.683 -0.948 1.00 0.00 H new ATOM 0 HA TYR A1622 11.161 -7.126 1.232 1.00 0.00 H new ATOM 0 HB2 TYR A1622 12.055 -4.738 -0.353 1.00 0.00 H new ATOM 0 HB3 TYR A1622 10.707 -4.615 0.759 1.00 0.00 H new ATOM 0 HD1 TYR A1622 11.319 -5.805 3.151 1.00 0.00 H new ATOM 0 HD2 TYR A1622 14.049 -3.956 0.477 1.00 0.00 H new ATOM 0 HE1 TYR A1622 12.823 -5.362 5.021 1.00 0.00 H new ATOM 0 HE2 TYR A1622 15.558 -3.487 2.355 1.00 0.00 H new ATOM 0 HH TYR A1622 15.909 -3.677 4.528 1.00 0.00 H new ATOM 1463 N LYS A1623 8.897 -6.726 0.255 1.00 0.00 N ATOM 1464 CA LYS A1623 7.599 -6.626 -0.265 1.00 0.00 C ATOM 1465 C LYS A1623 6.789 -5.794 0.663 1.00 0.00 C ATOM 1466 O LYS A1623 6.957 -5.873 1.865 1.00 0.00 O ATOM 1467 CB LYS A1623 6.980 -7.996 -0.512 1.00 0.00 C ATOM 1468 CG LYS A1623 5.489 -8.062 -0.308 1.00 0.00 C ATOM 1469 CD LYS A1623 4.914 -9.340 -0.855 1.00 0.00 C ATOM 1470 CE LYS A1623 5.459 -10.552 -0.151 1.00 0.00 C ATOM 1471 NZ LYS A1623 5.130 -11.779 -0.884 1.00 0.00 N1+ ATOM 0 H LYS A1623 8.924 -6.873 1.264 1.00 0.00 H new ATOM 0 HA LYS A1623 7.629 -6.144 -1.242 1.00 0.00 H new ATOM 0 HB2 LYS A1623 7.207 -8.303 -1.533 1.00 0.00 H new ATOM 0 HB3 LYS A1623 7.456 -8.719 0.151 1.00 0.00 H new ATOM 0 HG2 LYS A1623 5.262 -7.986 0.755 1.00 0.00 H new ATOM 0 HG3 LYS A1623 5.016 -7.210 -0.797 1.00 0.00 H new ATOM 0 HD2 LYS A1623 3.829 -9.321 -0.755 1.00 0.00 H new ATOM 0 HD3 LYS A1623 5.135 -9.410 -1.920 1.00 0.00 H new ATOM 0 HE2 LYS A1623 6.541 -10.463 -0.051 1.00 0.00 H new ATOM 0 HE3 LYS A1623 5.049 -10.606 0.858 1.00 0.00 H new ATOM 0 HZ1 LYS A1623 5.381 -12.606 -0.306 1.00 0.00 H new ATOM 0 HZ2 LYS A1623 4.111 -11.797 -1.091 1.00 0.00 H new ATOM 0 HZ3 LYS A1623 5.665 -11.805 -1.776 1.00 0.00 H new ATOM 1485 N SER A1624 5.946 -5.010 0.122 1.00 0.00 N ATOM 1486 CA SER A1624 5.175 -4.114 0.893 1.00 0.00 C ATOM 1487 C SER A1624 3.716 -4.487 0.835 1.00 0.00 C ATOM 1488 O SER A1624 3.192 -4.841 -0.221 1.00 0.00 O ATOM 1489 CB SER A1624 5.406 -2.684 0.413 1.00 0.00 C ATOM 1490 OG SER A1624 4.667 -1.759 1.173 1.00 0.00 O ATOM 0 H SER A1624 5.766 -4.968 -0.881 1.00 0.00 H new ATOM 0 HA SER A1624 5.488 -4.177 1.935 1.00 0.00 H new ATOM 0 HB2 SER A1624 6.467 -2.444 0.478 1.00 0.00 H new ATOM 0 HB3 SER A1624 5.124 -2.602 -0.637 1.00 0.00 H new ATOM 0 HG SER A1624 5.039 -1.708 2.078 1.00 0.00 H new ATOM 1496 N VAL A1625 3.098 -4.440 1.977 1.00 0.00 N ATOM 1497 CA VAL A1625 1.695 -4.707 2.153 1.00 0.00 C ATOM 1498 C VAL A1625 1.034 -3.556 2.851 1.00 0.00 C ATOM 1499 O VAL A1625 1.057 -3.422 4.083 1.00 0.00 O ATOM 1500 CB VAL A1625 1.435 -5.994 2.922 1.00 0.00 C ATOM 1501 CG1 VAL A1625 1.442 -7.182 1.970 1.00 0.00 C ATOM 1502 CG2 VAL A1625 2.507 -6.183 3.928 1.00 0.00 C ATOM 0 H VAL A1625 3.573 -4.206 2.849 1.00 0.00 H new ATOM 0 HA VAL A1625 1.269 -4.833 1.158 1.00 0.00 H new ATOM 0 HB VAL A1625 0.463 -5.927 3.411 1.00 0.00 H new ATOM 0 HG11 VAL A1625 1.255 -8.098 2.530 1.00 0.00 H new ATOM 0 HG12 VAL A1625 0.663 -7.051 1.219 1.00 0.00 H new ATOM 0 HG13 VAL A1625 2.413 -7.249 1.479 1.00 0.00 H new ATOM 0 HG21 VAL A1625 2.327 -7.104 4.483 1.00 0.00 H new ATOM 0 HG22 VAL A1625 3.472 -6.246 3.424 1.00 0.00 H new ATOM 0 HG23 VAL A1625 2.512 -5.339 4.618 1.00 0.00 H new ATOM 1512 N ILE A1626 0.536 -2.689 2.070 1.00 0.00 N ATOM 1513 CA ILE A1626 -0.116 -1.522 2.557 1.00 0.00 C ATOM 1514 C ILE A1626 -1.566 -1.867 2.810 1.00 0.00 C ATOM 1515 O ILE A1626 -2.324 -2.163 1.874 1.00 0.00 O ATOM 1516 CB ILE A1626 -0.029 -0.388 1.524 1.00 0.00 C ATOM 1517 CG1 ILE A1626 1.414 -0.214 1.063 1.00 0.00 C ATOM 1518 CG2 ILE A1626 -0.511 0.900 2.163 1.00 0.00 C ATOM 1519 CD1 ILE A1626 1.587 0.766 -0.068 1.00 0.00 C ATOM 0 H ILE A1626 0.564 -2.760 1.053 1.00 0.00 H new ATOM 0 HA ILE A1626 0.365 -1.186 3.475 1.00 0.00 H new ATOM 0 HB ILE A1626 -0.651 -0.633 0.663 1.00 0.00 H new ATOM 0 HG12 ILE A1626 2.017 0.115 1.909 1.00 0.00 H new ATOM 0 HG13 ILE A1626 1.804 -1.183 0.752 1.00 0.00 H new ATOM 0 HG21 ILE A1626 -0.453 1.711 1.437 1.00 0.00 H new ATOM 0 HG22 ILE A1626 -1.544 0.780 2.490 1.00 0.00 H new ATOM 0 HG23 ILE A1626 0.116 1.137 3.022 1.00 0.00 H new ATOM 0 HD11 ILE A1626 2.642 0.831 -0.335 1.00 0.00 H new ATOM 0 HD12 ILE A1626 1.014 0.429 -0.932 1.00 0.00 H new ATOM 0 HD13 ILE A1626 1.231 1.748 0.244 1.00 0.00 H new ATOM 1531 N SER A1627 -1.913 -1.926 4.060 1.00 0.00 N ATOM 1532 CA SER A1627 -3.235 -2.222 4.468 1.00 0.00 C ATOM 1533 C SER A1627 -4.055 -0.935 4.612 1.00 0.00 C ATOM 1534 O SER A1627 -3.726 -0.057 5.411 1.00 0.00 O ATOM 1535 CB SER A1627 -3.221 -3.089 5.757 1.00 0.00 C ATOM 1536 OG SER A1627 -2.435 -2.550 6.811 1.00 0.00 O ATOM 0 H SER A1627 -1.266 -1.765 4.832 1.00 0.00 H new ATOM 0 HA SER A1627 -3.729 -2.816 3.699 1.00 0.00 H new ATOM 0 HB2 SER A1627 -4.245 -3.214 6.109 1.00 0.00 H new ATOM 0 HB3 SER A1627 -2.846 -4.082 5.510 1.00 0.00 H new ATOM 0 HG SER A1627 -1.974 -1.744 6.496 1.00 0.00 H new ATOM 1542 N PHE A1628 -5.105 -0.836 3.821 1.00 0.00 N ATOM 1543 CA PHE A1628 -5.947 0.330 3.763 1.00 0.00 C ATOM 1544 C PHE A1628 -7.126 0.156 4.645 1.00 0.00 C ATOM 1545 O PHE A1628 -8.039 -0.630 4.369 1.00 0.00 O ATOM 1546 CB PHE A1628 -6.370 0.646 2.343 1.00 0.00 C ATOM 1547 CG PHE A1628 -5.237 1.053 1.453 1.00 0.00 C ATOM 1548 CD1 PHE A1628 -4.448 0.113 0.834 1.00 0.00 C ATOM 1549 CD2 PHE A1628 -4.967 2.384 1.244 1.00 0.00 C ATOM 1550 CE1 PHE A1628 -3.406 0.497 0.025 1.00 0.00 C ATOM 1551 CE2 PHE A1628 -3.931 2.780 0.436 1.00 0.00 C ATOM 1552 CZ PHE A1628 -3.146 1.838 -0.174 1.00 0.00 C ATOM 0 H PHE A1628 -5.398 -1.582 3.190 1.00 0.00 H new ATOM 0 HA PHE A1628 -5.368 1.181 4.121 1.00 0.00 H new ATOM 0 HB2 PHE A1628 -6.859 -0.229 1.916 1.00 0.00 H new ATOM 0 HB3 PHE A1628 -7.110 1.446 2.363 1.00 0.00 H new ATOM 0 HD1 PHE A1628 -4.649 -0.937 0.985 1.00 0.00 H new ATOM 0 HD2 PHE A1628 -5.581 3.132 1.724 1.00 0.00 H new ATOM 0 HE1 PHE A1628 -2.791 -0.250 -0.455 1.00 0.00 H new ATOM 0 HE2 PHE A1628 -3.735 3.831 0.282 1.00 0.00 H new ATOM 0 HZ PHE A1628 -2.327 2.143 -0.808 1.00 0.00 H new ATOM 1562 N VAL A1629 -7.065 0.875 5.693 1.00 0.00 N ATOM 1563 CA VAL A1629 -7.991 0.873 6.760 1.00 0.00 C ATOM 1564 C VAL A1629 -8.885 2.092 6.665 1.00 0.00 C ATOM 1565 O VAL A1629 -8.411 3.210 6.569 1.00 0.00 O ATOM 1566 CB VAL A1629 -7.195 0.891 8.079 1.00 0.00 C ATOM 1567 CG1 VAL A1629 -8.081 1.218 9.264 1.00 0.00 C ATOM 1568 CG2 VAL A1629 -6.488 -0.446 8.272 1.00 0.00 C ATOM 0 H VAL A1629 -6.304 1.537 5.843 1.00 0.00 H new ATOM 0 HA VAL A1629 -8.622 -0.015 6.719 1.00 0.00 H new ATOM 0 HB VAL A1629 -6.446 1.681 8.017 1.00 0.00 H new ATOM 0 HG11 VAL A1629 -7.483 1.221 10.175 1.00 0.00 H new ATOM 0 HG12 VAL A1629 -8.531 2.201 9.122 1.00 0.00 H new ATOM 0 HG13 VAL A1629 -8.867 0.468 9.348 1.00 0.00 H new ATOM 0 HG21 VAL A1629 -5.926 -0.429 9.206 1.00 0.00 H new ATOM 0 HG22 VAL A1629 -7.227 -1.247 8.307 1.00 0.00 H new ATOM 0 HG23 VAL A1629 -5.805 -0.620 7.441 1.00 0.00 H new ATOM 1578 N CYS A1630 -10.143 1.834 6.632 1.00 0.00 N ATOM 1579 CA CYS A1630 -11.203 2.823 6.557 1.00 0.00 C ATOM 1580 C CYS A1630 -11.070 3.959 7.605 1.00 0.00 C ATOM 1581 O CYS A1630 -10.963 3.715 8.816 1.00 0.00 O ATOM 1582 CB CYS A1630 -12.548 2.096 6.707 1.00 0.00 C ATOM 1583 SG CYS A1630 -14.000 3.157 6.968 1.00 0.00 S ATOM 0 H CYS A1630 -10.499 0.879 6.657 1.00 0.00 H new ATOM 0 HA CYS A1630 -11.133 3.319 5.589 1.00 0.00 H new ATOM 0 HB2 CYS A1630 -12.717 1.497 5.812 1.00 0.00 H new ATOM 0 HB3 CYS A1630 -12.473 1.403 7.545 1.00 0.00 H new ATOM 1588 N THR A1631 -11.079 5.196 7.118 1.00 0.00 N ATOM 1589 CA THR A1631 -11.055 6.374 7.975 1.00 0.00 C ATOM 1590 C THR A1631 -12.176 7.344 7.524 1.00 0.00 C ATOM 1591 O THR A1631 -12.488 7.425 6.339 1.00 0.00 O ATOM 1592 CB THR A1631 -9.648 7.083 8.007 1.00 0.00 C ATOM 1593 OG1 THR A1631 -9.574 8.030 9.089 1.00 0.00 O ATOM 1594 CG2 THR A1631 -9.351 7.813 6.727 1.00 0.00 C ATOM 0 H THR A1631 -11.103 5.409 6.121 1.00 0.00 H new ATOM 0 HA THR A1631 -11.238 6.055 9.001 1.00 0.00 H new ATOM 0 HB THR A1631 -8.912 6.291 8.145 1.00 0.00 H new ATOM 0 HG1 THR A1631 -9.523 8.939 8.726 1.00 0.00 H new ATOM 0 HG21 THR A1631 -8.371 8.285 6.797 1.00 0.00 H new ATOM 0 HG22 THR A1631 -9.355 7.107 5.896 1.00 0.00 H new ATOM 0 HG23 THR A1631 -10.111 8.576 6.559 1.00 0.00 H new ATOM 1602 N HIS A1632 -12.804 8.020 8.470 1.00 0.00 N ATOM 1603 CA HIS A1632 -13.954 8.940 8.219 1.00 0.00 C ATOM 1604 C HIS A1632 -13.639 10.179 7.363 1.00 0.00 C ATOM 1605 O HIS A1632 -14.519 11.018 7.148 1.00 0.00 O ATOM 1606 CB HIS A1632 -14.651 9.364 9.519 1.00 0.00 C ATOM 1607 CG HIS A1632 -15.477 8.286 10.154 1.00 0.00 C ATOM 1608 ND1 HIS A1632 -15.204 7.746 11.386 1.00 0.00 N ATOM 1609 CD2 HIS A1632 -16.606 7.676 9.727 1.00 0.00 C ATOM 1610 CE1 HIS A1632 -16.119 6.854 11.686 1.00 0.00 C ATOM 1611 NE2 HIS A1632 -16.978 6.796 10.701 1.00 0.00 N ATOM 0 H HIS A1632 -12.544 7.961 9.454 1.00 0.00 H new ATOM 0 HA HIS A1632 -14.633 8.332 7.621 1.00 0.00 H new ATOM 0 HB2 HIS A1632 -13.896 9.695 10.232 1.00 0.00 H new ATOM 0 HB3 HIS A1632 -15.291 10.222 9.312 1.00 0.00 H new ATOM 0 HD2 HIS A1632 -17.117 7.852 8.792 1.00 0.00 H new ATOM 0 HE1 HIS A1632 -16.156 6.268 12.592 1.00 0.00 H new ATOM 0 HE2 HIS A1632 -17.797 6.189 10.667 1.00 0.00 H new ATOM 1620 N ASP A1633 -12.417 10.288 6.892 1.00 0.00 N ATOM 1621 CA ASP A1633 -11.945 11.452 6.104 1.00 0.00 C ATOM 1622 C ASP A1633 -12.507 11.438 4.661 1.00 0.00 C ATOM 1623 O ASP A1633 -13.474 10.725 4.365 1.00 0.00 O ATOM 1624 CB ASP A1633 -10.407 11.449 6.071 1.00 0.00 C ATOM 1625 CG ASP A1633 -9.789 11.677 7.425 1.00 0.00 C ATOM 1626 OD1 ASP A1633 -9.646 12.847 7.834 1.00 0.00 O ATOM 1627 OD2 ASP A1633 -9.426 10.686 8.109 1.00 0.00 O1- ATOM 0 H ASP A1633 -11.701 9.576 7.035 1.00 0.00 H new ATOM 0 HA ASP A1633 -12.308 12.360 6.585 1.00 0.00 H new ATOM 0 HB2 ASP A1633 -10.059 10.495 5.675 1.00 0.00 H new ATOM 0 HB3 ASP A1633 -10.062 12.223 5.385 1.00 0.00 H new ATOM 1632 N SER A1634 -11.914 12.226 3.769 1.00 0.00 N ATOM 1633 CA SER A1634 -12.311 12.231 2.372 1.00 0.00 C ATOM 1634 C SER A1634 -11.089 12.003 1.463 1.00 0.00 C ATOM 1635 O SER A1634 -10.244 12.897 1.321 1.00 0.00 O ATOM 1636 CB SER A1634 -13.015 13.552 2.012 1.00 0.00 C ATOM 1637 OG SER A1634 -13.499 13.556 0.664 1.00 0.00 O ATOM 0 H SER A1634 -11.155 12.870 3.993 1.00 0.00 H new ATOM 0 HA SER A1634 -13.015 11.415 2.213 1.00 0.00 H new ATOM 0 HB2 SER A1634 -13.848 13.716 2.696 1.00 0.00 H new ATOM 0 HB3 SER A1634 -12.321 14.381 2.150 1.00 0.00 H new ATOM 0 HG SER A1634 -13.940 14.411 0.477 1.00 0.00 H new ATOM 1643 N GLY A1635 -11.000 10.774 0.894 1.00 0.00 N ATOM 1644 CA GLY A1635 -9.935 10.365 -0.035 1.00 0.00 C ATOM 1645 C GLY A1635 -8.558 10.830 0.377 1.00 0.00 C ATOM 1646 O GLY A1635 -7.878 11.524 -0.364 1.00 0.00 O ATOM 0 H GLY A1635 -11.679 10.035 1.075 1.00 0.00 H new ATOM 0 HA2 GLY A1635 -9.933 9.278 -0.115 1.00 0.00 H new ATOM 0 HA3 GLY A1635 -10.160 10.757 -1.027 1.00 0.00 H new ATOM 1650 N ALA A1636 -8.160 10.436 1.539 1.00 0.00 N ATOM 1651 CA ALA A1636 -6.936 10.906 2.143 1.00 0.00 C ATOM 1652 C ALA A1636 -5.983 9.761 2.474 1.00 0.00 C ATOM 1653 O ALA A1636 -6.300 8.570 2.238 1.00 0.00 O ATOM 1654 CB ALA A1636 -7.292 11.664 3.405 1.00 0.00 C ATOM 0 H ALA A1636 -8.675 9.769 2.113 1.00 0.00 H new ATOM 0 HA ALA A1636 -6.421 11.553 1.433 1.00 0.00 H new ATOM 0 HB1 ALA A1636 -6.381 12.029 3.879 1.00 0.00 H new ATOM 0 HB2 ALA A1636 -7.934 12.508 3.153 1.00 0.00 H new ATOM 0 HB3 ALA A1636 -7.818 11.001 4.092 1.00 0.00 H new ATOM 1660 N ASN A1637 -4.824 10.113 3.021 1.00 0.00 N ATOM 1661 CA ASN A1637 -3.858 9.141 3.466 1.00 0.00 C ATOM 1662 C ASN A1637 -3.938 9.100 4.957 1.00 0.00 C ATOM 1663 O ASN A1637 -3.556 8.106 5.592 1.00 0.00 O ATOM 1664 CB ASN A1637 -2.394 9.500 3.040 1.00 0.00 C ATOM 1665 CG ASN A1637 -1.763 10.702 3.759 1.00 0.00 C ATOM 1666 OD1 ASN A1637 -2.436 11.659 4.115 1.00 0.00 O ATOM 1667 ND2 ASN A1637 -0.465 10.654 3.971 1.00 0.00 N ATOM 0 H ASN A1637 -4.537 11.081 3.164 1.00 0.00 H new ATOM 0 HA ASN A1637 -4.089 8.179 3.008 1.00 0.00 H new ATOM 0 HB2 ASN A1637 -1.763 8.628 3.209 1.00 0.00 H new ATOM 0 HB3 ASN A1637 -2.386 9.697 1.968 1.00 0.00 H new ATOM 0 HD21 ASN A1637 0.004 11.427 4.443 1.00 0.00 H new ATOM 0 HD22 ASN A1637 0.072 9.843 3.664 1.00 0.00 H new ATOM 1674 N ASN A1638 -4.468 10.222 5.505 1.00 0.00 N ATOM 1675 CA ASN A1638 -4.602 10.493 6.922 1.00 0.00 C ATOM 1676 C ASN A1638 -3.219 10.600 7.522 1.00 0.00 C ATOM 1677 O ASN A1638 -2.686 11.693 7.739 1.00 0.00 O ATOM 1678 CB ASN A1638 -5.447 9.415 7.618 1.00 0.00 C ATOM 1679 CG ASN A1638 -5.777 9.733 9.057 1.00 0.00 C ATOM 1680 OD1 ASN A1638 -5.004 9.421 9.964 1.00 0.00 O ATOM 1681 ND2 ASN A1638 -6.922 10.276 9.300 1.00 0.00 N ATOM 0 H ASN A1638 -4.824 10.984 4.928 1.00 0.00 H new ATOM 0 HA ASN A1638 -5.129 11.435 7.069 1.00 0.00 H new ATOM 0 HB2 ASN A1638 -6.376 9.280 7.063 1.00 0.00 H new ATOM 0 HB3 ASN A1638 -4.912 8.466 7.579 1.00 0.00 H new ATOM 0 HD21 ASN A1638 -7.207 10.457 10.263 1.00 0.00 H new ATOM 0 HD22 ASN A1638 -7.542 10.524 8.529 1.00 0.00 H new ATOM 1688 N LYS A1639 -2.649 9.472 7.693 1.00 0.00 N ATOM 1689 CA LYS A1639 -1.316 9.273 8.195 1.00 0.00 C ATOM 1690 C LYS A1639 -1.002 7.767 8.076 1.00 0.00 C ATOM 1691 O LYS A1639 -1.598 6.958 8.797 1.00 0.00 O ATOM 1692 CB LYS A1639 -1.193 9.766 9.660 1.00 0.00 C ATOM 1693 CG LYS A1639 0.215 10.242 10.072 1.00 0.00 C ATOM 1694 CD LYS A1639 1.249 9.124 10.163 1.00 0.00 C ATOM 1695 CE LYS A1639 0.964 8.170 11.317 1.00 0.00 C ATOM 1696 NZ LYS A1639 1.034 8.831 12.644 1.00 0.00 N1+ ATOM 0 H LYS A1639 -3.119 8.593 7.476 1.00 0.00 H new ATOM 0 HA LYS A1639 -0.597 9.853 7.616 1.00 0.00 H new ATOM 0 HB2 LYS A1639 -1.896 10.585 9.812 1.00 0.00 H new ATOM 0 HB3 LYS A1639 -1.496 8.958 10.326 1.00 0.00 H new ATOM 0 HG2 LYS A1639 0.561 10.984 9.353 1.00 0.00 H new ATOM 0 HG3 LYS A1639 0.150 10.741 11.039 1.00 0.00 H new ATOM 0 HD2 LYS A1639 1.262 8.566 9.227 1.00 0.00 H new ATOM 0 HD3 LYS A1639 2.241 9.558 10.289 1.00 0.00 H new ATOM 0 HE2 LYS A1639 -0.027 7.735 11.186 1.00 0.00 H new ATOM 0 HE3 LYS A1639 1.680 7.348 11.288 1.00 0.00 H new ATOM 0 HZ1 LYS A1639 1.052 8.108 13.391 1.00 0.00 H new ATOM 0 HZ2 LYS A1639 1.897 9.408 12.699 1.00 0.00 H new ATOM 0 HZ3 LYS A1639 0.201 9.441 12.772 1.00 0.00 H new ATOM 1710 N PRO A1640 -0.153 7.365 7.127 1.00 0.00 N ATOM 1711 CA PRO A1640 0.275 5.969 6.990 1.00 0.00 C ATOM 1712 C PRO A1640 1.286 5.611 8.074 1.00 0.00 C ATOM 1713 O PRO A1640 2.209 6.384 8.352 1.00 0.00 O ATOM 1714 CB PRO A1640 0.949 5.915 5.611 1.00 0.00 C ATOM 1715 CG PRO A1640 0.707 7.251 4.981 1.00 0.00 C ATOM 1716 CD PRO A1640 0.437 8.214 6.098 1.00 0.00 C ATOM 0 HA PRO A1640 -0.556 5.270 7.086 1.00 0.00 H new ATOM 0 HB2 PRO A1640 2.016 5.716 5.706 1.00 0.00 H new ATOM 0 HB3 PRO A1640 0.528 5.115 5.002 1.00 0.00 H new ATOM 0 HG2 PRO A1640 1.573 7.567 4.399 1.00 0.00 H new ATOM 0 HG3 PRO A1640 -0.139 7.207 4.295 1.00 0.00 H new ATOM 0 HD2 PRO A1640 1.351 8.695 6.446 1.00 0.00 H new ATOM 0 HD3 PRO A1640 -0.243 9.008 5.791 1.00 0.00 H new ATOM 1724 N VAL A1641 1.113 4.477 8.690 1.00 0.00 N ATOM 1725 CA VAL A1641 1.984 4.064 9.761 1.00 0.00 C ATOM 1726 C VAL A1641 2.647 2.752 9.375 1.00 0.00 C ATOM 1727 O VAL A1641 2.140 2.018 8.533 1.00 0.00 O ATOM 1728 CB VAL A1641 1.201 3.809 11.092 1.00 0.00 C ATOM 1729 CG1 VAL A1641 2.087 3.969 12.317 1.00 0.00 C ATOM 1730 CG2 VAL A1641 -0.092 4.621 11.197 1.00 0.00 C ATOM 0 H VAL A1641 0.370 3.814 8.469 1.00 0.00 H new ATOM 0 HA VAL A1641 2.707 4.864 9.920 1.00 0.00 H new ATOM 0 HB VAL A1641 0.890 2.765 11.061 1.00 0.00 H new ATOM 0 HG11 VAL A1641 1.501 3.783 13.217 1.00 0.00 H new ATOM 0 HG12 VAL A1641 2.910 3.256 12.266 1.00 0.00 H new ATOM 0 HG13 VAL A1641 2.486 4.983 12.347 1.00 0.00 H new ATOM 0 HG21 VAL A1641 -0.586 4.398 12.143 1.00 0.00 H new ATOM 0 HG22 VAL A1641 0.142 5.685 11.152 1.00 0.00 H new ATOM 0 HG23 VAL A1641 -0.754 4.360 10.371 1.00 0.00 H new ATOM 1740 N PHE A1642 3.774 2.488 9.943 1.00 0.00 N ATOM 1741 CA PHE A1642 4.407 1.239 9.816 1.00 0.00 C ATOM 1742 C PHE A1642 4.019 0.424 11.007 1.00 0.00 C ATOM 1743 O PHE A1642 4.447 0.704 12.136 1.00 0.00 O ATOM 1744 CB PHE A1642 5.913 1.429 9.731 1.00 0.00 C ATOM 1745 CG PHE A1642 6.679 0.170 9.626 1.00 0.00 C ATOM 1746 CD1 PHE A1642 6.761 -0.493 8.426 1.00 0.00 C ATOM 1747 CD2 PHE A1642 7.313 -0.355 10.728 1.00 0.00 C ATOM 1748 CE1 PHE A1642 7.462 -1.656 8.320 1.00 0.00 C ATOM 1749 CE2 PHE A1642 8.014 -1.517 10.633 1.00 0.00 C ATOM 1750 CZ PHE A1642 8.092 -2.172 9.424 1.00 0.00 C ATOM 0 H PHE A1642 4.285 3.156 10.520 1.00 0.00 H new ATOM 0 HA PHE A1642 4.099 0.726 8.905 1.00 0.00 H new ATOM 0 HB2 PHE A1642 6.141 2.052 8.866 1.00 0.00 H new ATOM 0 HB3 PHE A1642 6.249 1.973 10.614 1.00 0.00 H new ATOM 0 HD1 PHE A1642 6.264 -0.088 7.557 1.00 0.00 H new ATOM 0 HD2 PHE A1642 7.254 0.159 11.676 1.00 0.00 H new ATOM 0 HE1 PHE A1642 7.522 -2.169 7.372 1.00 0.00 H new ATOM 0 HE2 PHE A1642 8.508 -1.925 11.503 1.00 0.00 H new ATOM 0 HZ PHE A1642 8.650 -3.093 9.345 1.00 0.00 H new ATOM 1760 N VAL A1643 3.174 -0.532 10.778 1.00 0.00 N ATOM 1761 CA VAL A1643 2.694 -1.356 11.828 1.00 0.00 C ATOM 1762 C VAL A1643 3.732 -2.396 12.233 1.00 0.00 C ATOM 1763 O VAL A1643 4.094 -2.470 13.407 1.00 0.00 O ATOM 1764 CB VAL A1643 1.279 -1.977 11.518 1.00 0.00 C ATOM 1765 CG1 VAL A1643 1.179 -2.518 10.110 1.00 0.00 C ATOM 1766 CG2 VAL A1643 0.964 -3.076 12.496 1.00 0.00 C ATOM 0 H VAL A1643 2.801 -0.758 9.856 1.00 0.00 H new ATOM 0 HA VAL A1643 2.537 -0.715 12.696 1.00 0.00 H new ATOM 0 HB VAL A1643 0.555 -1.169 11.617 1.00 0.00 H new ATOM 0 HG11 VAL A1643 0.184 -2.934 9.950 1.00 0.00 H new ATOM 0 HG12 VAL A1643 1.355 -1.712 9.397 1.00 0.00 H new ATOM 0 HG13 VAL A1643 1.926 -3.299 9.966 1.00 0.00 H new ATOM 0 HG21 VAL A1643 -0.016 -3.495 12.269 1.00 0.00 H new ATOM 0 HG22 VAL A1643 1.719 -3.858 12.420 1.00 0.00 H new ATOM 0 HG23 VAL A1643 0.960 -2.672 13.508 1.00 0.00 H new ATOM 1776 N SER A1644 4.231 -3.162 11.283 1.00 0.00 N ATOM 1777 CA SER A1644 5.193 -4.201 11.615 1.00 0.00 C ATOM 1778 C SER A1644 5.947 -4.674 10.375 1.00 0.00 C ATOM 1779 O SER A1644 5.462 -4.520 9.244 1.00 0.00 O ATOM 1780 CB SER A1644 4.458 -5.385 12.290 1.00 0.00 C ATOM 1781 OG SER A1644 5.348 -6.431 12.659 1.00 0.00 O ATOM 0 H SER A1644 3.994 -3.090 10.293 1.00 0.00 H new ATOM 0 HA SER A1644 5.928 -3.789 12.307 1.00 0.00 H new ATOM 0 HB2 SER A1644 3.934 -5.027 13.176 1.00 0.00 H new ATOM 0 HB3 SER A1644 3.702 -5.777 11.609 1.00 0.00 H new ATOM 0 HG SER A1644 4.843 -7.156 13.082 1.00 0.00 H new ATOM 1787 N LEU A1645 7.153 -5.183 10.581 1.00 0.00 N ATOM 1788 CA LEU A1645 7.909 -5.785 9.522 1.00 0.00 C ATOM 1789 C LEU A1645 7.842 -7.269 9.712 1.00 0.00 C ATOM 1790 O LEU A1645 7.970 -7.781 10.833 1.00 0.00 O ATOM 1791 CB LEU A1645 9.388 -5.282 9.504 1.00 0.00 C ATOM 1792 CG LEU A1645 10.304 -5.676 8.289 1.00 0.00 C ATOM 1793 CD1 LEU A1645 10.882 -7.089 8.368 1.00 0.00 C ATOM 1794 CD2 LEU A1645 9.581 -5.485 6.977 1.00 0.00 C ATOM 0 H LEU A1645 7.623 -5.185 11.487 1.00 0.00 H new ATOM 0 HA LEU A1645 7.486 -5.504 8.558 1.00 0.00 H new ATOM 0 HB2 LEU A1645 9.368 -4.194 9.564 1.00 0.00 H new ATOM 0 HB3 LEU A1645 9.871 -5.642 10.412 1.00 0.00 H new ATOM 0 HG LEU A1645 11.154 -4.996 8.344 1.00 0.00 H new ATOM 0 HD11 LEU A1645 11.501 -7.278 7.491 1.00 0.00 H new ATOM 0 HD12 LEU A1645 11.489 -7.184 9.268 1.00 0.00 H new ATOM 0 HD13 LEU A1645 10.068 -7.814 8.401 1.00 0.00 H new ATOM 0 HD21 LEU A1645 10.239 -5.765 6.155 1.00 0.00 H new ATOM 0 HD22 LEU A1645 8.690 -6.112 6.958 1.00 0.00 H new ATOM 0 HD23 LEU A1645 9.292 -4.440 6.870 1.00 0.00 H new ATOM 1806 N ASP A1646 7.645 -7.940 8.642 1.00 0.00 N ATOM 1807 CA ASP A1646 7.556 -9.365 8.639 1.00 0.00 C ATOM 1808 C ASP A1646 8.894 -9.887 8.342 1.00 0.00 C ATOM 1809 O ASP A1646 9.379 -9.800 7.225 1.00 0.00 O ATOM 1810 CB ASP A1646 6.560 -9.888 7.625 1.00 0.00 C ATOM 1811 CG ASP A1646 6.589 -11.378 7.498 1.00 0.00 C ATOM 1812 OD1 ASP A1646 5.951 -12.090 8.316 1.00 0.00 O1- ATOM 1813 OD2 ASP A1646 7.247 -11.854 6.587 1.00 0.00 O ATOM 0 H ASP A1646 7.538 -7.515 7.721 1.00 0.00 H new ATOM 0 HA ASP A1646 7.201 -9.698 9.614 1.00 0.00 H new ATOM 0 HB2 ASP A1646 5.557 -9.572 7.912 1.00 0.00 H new ATOM 0 HB3 ASP A1646 6.769 -9.441 6.653 1.00 0.00 H new ATOM 1818 N LYS A1647 9.485 -10.400 9.332 1.00 0.00 N ATOM 1819 CA LYS A1647 10.847 -10.866 9.303 1.00 0.00 C ATOM 1820 C LYS A1647 10.898 -12.293 8.818 1.00 0.00 C ATOM 1821 O LYS A1647 11.913 -12.967 8.906 1.00 0.00 O ATOM 1822 CB LYS A1647 11.427 -10.693 10.694 1.00 0.00 C ATOM 1823 CG LYS A1647 11.059 -9.326 11.235 1.00 0.00 C ATOM 1824 CD LYS A1647 11.552 -9.063 12.635 1.00 0.00 C ATOM 1825 CE LYS A1647 11.089 -7.682 13.105 1.00 0.00 C ATOM 1826 NZ LYS A1647 11.576 -7.345 14.454 1.00 0.00 N1+ ATOM 0 H LYS A1647 9.035 -10.524 10.239 1.00 0.00 H new ATOM 0 HA LYS A1647 11.450 -10.287 8.603 1.00 0.00 H new ATOM 0 HB2 LYS A1647 11.047 -11.471 11.356 1.00 0.00 H new ATOM 0 HB3 LYS A1647 12.511 -10.802 10.663 1.00 0.00 H new ATOM 0 HG2 LYS A1647 11.464 -8.563 10.570 1.00 0.00 H new ATOM 0 HG3 LYS A1647 9.974 -9.221 11.218 1.00 0.00 H new ATOM 0 HD2 LYS A1647 11.176 -9.831 13.311 1.00 0.00 H new ATOM 0 HD3 LYS A1647 12.640 -9.119 12.662 1.00 0.00 H new ATOM 0 HE2 LYS A1647 11.437 -6.928 12.399 1.00 0.00 H new ATOM 0 HE3 LYS A1647 10.000 -7.647 13.098 1.00 0.00 H new ATOM 0 HZ1 LYS A1647 11.233 -6.400 14.721 1.00 0.00 H new ATOM 0 HZ2 LYS A1647 11.224 -8.047 15.136 1.00 0.00 H new ATOM 0 HZ3 LYS A1647 12.616 -7.350 14.459 1.00 0.00 H new ATOM 1840 N GLN A1648 9.788 -12.742 8.321 1.00 0.00 N ATOM 1841 CA GLN A1648 9.671 -14.036 7.769 1.00 0.00 C ATOM 1842 C GLN A1648 10.030 -13.951 6.305 1.00 0.00 C ATOM 1843 O GLN A1648 10.818 -14.745 5.800 1.00 0.00 O ATOM 1844 CB GLN A1648 8.242 -14.507 7.933 1.00 0.00 C ATOM 1845 CG GLN A1648 7.899 -15.824 7.280 1.00 0.00 C ATOM 1846 CD GLN A1648 6.415 -16.114 7.352 1.00 0.00 C ATOM 1847 OE1 GLN A1648 5.605 -15.081 7.354 1.00 0.00 O flip ATOM 1848 NE2 GLN A1648 5.995 -17.265 7.409 1.00 0.00 N flip ATOM 0 H GLN A1648 8.925 -12.200 8.292 1.00 0.00 H new ATOM 0 HA GLN A1648 10.335 -14.741 8.270 1.00 0.00 H new ATOM 0 HB2 GLN A1648 8.027 -14.586 8.999 1.00 0.00 H new ATOM 0 HB3 GLN A1648 7.580 -13.741 7.530 1.00 0.00 H new ATOM 0 HG2 GLN A1648 8.216 -15.807 6.237 1.00 0.00 H new ATOM 0 HG3 GLN A1648 8.451 -16.627 7.768 1.00 0.00 H new ATOM 0 HE21 GLN A1648 6.649 -18.047 7.406 1.00 0.00 H new ATOM 0 HE22 GLN A1648 4.991 -17.440 7.460 1.00 0.00 H new ATOM 1857 N THR A1649 9.478 -12.972 5.632 1.00 0.00 N ATOM 1858 CA THR A1649 9.687 -12.848 4.222 1.00 0.00 C ATOM 1859 C THR A1649 9.897 -11.392 3.765 1.00 0.00 C ATOM 1860 O THR A1649 9.785 -11.081 2.577 1.00 0.00 O ATOM 1861 CB THR A1649 8.589 -13.634 3.415 1.00 0.00 C ATOM 1862 OG1 THR A1649 8.683 -13.428 1.990 1.00 0.00 O ATOM 1863 CG2 THR A1649 7.206 -13.297 3.916 1.00 0.00 C ATOM 0 H THR A1649 8.882 -12.253 6.043 1.00 0.00 H new ATOM 0 HA THR A1649 10.636 -13.329 3.986 1.00 0.00 H new ATOM 0 HB THR A1649 8.777 -14.693 3.590 1.00 0.00 H new ATOM 0 HG1 THR A1649 9.134 -12.577 1.812 1.00 0.00 H new ATOM 0 HG21 THR A1649 6.465 -13.853 3.342 1.00 0.00 H new ATOM 0 HG22 THR A1649 7.125 -13.566 4.969 1.00 0.00 H new ATOM 0 HG23 THR A1649 7.027 -12.228 3.799 1.00 0.00 H new ATOM 1871 N CYS A1650 10.260 -10.532 4.719 1.00 0.00 N ATOM 1872 CA CYS A1650 10.536 -9.115 4.486 1.00 0.00 C ATOM 1873 C CYS A1650 9.313 -8.373 3.968 1.00 0.00 C ATOM 1874 O CYS A1650 9.360 -7.671 2.954 1.00 0.00 O ATOM 1875 CB CYS A1650 11.741 -8.942 3.573 1.00 0.00 C ATOM 1876 SG CYS A1650 13.284 -9.630 4.256 1.00 0.00 S ATOM 0 H CYS A1650 10.372 -10.808 5.695 1.00 0.00 H new ATOM 0 HA CYS A1650 10.783 -8.663 5.447 1.00 0.00 H new ATOM 0 HB2 CYS A1650 11.532 -9.421 2.616 1.00 0.00 H new ATOM 0 HB3 CYS A1650 11.885 -7.880 3.373 1.00 0.00 H new ATOM 1881 N THR A1651 8.233 -8.504 4.691 1.00 0.00 N ATOM 1882 CA THR A1651 6.992 -7.913 4.287 1.00 0.00 C ATOM 1883 C THR A1651 6.703 -6.641 5.128 1.00 0.00 C ATOM 1884 O THR A1651 6.521 -6.715 6.342 1.00 0.00 O ATOM 1885 CB THR A1651 5.864 -8.927 4.474 1.00 0.00 C ATOM 1886 OG1 THR A1651 6.362 -10.263 4.198 1.00 0.00 O ATOM 1887 CG2 THR A1651 4.770 -8.622 3.483 1.00 0.00 C ATOM 0 H THR A1651 8.191 -9.020 5.570 1.00 0.00 H new ATOM 0 HA THR A1651 7.056 -7.628 3.237 1.00 0.00 H new ATOM 0 HB THR A1651 5.490 -8.870 5.496 1.00 0.00 H new ATOM 0 HG1 THR A1651 6.742 -10.646 5.016 1.00 0.00 H new ATOM 0 HG21 THR A1651 3.958 -9.339 3.605 1.00 0.00 H new ATOM 0 HG22 THR A1651 4.393 -7.614 3.656 1.00 0.00 H new ATOM 0 HG23 THR A1651 5.167 -8.693 2.470 1.00 0.00 H new ATOM 1895 N LEU A1652 6.755 -5.502 4.474 1.00 0.00 N ATOM 1896 CA LEU A1652 6.514 -4.180 5.064 1.00 0.00 C ATOM 1897 C LEU A1652 5.029 -3.960 5.258 1.00 0.00 C ATOM 1898 O LEU A1652 4.331 -3.628 4.298 1.00 0.00 O ATOM 1899 CB LEU A1652 7.013 -3.053 4.112 1.00 0.00 C ATOM 1900 CG LEU A1652 8.518 -2.806 3.926 1.00 0.00 C ATOM 1901 CD1 LEU A1652 9.135 -2.214 5.162 1.00 0.00 C ATOM 1902 CD2 LEU A1652 9.254 -4.054 3.502 1.00 0.00 C ATOM 0 H LEU A1652 6.974 -5.456 3.479 1.00 0.00 H new ATOM 0 HA LEU A1652 7.047 -4.146 6.014 1.00 0.00 H new ATOM 0 HB2 LEU A1652 6.595 -3.255 3.126 1.00 0.00 H new ATOM 0 HB3 LEU A1652 6.573 -2.118 4.460 1.00 0.00 H new ATOM 0 HG LEU A1652 8.617 -2.082 3.118 1.00 0.00 H new ATOM 0 HD11 LEU A1652 10.200 -2.052 4.995 1.00 0.00 H new ATOM 0 HD12 LEU A1652 8.655 -1.262 5.388 1.00 0.00 H new ATOM 0 HD13 LEU A1652 8.999 -2.898 6.000 1.00 0.00 H new ATOM 0 HD21 LEU A1652 10.314 -3.829 3.383 1.00 0.00 H new ATOM 0 HD22 LEU A1652 9.130 -4.826 4.262 1.00 0.00 H new ATOM 0 HD23 LEU A1652 8.851 -4.410 2.554 1.00 0.00 H new ATOM 1914 N TYR A1653 4.540 -4.162 6.449 1.00 0.00 N ATOM 1915 CA TYR A1653 3.147 -3.930 6.726 1.00 0.00 C ATOM 1916 C TYR A1653 2.917 -2.483 7.044 1.00 0.00 C ATOM 1917 O TYR A1653 3.467 -1.945 8.022 1.00 0.00 O ATOM 1918 CB TYR A1653 2.623 -4.835 7.854 1.00 0.00 C ATOM 1919 CG TYR A1653 2.445 -6.271 7.433 1.00 0.00 C ATOM 1920 CD1 TYR A1653 3.502 -7.163 7.471 1.00 0.00 C ATOM 1921 CD2 TYR A1653 1.215 -6.731 6.964 1.00 0.00 C ATOM 1922 CE1 TYR A1653 3.346 -8.464 7.058 1.00 0.00 C ATOM 1923 CE2 TYR A1653 1.056 -8.035 6.545 1.00 0.00 C ATOM 1924 CZ TYR A1653 2.127 -8.895 6.593 1.00 0.00 C ATOM 1925 OH TYR A1653 1.987 -10.197 6.161 1.00 0.00 O ATOM 0 H TYR A1653 5.086 -4.488 7.247 1.00 0.00 H new ATOM 0 HA TYR A1653 2.583 -4.187 5.829 1.00 0.00 H new ATOM 0 HB2 TYR A1653 3.315 -4.793 8.695 1.00 0.00 H new ATOM 0 HB3 TYR A1653 1.668 -4.446 8.208 1.00 0.00 H new ATOM 0 HD1 TYR A1653 4.465 -6.831 7.831 1.00 0.00 H new ATOM 0 HD2 TYR A1653 0.373 -6.055 6.928 1.00 0.00 H new ATOM 0 HE1 TYR A1653 4.181 -9.148 7.099 1.00 0.00 H new ATOM 0 HE2 TYR A1653 0.098 -8.378 6.182 1.00 0.00 H new ATOM 0 HH TYR A1653 1.065 -10.346 5.864 1.00 0.00 H new ATOM 1935 N PHE A1654 2.147 -1.842 6.221 1.00 0.00 N ATOM 1936 CA PHE A1654 1.822 -0.449 6.435 1.00 0.00 C ATOM 1937 C PHE A1654 0.375 -0.319 6.750 1.00 0.00 C ATOM 1938 O PHE A1654 -0.445 -0.988 6.142 1.00 0.00 O ATOM 1939 CB PHE A1654 2.150 0.411 5.215 1.00 0.00 C ATOM 1940 CG PHE A1654 3.604 0.501 4.909 1.00 0.00 C ATOM 1941 CD1 PHE A1654 4.473 1.073 5.812 1.00 0.00 C ATOM 1942 CD2 PHE A1654 4.102 0.032 3.717 1.00 0.00 C ATOM 1943 CE1 PHE A1654 5.814 1.172 5.532 1.00 0.00 C ATOM 1944 CE2 PHE A1654 5.445 0.129 3.435 1.00 0.00 C ATOM 1945 CZ PHE A1654 6.299 0.697 4.342 1.00 0.00 C ATOM 0 H PHE A1654 1.726 -2.255 5.389 1.00 0.00 H new ATOM 0 HA PHE A1654 2.428 -0.094 7.268 1.00 0.00 H new ATOM 0 HB2 PHE A1654 1.631 0.004 4.347 1.00 0.00 H new ATOM 0 HB3 PHE A1654 1.761 1.416 5.377 1.00 0.00 H new ATOM 0 HD1 PHE A1654 4.095 1.448 6.752 1.00 0.00 H new ATOM 0 HD2 PHE A1654 3.434 -0.416 2.996 1.00 0.00 H new ATOM 0 HE1 PHE A1654 6.485 1.623 6.248 1.00 0.00 H new ATOM 0 HE2 PHE A1654 5.827 -0.244 2.496 1.00 0.00 H new ATOM 0 HZ PHE A1654 7.353 0.770 4.120 1.00 0.00 H new ATOM 1955 N SER A1655 0.054 0.529 7.660 1.00 0.00 N ATOM 1956 CA SER A1655 -1.290 0.758 8.019 1.00 0.00 C ATOM 1957 C SER A1655 -1.675 2.120 7.494 1.00 0.00 C ATOM 1958 O SER A1655 -1.093 3.140 7.854 1.00 0.00 O ATOM 1959 CB SER A1655 -1.435 0.650 9.546 1.00 0.00 C ATOM 1960 OG SER A1655 -0.366 1.307 10.208 1.00 0.00 O ATOM 0 H SER A1655 0.730 1.088 8.180 1.00 0.00 H new ATOM 0 HA SER A1655 -1.960 0.015 7.586 1.00 0.00 H new ATOM 0 HB2 SER A1655 -2.383 1.089 9.856 1.00 0.00 H new ATOM 0 HB3 SER A1655 -1.458 -0.400 9.839 1.00 0.00 H new ATOM 0 HG SER A1655 -0.531 1.309 11.174 1.00 0.00 H new ATOM 1966 N TRP A1656 -2.623 2.135 6.636 1.00 0.00 N ATOM 1967 CA TRP A1656 -3.010 3.317 5.977 1.00 0.00 C ATOM 1968 C TRP A1656 -4.430 3.583 6.336 1.00 0.00 C ATOM 1969 O TRP A1656 -5.253 2.704 6.267 1.00 0.00 O ATOM 1970 CB TRP A1656 -2.884 3.087 4.473 1.00 0.00 C ATOM 1971 CG TRP A1656 -3.072 4.296 3.620 1.00 0.00 C ATOM 1972 CD1 TRP A1656 -4.213 5.011 3.437 1.00 0.00 C ATOM 1973 CD2 TRP A1656 -2.089 4.892 2.790 1.00 0.00 C ATOM 1974 NE1 TRP A1656 -3.999 6.036 2.569 1.00 0.00 N ATOM 1975 CE2 TRP A1656 -2.694 5.979 2.143 1.00 0.00 C ATOM 1976 CE3 TRP A1656 -0.747 4.614 2.535 1.00 0.00 C ATOM 1977 CZ2 TRP A1656 -2.003 6.784 1.255 1.00 0.00 C ATOM 1978 CZ3 TRP A1656 -0.065 5.414 1.657 1.00 0.00 C ATOM 1979 CH2 TRP A1656 -0.695 6.486 1.026 1.00 0.00 C ATOM 0 H TRP A1656 -3.160 1.310 6.369 1.00 0.00 H new ATOM 0 HA TRP A1656 -2.388 4.164 6.265 1.00 0.00 H new ATOM 0 HB2 TRP A1656 -1.898 2.669 4.268 1.00 0.00 H new ATOM 0 HB3 TRP A1656 -3.616 2.336 4.175 1.00 0.00 H new ATOM 0 HD1 TRP A1656 -5.158 4.795 3.914 1.00 0.00 H new ATOM 0 HE1 TRP A1656 -4.690 6.729 2.283 1.00 0.00 H new ATOM 0 HE3 TRP A1656 -0.255 3.784 3.020 1.00 0.00 H new ATOM 0 HZ2 TRP A1656 -2.483 7.617 0.763 1.00 0.00 H new ATOM 0 HZ3 TRP A1656 0.976 5.212 1.450 1.00 0.00 H new ATOM 0 HH2 TRP A1656 -0.130 7.096 0.337 1.00 0.00 H new ATOM 1990 N HIS A1657 -4.706 4.764 6.746 1.00 0.00 N ATOM 1991 CA HIS A1657 -6.042 5.140 7.074 1.00 0.00 C ATOM 1992 C HIS A1657 -6.615 5.861 5.879 1.00 0.00 C ATOM 1993 O HIS A1657 -6.289 7.012 5.633 1.00 0.00 O ATOM 1994 CB HIS A1657 -6.073 6.042 8.320 1.00 0.00 C ATOM 1995 CG HIS A1657 -5.587 5.386 9.582 1.00 0.00 C ATOM 1996 ND1 HIS A1657 -6.413 5.061 10.632 1.00 0.00 N ATOM 1997 CD2 HIS A1657 -4.343 4.997 9.959 1.00 0.00 C ATOM 1998 CE1 HIS A1657 -5.703 4.502 11.589 1.00 0.00 C ATOM 1999 NE2 HIS A1657 -4.451 4.453 11.201 1.00 0.00 N ATOM 0 H HIS A1657 -4.015 5.504 6.866 1.00 0.00 H new ATOM 0 HA HIS A1657 -6.635 4.256 7.308 1.00 0.00 H new ATOM 0 HB2 HIS A1657 -5.464 6.925 8.128 1.00 0.00 H new ATOM 0 HB3 HIS A1657 -7.095 6.388 8.476 1.00 0.00 H new ATOM 0 HD2 HIS A1657 -3.437 5.100 9.381 1.00 0.00 H new ATOM 0 HE1 HIS A1657 -6.086 4.144 12.533 1.00 0.00 H new ATOM 0 HE2 HIS A1657 -3.679 4.067 11.745 1.00 0.00 H new ATOM 2008 N THR A1658 -7.418 5.192 5.110 1.00 0.00 N ATOM 2009 CA THR A1658 -7.940 5.800 3.944 1.00 0.00 C ATOM 2010 C THR A1658 -9.483 5.747 3.920 1.00 0.00 C ATOM 2011 O THR A1658 -10.108 4.739 4.251 1.00 0.00 O ATOM 2012 CB THR A1658 -7.318 5.260 2.623 1.00 0.00 C ATOM 2013 OG1 THR A1658 -7.644 6.138 1.557 1.00 0.00 O ATOM 2014 CG2 THR A1658 -7.838 3.899 2.307 1.00 0.00 C ATOM 0 H THR A1658 -7.720 4.232 5.274 1.00 0.00 H new ATOM 0 HA THR A1658 -7.642 6.847 3.996 1.00 0.00 H new ATOM 0 HB THR A1658 -6.237 5.202 2.750 1.00 0.00 H new ATOM 0 HG1 THR A1658 -7.221 7.009 1.710 1.00 0.00 H new ATOM 0 HG21 THR A1658 -7.388 3.544 1.380 1.00 0.00 H new ATOM 0 HG22 THR A1658 -7.585 3.216 3.118 1.00 0.00 H new ATOM 0 HG23 THR A1658 -8.921 3.941 2.192 1.00 0.00 H new ATOM 2022 N PRO A1659 -10.099 6.865 3.572 1.00 0.00 N ATOM 2023 CA PRO A1659 -11.569 7.030 3.499 1.00 0.00 C ATOM 2024 C PRO A1659 -12.192 6.249 2.377 1.00 0.00 C ATOM 2025 O PRO A1659 -13.385 5.993 2.362 1.00 0.00 O ATOM 2026 CB PRO A1659 -11.704 8.507 3.189 1.00 0.00 C ATOM 2027 CG PRO A1659 -10.438 9.087 3.642 1.00 0.00 C ATOM 2028 CD PRO A1659 -9.427 8.107 3.267 1.00 0.00 C ATOM 0 HA PRO A1659 -12.061 6.684 4.408 1.00 0.00 H new ATOM 0 HB2 PRO A1659 -11.862 8.677 2.124 1.00 0.00 H new ATOM 0 HB3 PRO A1659 -12.553 8.947 3.711 1.00 0.00 H new ATOM 0 HG2 PRO A1659 -10.251 10.050 3.167 1.00 0.00 H new ATOM 0 HG3 PRO A1659 -10.444 9.258 4.718 1.00 0.00 H new ATOM 0 HD2 PRO A1659 -9.157 8.179 2.213 1.00 0.00 H new ATOM 0 HD3 PRO A1659 -8.508 8.227 3.840 1.00 0.00 H new ATOM 2036 N LEU A1660 -11.390 5.898 1.436 1.00 0.00 N ATOM 2037 CA LEU A1660 -11.836 5.181 0.293 1.00 0.00 C ATOM 2038 C LEU A1660 -12.007 3.702 0.601 1.00 0.00 C ATOM 2039 O LEU A1660 -12.697 2.985 -0.094 1.00 0.00 O ATOM 2040 CB LEU A1660 -10.897 5.475 -0.840 1.00 0.00 C ATOM 2041 CG LEU A1660 -9.467 5.247 -0.606 1.00 0.00 C ATOM 2042 CD1 LEU A1660 -9.196 3.814 -0.766 1.00 0.00 C ATOM 2043 CD2 LEU A1660 -8.615 6.088 -1.532 1.00 0.00 C ATOM 0 H LEU A1660 -10.391 6.103 1.437 1.00 0.00 H new ATOM 0 HA LEU A1660 -12.831 5.508 -0.010 1.00 0.00 H new ATOM 0 HB2 LEU A1660 -11.200 4.870 -1.694 1.00 0.00 H new ATOM 0 HB3 LEU A1660 -11.030 6.518 -1.126 1.00 0.00 H new ATOM 0 HG LEU A1660 -9.206 5.553 0.407 1.00 0.00 H new ATOM 0 HD11 LEU A1660 -8.136 3.623 -0.596 1.00 0.00 H new ATOM 0 HD12 LEU A1660 -9.787 3.249 -0.045 1.00 0.00 H new ATOM 0 HD13 LEU A1660 -9.463 3.504 -1.776 1.00 0.00 H new ATOM 0 HD21 LEU A1660 -7.561 5.895 -1.332 1.00 0.00 H new ATOM 0 HD22 LEU A1660 -8.841 5.832 -2.567 1.00 0.00 H new ATOM 0 HD23 LEU A1660 -8.829 7.144 -1.364 1.00 0.00 H new ATOM 2055 N ALA A1661 -11.388 3.287 1.696 1.00 0.00 N ATOM 2056 CA ALA A1661 -11.472 1.922 2.199 1.00 0.00 C ATOM 2057 C ALA A1661 -12.754 1.801 2.981 1.00 0.00 C ATOM 2058 O ALA A1661 -13.113 0.742 3.483 1.00 0.00 O ATOM 2059 CB ALA A1661 -10.283 1.628 3.116 1.00 0.00 C ATOM 0 H ALA A1661 -10.805 3.897 2.269 1.00 0.00 H new ATOM 0 HA ALA A1661 -11.455 1.212 1.372 1.00 0.00 H new ATOM 0 HB1 ALA A1661 -10.354 0.606 3.487 1.00 0.00 H new ATOM 0 HB2 ALA A1661 -9.355 1.748 2.558 1.00 0.00 H new ATOM 0 HB3 ALA A1661 -10.292 2.321 3.957 1.00 0.00 H new ATOM 2065 N CYS A1662 -13.423 2.908 3.081 1.00 0.00 N ATOM 2066 CA CYS A1662 -14.696 2.985 3.723 1.00 0.00 C ATOM 2067 C CYS A1662 -15.761 2.758 2.717 1.00 0.00 C ATOM 2068 O CYS A1662 -15.898 3.510 1.756 1.00 0.00 O ATOM 2069 CB CYS A1662 -14.906 4.333 4.368 1.00 0.00 C ATOM 2070 SG CYS A1662 -13.740 4.693 5.683 1.00 0.00 S ATOM 0 H CYS A1662 -13.092 3.799 2.711 1.00 0.00 H new ATOM 0 HA CYS A1662 -14.734 2.223 4.501 1.00 0.00 H new ATOM 0 HB2 CYS A1662 -14.829 5.107 3.604 1.00 0.00 H new ATOM 0 HB3 CYS A1662 -15.918 4.380 4.769 1.00 0.00 H new