USER MOD reduce.3.24.130724 H: found=0, std=0, add=926, rem=0, adj=33 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: A1623 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A1649 THR OG1 : rot -23:sc= 1.02 USER MOD Set 2.1: A1589 ASN : amide:sc= -0.987 K(o=0.56,f=-6.3!) USER MOD Set 2.2: A1592 SER OG : rot 101:sc= 1.55 USER MOD Set 3.1: A1550 ASN : amide:sc= 0.198 X(o=1.1,f=0.71) USER MOD Set 3.2: A1554 TYR OH : rot 21:sc= 0.888 USER MOD Set 4.1: A1536 ASN : amide:sc= 0.68 K(o=-0.54,f=-11!) USER MOD Set 4.2: A1539 THR OG1 : rot 180:sc= -0.706 USER MOD Set 4.3: A1541 HIS : no HD1:sc= -0.512 K(o=-0.54,f=-1.3) USER MOD Set 5.1: A1531 ASN : amide:sc= 0 X(o=1.8,f=1.7) USER MOD Set 5.2: A1546 ASN : amide:sc= 1.54 K(o=1.8,f=-6.4!) USER MOD Set 5.3: A1549 LYS NZ :NH3+ -159:sc= 0.237 (180deg=0) USER MOD Single : A1533 GLN : amide:sc= -1.57! K(o=-1.6!,f=-0.04) USER MOD Single : A1535 THR OG1 : rot 180:sc= -0.487 USER MOD Single : A1547 SER OG : rot 180:sc= 0 USER MOD Single : A1552 SER OG : rot 180:sc= 0.0699 USER MOD Single : A1555 SER OG : rot 180:sc= 0 USER MOD Single : A1558 TYR OH : rot 180:sc= 0 USER MOD Single : A1559 SER OG : rot 180:sc= 0.124 USER MOD Single : A1561 LYS NZ :NH3+ 167:sc= -0.0199 (180deg=-0.201) USER MOD Single : A1565 TYR OH : rot 180:sc= 0 USER MOD Single : A1572 THR OG1 : rot 58:sc= -0.741! USER MOD Single : A1573 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1574 ASN : amide:sc= 0 K(o=0,f=-0.83) USER MOD Single : A1577 SER OG : rot 180:sc= 0 USER MOD Single : A1586 THR OG1 : rot 160:sc= -0.859 USER MOD Single : A1587 LYS NZ :NH3+ 171:sc=-0.00642 (180deg=-0.118) USER MOD Single : A1594 ASN : amide:sc= 0.211 K(o=0.21,f=-0.87) USER MOD Single : A1595 SER OG : rot 180:sc= 0 USER MOD Single : A1596 GLN : amide:sc= -0.0497 X(o=-0.05,f=-0.014) USER MOD Single : A1598 MET CE :methyl -146:sc= -0.268 (180deg=-2.05) USER MOD Single : A1599 TYR OH : rot 180:sc= -0.109 USER MOD Single : A1602 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1605 GLN : amide:sc= -1.87! K(o=-1.9!,f=-0.23) USER MOD Single : A1608 TYR OH : rot -99:sc= -0.799! USER MOD Single : A1621 LYS NZ :NH3+ -158:sc= 1.22 (180deg=1.16) USER MOD Single : A1622 TYR OH : rot 180:sc= 0 USER MOD Single : A1624 SER OG : rot 55:sc= 1.18 USER MOD Single : A1627 SER OG : rot 180:sc= 0 USER MOD Single : A1631 THR OG1 : rot -116:sc= 1.27 USER MOD Single : A1632 HIS : no HD1:sc= 0 X(o=0,f=-0.019) USER MOD Single : A1634 SER OG : rot 180:sc= 0 USER MOD Single : A1637 ASN : amide:sc= -1.87 K(o=-1.9,f=-0.56) USER MOD Single : A1638 ASN : amide:sc= 0.187 X(o=0.19,f=-0.12) USER MOD Single : A1639 LYS NZ :NH3+ -167:sc= -0.0292 (180deg=-0.202) 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 : amide:sc= 0 K(o=0,f=-0.61) USER MOD Single : A1651 THR OG1 : rot -28:sc= -2.9! USER MOD Single : A1653 TYR OH : rot 180:sc= 0 USER MOD Single : A1655 SER OG : rot -8:sc= -1.51! USER MOD Single : A1657 HIS : no HD1:sc= -0.102 X(o=-0.1,f=0.0091) USER MOD Single : A1658 THR OG1 : rot 64:sc= -0.104 USER MOD ----------------------------------------------------------------- ATOM 115 N ASN A1531 -6.131 -2.433 -11.129 1.00 0.00 N ATOM 116 CA ASN A1531 -5.383 -1.208 -11.294 1.00 0.00 C ATOM 117 C ASN A1531 -5.682 -0.300 -10.129 1.00 0.00 C ATOM 118 O ASN A1531 -6.540 0.585 -10.224 1.00 0.00 O ATOM 119 CB ASN A1531 -5.717 -0.500 -12.625 1.00 0.00 C ATOM 120 CG ASN A1531 -4.807 0.691 -12.902 1.00 0.00 C ATOM 121 OD1 ASN A1531 -5.112 1.816 -12.537 1.00 0.00 O ATOM 122 ND2 ASN A1531 -3.711 0.455 -13.578 1.00 0.00 N ATOM 0 HA ASN A1531 -4.321 -1.451 -11.323 1.00 0.00 H new ATOM 0 HB2 ASN A1531 -5.632 -1.215 -13.443 1.00 0.00 H new ATOM 0 HB3 ASN A1531 -6.753 -0.163 -12.602 1.00 0.00 H new ATOM 0 HD21 ASN A1531 -3.083 1.223 -13.815 1.00 0.00 H new ATOM 0 HD22 ASN A1531 -3.486 -0.497 -13.868 1.00 0.00 H new ATOM 129 N CYS A1532 -5.062 -0.626 -8.980 1.00 0.00 N ATOM 130 CA CYS A1532 -5.188 0.132 -7.720 1.00 0.00 C ATOM 131 C CYS A1532 -6.642 0.414 -7.338 1.00 0.00 C ATOM 132 O CYS A1532 -6.982 1.436 -6.744 1.00 0.00 O ATOM 133 CB CYS A1532 -4.249 1.372 -7.687 1.00 0.00 C ATOM 134 SG CYS A1532 -4.150 2.349 -9.218 1.00 0.00 S ATOM 0 H CYS A1532 -4.449 -1.437 -8.899 1.00 0.00 H new ATOM 0 HA CYS A1532 -4.828 -0.512 -6.918 1.00 0.00 H new ATOM 0 HB2 CYS A1532 -4.579 2.029 -6.882 1.00 0.00 H new ATOM 0 HB3 CYS A1532 -3.245 1.034 -7.431 1.00 0.00 H new ATOM 139 N GLN A1533 -7.467 -0.571 -7.629 1.00 0.00 N ATOM 140 CA GLN A1533 -8.865 -0.570 -7.358 1.00 0.00 C ATOM 141 C GLN A1533 -9.271 -2.014 -7.142 1.00 0.00 C ATOM 142 O GLN A1533 -8.700 -2.910 -7.774 1.00 0.00 O ATOM 143 CB GLN A1533 -9.633 0.061 -8.518 1.00 0.00 C ATOM 144 CG GLN A1533 -9.540 -0.686 -9.836 1.00 0.00 C ATOM 145 CD GLN A1533 -10.212 0.049 -10.952 1.00 0.00 C ATOM 146 OE1 GLN A1533 -10.747 -0.555 -11.878 1.00 0.00 O ATOM 147 NE2 GLN A1533 -10.149 1.341 -10.913 1.00 0.00 N ATOM 0 H GLN A1533 -7.152 -1.429 -8.082 1.00 0.00 H new ATOM 0 HA GLN A1533 -9.096 0.023 -6.473 1.00 0.00 H new ATOM 0 HB2 GLN A1533 -10.683 0.141 -8.237 1.00 0.00 H new ATOM 0 HB3 GLN A1533 -9.265 1.076 -8.667 1.00 0.00 H new ATOM 0 HG2 GLN A1533 -8.492 -0.845 -10.088 1.00 0.00 H new ATOM 0 HG3 GLN A1533 -9.995 -1.671 -9.726 1.00 0.00 H new ATOM 0 HE21 GLN A1533 -9.696 1.806 -10.126 1.00 0.00 H new ATOM 0 HE22 GLN A1533 -10.552 1.894 -11.669 1.00 0.00 H new ATOM 156 N VAL A1534 -10.187 -2.247 -6.238 1.00 0.00 N ATOM 157 CA VAL A1534 -10.595 -3.593 -5.902 1.00 0.00 C ATOM 158 C VAL A1534 -12.088 -3.604 -5.745 1.00 0.00 C ATOM 159 O VAL A1534 -12.656 -2.612 -5.424 1.00 0.00 O ATOM 160 CB VAL A1534 -9.894 -4.080 -4.588 1.00 0.00 C ATOM 161 CG1 VAL A1534 -10.239 -3.223 -3.386 1.00 0.00 C ATOM 162 CG2 VAL A1534 -10.179 -5.521 -4.276 1.00 0.00 C ATOM 0 H VAL A1534 -10.670 -1.517 -5.715 1.00 0.00 H new ATOM 0 HA VAL A1534 -10.299 -4.278 -6.697 1.00 0.00 H new ATOM 0 HB VAL A1534 -8.827 -3.977 -4.788 1.00 0.00 H new ATOM 0 HG11 VAL A1534 -9.725 -3.608 -2.505 1.00 0.00 H new ATOM 0 HG12 VAL A1534 -9.925 -2.196 -3.570 1.00 0.00 H new ATOM 0 HG13 VAL A1534 -11.316 -3.249 -3.218 1.00 0.00 H new ATOM 0 HG21 VAL A1534 -9.667 -5.802 -3.355 1.00 0.00 H new ATOM 0 HG22 VAL A1534 -11.253 -5.661 -4.152 1.00 0.00 H new ATOM 0 HG23 VAL A1534 -9.824 -6.148 -5.094 1.00 0.00 H new ATOM 172 N THR A1535 -12.706 -4.673 -6.017 1.00 0.00 N ATOM 173 CA THR A1535 -14.126 -4.757 -5.877 1.00 0.00 C ATOM 174 C THR A1535 -14.457 -5.788 -4.800 1.00 0.00 C ATOM 175 O THR A1535 -13.884 -6.874 -4.784 1.00 0.00 O ATOM 176 CB THR A1535 -14.743 -5.148 -7.224 1.00 0.00 C ATOM 177 OG1 THR A1535 -14.243 -4.258 -8.234 1.00 0.00 O ATOM 178 CG2 THR A1535 -16.240 -5.030 -7.181 1.00 0.00 C ATOM 0 H THR A1535 -12.258 -5.528 -6.346 1.00 0.00 H new ATOM 0 HA THR A1535 -14.539 -3.794 -5.577 1.00 0.00 H new ATOM 0 HB THR A1535 -14.477 -6.182 -7.446 1.00 0.00 H new ATOM 0 HG1 THR A1535 -14.629 -4.498 -9.102 1.00 0.00 H new ATOM 0 HG21 THR A1535 -16.655 -5.313 -8.148 1.00 0.00 H new ATOM 0 HG22 THR A1535 -16.635 -5.691 -6.409 1.00 0.00 H new ATOM 0 HG23 THR A1535 -16.517 -4.001 -6.954 1.00 0.00 H new ATOM 186 N ASN A1536 -15.286 -5.397 -3.849 1.00 0.00 N ATOM 187 CA ASN A1536 -15.723 -6.297 -2.777 1.00 0.00 C ATOM 188 C ASN A1536 -16.518 -7.438 -3.381 1.00 0.00 C ATOM 189 O ASN A1536 -17.533 -7.195 -4.024 1.00 0.00 O ATOM 190 CB ASN A1536 -16.671 -5.584 -1.806 1.00 0.00 C ATOM 191 CG ASN A1536 -16.971 -6.406 -0.531 1.00 0.00 C ATOM 192 OD1 ASN A1536 -16.851 -7.619 -0.498 1.00 0.00 O ATOM 193 ND2 ASN A1536 -17.448 -5.772 0.465 1.00 0.00 N ATOM 0 H ASN A1536 -15.677 -4.457 -3.790 1.00 0.00 H new ATOM 0 HA ASN A1536 -14.831 -6.641 -2.253 1.00 0.00 H new ATOM 0 HB2 ASN A1536 -16.234 -4.627 -1.519 1.00 0.00 H new ATOM 0 HB3 ASN A1536 -17.608 -5.366 -2.318 1.00 0.00 H new ATOM 0 HD21 ASN A1536 -17.735 -6.279 1.302 1.00 0.00 H new ATOM 0 HD22 ASN A1536 -17.543 -4.757 0.425 1.00 0.00 H new ATOM 200 N PRO A1537 -16.111 -8.685 -3.165 1.00 0.00 N ATOM 201 CA PRO A1537 -16.849 -9.846 -3.654 1.00 0.00 C ATOM 202 C PRO A1537 -18.265 -9.969 -3.053 1.00 0.00 C ATOM 203 O PRO A1537 -19.094 -10.695 -3.582 1.00 0.00 O ATOM 204 CB PRO A1537 -15.997 -11.040 -3.211 1.00 0.00 C ATOM 205 CG PRO A1537 -15.100 -10.514 -2.145 1.00 0.00 C ATOM 206 CD PRO A1537 -14.873 -9.073 -2.463 1.00 0.00 C ATOM 0 HA PRO A1537 -17.002 -9.778 -4.731 1.00 0.00 H new ATOM 0 HB2 PRO A1537 -16.622 -11.850 -2.834 1.00 0.00 H new ATOM 0 HB3 PRO A1537 -15.422 -11.443 -4.045 1.00 0.00 H new ATOM 0 HG2 PRO A1537 -15.556 -10.628 -1.162 1.00 0.00 H new ATOM 0 HG3 PRO A1537 -14.157 -11.061 -2.125 1.00 0.00 H new ATOM 0 HD2 PRO A1537 -14.719 -8.481 -1.561 1.00 0.00 H new ATOM 0 HD3 PRO A1537 -13.993 -8.933 -3.091 1.00 0.00 H new ATOM 214 N ALA A1538 -18.558 -9.235 -1.980 1.00 0.00 N ATOM 215 CA ALA A1538 -19.840 -9.384 -1.322 1.00 0.00 C ATOM 216 C ALA A1538 -20.834 -8.338 -1.783 1.00 0.00 C ATOM 217 O ALA A1538 -22.045 -8.554 -1.737 1.00 0.00 O ATOM 218 CB ALA A1538 -19.667 -9.304 0.184 1.00 0.00 C ATOM 0 H ALA A1538 -17.934 -8.546 -1.560 1.00 0.00 H new ATOM 0 HA ALA A1538 -20.236 -10.363 -1.592 1.00 0.00 H new ATOM 0 HB1 ALA A1538 -20.637 -9.417 0.668 1.00 0.00 H new ATOM 0 HB2 ALA A1538 -19.000 -10.100 0.516 1.00 0.00 H new ATOM 0 HB3 ALA A1538 -19.239 -8.337 0.450 1.00 0.00 H new ATOM 224 N THR A1539 -20.336 -7.201 -2.210 1.00 0.00 N ATOM 225 CA THR A1539 -21.218 -6.105 -2.571 1.00 0.00 C ATOM 226 C THR A1539 -21.033 -5.657 -3.994 1.00 0.00 C ATOM 227 O THR A1539 -21.909 -5.010 -4.595 1.00 0.00 O ATOM 228 CB THR A1539 -20.985 -4.926 -1.629 1.00 0.00 C ATOM 229 OG1 THR A1539 -19.605 -4.523 -1.720 1.00 0.00 O ATOM 230 CG2 THR A1539 -21.277 -5.343 -0.208 1.00 0.00 C ATOM 0 H THR A1539 -19.340 -7.007 -2.317 1.00 0.00 H new ATOM 0 HA THR A1539 -22.241 -6.470 -2.477 1.00 0.00 H new ATOM 0 HB THR A1539 -21.641 -4.102 -1.909 1.00 0.00 H new ATOM 0 HG1 THR A1539 -19.445 -3.765 -1.120 1.00 0.00 H new ATOM 0 HG21 THR A1539 -21.109 -4.499 0.461 1.00 0.00 H new ATOM 0 HG22 THR A1539 -22.315 -5.667 -0.130 1.00 0.00 H new ATOM 0 HG23 THR A1539 -20.618 -6.165 0.073 1.00 0.00 H new ATOM 238 N GLY A1540 -19.900 -5.985 -4.533 1.00 0.00 N ATOM 239 CA GLY A1540 -19.567 -5.560 -5.840 1.00 0.00 C ATOM 240 C GLY A1540 -19.149 -4.119 -5.828 1.00 0.00 C ATOM 241 O GLY A1540 -19.044 -3.488 -6.874 1.00 0.00 O ATOM 0 H GLY A1540 -19.188 -6.553 -4.074 1.00 0.00 H new ATOM 0 HA2 GLY A1540 -18.760 -6.177 -6.236 1.00 0.00 H new ATOM 0 HA3 GLY A1540 -20.423 -5.692 -6.502 1.00 0.00 H new ATOM 245 N HIS A1541 -18.947 -3.570 -4.635 1.00 0.00 N ATOM 246 CA HIS A1541 -18.508 -2.213 -4.536 1.00 0.00 C ATOM 247 C HIS A1541 -17.017 -2.091 -4.761 1.00 0.00 C ATOM 248 O HIS A1541 -16.216 -2.744 -4.086 1.00 0.00 O ATOM 249 CB HIS A1541 -18.950 -1.556 -3.236 1.00 0.00 C ATOM 250 CG HIS A1541 -20.432 -1.341 -3.157 1.00 0.00 C ATOM 251 ND1 HIS A1541 -21.194 -1.645 -2.053 1.00 0.00 N ATOM 252 CD2 HIS A1541 -21.291 -0.821 -4.060 1.00 0.00 C ATOM 253 CE1 HIS A1541 -22.437 -1.329 -2.283 1.00 0.00 C ATOM 254 NE2 HIS A1541 -22.527 -0.824 -3.489 1.00 0.00 N ATOM 0 H HIS A1541 -19.082 -4.048 -3.744 1.00 0.00 H new ATOM 0 HA HIS A1541 -18.998 -1.662 -5.339 1.00 0.00 H new ATOM 0 HB2 HIS A1541 -18.634 -2.176 -2.397 1.00 0.00 H new ATOM 0 HB3 HIS A1541 -18.444 -0.596 -3.131 1.00 0.00 H new ATOM 0 HD2 HIS A1541 -21.044 -0.468 -5.050 1.00 0.00 H new ATOM 0 HE1 HIS A1541 -23.258 -1.461 -1.594 1.00 0.00 H new ATOM 0 HE2 HIS A1541 -23.384 -0.488 -3.928 1.00 0.00 H new ATOM 263 N LEU A1542 -16.678 -1.317 -5.754 1.00 0.00 N ATOM 264 CA LEU A1542 -15.336 -1.014 -6.130 1.00 0.00 C ATOM 265 C LEU A1542 -14.731 -0.009 -5.141 1.00 0.00 C ATOM 266 O LEU A1542 -15.398 0.919 -4.663 1.00 0.00 O ATOM 267 CB LEU A1542 -15.356 -0.484 -7.604 1.00 0.00 C ATOM 268 CG LEU A1542 -14.032 -0.118 -8.343 1.00 0.00 C ATOM 269 CD1 LEU A1542 -13.400 1.170 -7.848 1.00 0.00 C ATOM 270 CD2 LEU A1542 -13.032 -1.258 -8.316 1.00 0.00 C ATOM 0 H LEU A1542 -17.369 -0.860 -6.349 1.00 0.00 H new ATOM 0 HA LEU A1542 -14.702 -1.900 -6.093 1.00 0.00 H new ATOM 0 HB2 LEU A1542 -15.861 -1.238 -8.208 1.00 0.00 H new ATOM 0 HB3 LEU A1542 -15.985 0.406 -7.615 1.00 0.00 H new ATOM 0 HG LEU A1542 -14.320 0.056 -9.380 1.00 0.00 H new ATOM 0 HD11 LEU A1542 -12.483 1.363 -8.405 1.00 0.00 H new ATOM 0 HD12 LEU A1542 -14.095 1.996 -7.995 1.00 0.00 H new ATOM 0 HD13 LEU A1542 -13.167 1.077 -6.787 1.00 0.00 H new ATOM 0 HD21 LEU A1542 -12.125 -0.959 -8.842 1.00 0.00 H new ATOM 0 HD22 LEU A1542 -12.788 -1.503 -7.282 1.00 0.00 H new ATOM 0 HD23 LEU A1542 -13.463 -2.132 -8.804 1.00 0.00 H new ATOM 282 N PHE A1543 -13.504 -0.251 -4.829 1.00 0.00 N ATOM 283 CA PHE A1543 -12.681 0.551 -3.987 1.00 0.00 C ATOM 284 C PHE A1543 -11.582 1.044 -4.843 1.00 0.00 C ATOM 285 O PHE A1543 -11.095 0.296 -5.672 1.00 0.00 O ATOM 286 CB PHE A1543 -12.081 -0.265 -2.871 1.00 0.00 C ATOM 287 CG PHE A1543 -13.042 -0.851 -1.899 1.00 0.00 C ATOM 288 CD1 PHE A1543 -13.400 -0.144 -0.782 1.00 0.00 C ATOM 289 CD2 PHE A1543 -13.557 -2.119 -2.086 1.00 0.00 C ATOM 290 CE1 PHE A1543 -14.258 -0.678 0.137 1.00 0.00 C ATOM 291 CE2 PHE A1543 -14.418 -2.664 -1.167 1.00 0.00 C ATOM 292 CZ PHE A1543 -14.772 -1.943 -0.051 1.00 0.00 C ATOM 0 H PHE A1543 -13.014 -1.073 -5.181 1.00 0.00 H new ATOM 0 HA PHE A1543 -13.268 1.353 -3.540 1.00 0.00 H new ATOM 0 HB2 PHE A1543 -11.502 -1.076 -3.312 1.00 0.00 H new ATOM 0 HB3 PHE A1543 -11.381 0.366 -2.323 1.00 0.00 H new ATOM 0 HD1 PHE A1543 -12.999 0.847 -0.626 1.00 0.00 H new ATOM 0 HD2 PHE A1543 -13.280 -2.686 -2.962 1.00 0.00 H new ATOM 0 HE1 PHE A1543 -14.534 -0.108 1.012 1.00 0.00 H new ATOM 0 HE2 PHE A1543 -14.816 -3.656 -1.320 1.00 0.00 H new ATOM 0 HZ PHE A1543 -15.450 -2.366 0.675 1.00 0.00 H new ATOM 302 N ASP A1544 -11.177 2.248 -4.666 1.00 0.00 N ATOM 303 CA ASP A1544 -10.230 2.829 -5.569 1.00 0.00 C ATOM 304 C ASP A1544 -9.213 3.648 -4.839 1.00 0.00 C ATOM 305 O ASP A1544 -9.565 4.439 -3.965 1.00 0.00 O ATOM 306 CB ASP A1544 -10.981 3.701 -6.544 1.00 0.00 C ATOM 307 CG ASP A1544 -10.092 4.346 -7.552 1.00 0.00 C ATOM 308 OD1 ASP A1544 -9.836 3.739 -8.586 1.00 0.00 O1- ATOM 309 OD2 ASP A1544 -9.632 5.482 -7.320 1.00 0.00 O ATOM 0 H ASP A1544 -11.481 2.857 -3.907 1.00 0.00 H new ATOM 0 HA ASP A1544 -9.700 2.033 -6.091 1.00 0.00 H new ATOM 0 HB2 ASP A1544 -11.729 3.099 -7.060 1.00 0.00 H new ATOM 0 HB3 ASP A1544 -11.518 4.474 -5.993 1.00 0.00 H new ATOM 314 N LEU A1545 -7.964 3.477 -5.194 1.00 0.00 N ATOM 315 CA LEU A1545 -6.881 4.214 -4.597 1.00 0.00 C ATOM 316 C LEU A1545 -6.224 5.100 -5.631 1.00 0.00 C ATOM 317 O LEU A1545 -5.174 5.678 -5.384 1.00 0.00 O ATOM 318 CB LEU A1545 -5.850 3.257 -4.076 1.00 0.00 C ATOM 319 CG LEU A1545 -6.333 2.216 -3.102 1.00 0.00 C ATOM 320 CD1 LEU A1545 -5.252 1.220 -2.862 1.00 0.00 C ATOM 321 CD2 LEU A1545 -6.760 2.825 -1.789 1.00 0.00 C ATOM 0 H LEU A1545 -7.669 2.816 -5.912 1.00 0.00 H new ATOM 0 HA LEU A1545 -7.280 4.823 -3.786 1.00 0.00 H new ATOM 0 HB2 LEU A1545 -5.398 2.746 -4.926 1.00 0.00 H new ATOM 0 HB3 LEU A1545 -5.060 3.834 -3.595 1.00 0.00 H new ATOM 0 HG LEU A1545 -7.204 1.729 -3.540 1.00 0.00 H new ATOM 0 HD11 LEU A1545 -5.602 0.466 -2.157 1.00 0.00 H new ATOM 0 HD12 LEU A1545 -4.984 0.740 -3.803 1.00 0.00 H new ATOM 0 HD13 LEU A1545 -4.378 1.724 -2.450 1.00 0.00 H new ATOM 0 HD21 LEU A1545 -7.101 2.038 -1.117 1.00 0.00 H new ATOM 0 HD22 LEU A1545 -5.916 3.347 -1.338 1.00 0.00 H new ATOM 0 HD23 LEU A1545 -7.572 3.531 -1.962 1.00 0.00 H new ATOM 333 N ASN A1546 -6.859 5.238 -6.773 1.00 0.00 N ATOM 334 CA ASN A1546 -6.310 6.036 -7.875 1.00 0.00 C ATOM 335 C ASN A1546 -6.224 7.497 -7.520 1.00 0.00 C ATOM 336 O ASN A1546 -5.439 8.235 -8.095 1.00 0.00 O ATOM 337 CB ASN A1546 -7.071 5.834 -9.195 1.00 0.00 C ATOM 338 CG ASN A1546 -6.702 4.548 -9.900 1.00 0.00 C ATOM 339 OD1 ASN A1546 -5.781 4.525 -10.702 1.00 0.00 O ATOM 340 ND2 ASN A1546 -7.424 3.497 -9.649 1.00 0.00 N ATOM 0 H ASN A1546 -7.762 4.810 -6.975 1.00 0.00 H new ATOM 0 HA ASN A1546 -5.296 5.668 -8.035 1.00 0.00 H new ATOM 0 HB2 ASN A1546 -8.142 5.837 -8.994 1.00 0.00 H new ATOM 0 HB3 ASN A1546 -6.868 6.676 -9.857 1.00 0.00 H new ATOM 0 HD21 ASN A1546 -7.229 2.618 -10.128 1.00 0.00 H new ATOM 0 HD22 ASN A1546 -8.186 3.551 -8.973 1.00 0.00 H new ATOM 347 N SER A1547 -7.005 7.913 -6.554 1.00 0.00 N ATOM 348 CA SER A1547 -6.942 9.287 -6.078 1.00 0.00 C ATOM 349 C SER A1547 -5.683 9.523 -5.218 1.00 0.00 C ATOM 350 O SER A1547 -5.311 10.651 -4.948 1.00 0.00 O ATOM 351 CB SER A1547 -8.203 9.630 -5.303 1.00 0.00 C ATOM 352 OG SER A1547 -9.359 9.332 -6.090 1.00 0.00 O ATOM 0 H SER A1547 -7.692 7.328 -6.078 1.00 0.00 H new ATOM 0 HA SER A1547 -6.875 9.947 -6.943 1.00 0.00 H new ATOM 0 HB2 SER A1547 -8.232 9.065 -4.371 1.00 0.00 H new ATOM 0 HB3 SER A1547 -8.198 10.686 -5.035 1.00 0.00 H new ATOM 0 HG SER A1547 -10.167 9.555 -5.582 1.00 0.00 H new ATOM 358 N LEU A1548 -5.018 8.445 -4.808 1.00 0.00 N ATOM 359 CA LEU A1548 -3.810 8.558 -4.030 1.00 0.00 C ATOM 360 C LEU A1548 -2.594 8.573 -4.927 1.00 0.00 C ATOM 361 O LEU A1548 -1.466 8.554 -4.448 1.00 0.00 O ATOM 362 CB LEU A1548 -3.696 7.409 -3.046 1.00 0.00 C ATOM 363 CG LEU A1548 -4.804 7.300 -2.032 1.00 0.00 C ATOM 364 CD1 LEU A1548 -4.595 6.082 -1.168 1.00 0.00 C ATOM 365 CD2 LEU A1548 -4.872 8.556 -1.199 1.00 0.00 C ATOM 0 H LEU A1548 -5.305 7.487 -5.008 1.00 0.00 H new ATOM 0 HA LEU A1548 -3.857 9.497 -3.479 1.00 0.00 H new ATOM 0 HB2 LEU A1548 -3.652 6.477 -3.609 1.00 0.00 H new ATOM 0 HB3 LEU A1548 -2.750 7.505 -2.513 1.00 0.00 H new ATOM 0 HG LEU A1548 -5.756 7.188 -2.551 1.00 0.00 H new ATOM 0 HD11 LEU A1548 -5.401 6.011 -0.438 1.00 0.00 H new ATOM 0 HD12 LEU A1548 -4.592 5.189 -1.793 1.00 0.00 H new ATOM 0 HD13 LEU A1548 -3.641 6.164 -0.648 1.00 0.00 H new ATOM 0 HD21 LEU A1548 -5.677 8.466 -0.469 1.00 0.00 H new ATOM 0 HD22 LEU A1548 -3.925 8.699 -0.679 1.00 0.00 H new ATOM 0 HD23 LEU A1548 -5.064 9.412 -1.846 1.00 0.00 H new ATOM 377 N LYS A1549 -2.819 8.635 -6.208 1.00 0.00 N ATOM 378 CA LYS A1549 -1.744 8.672 -7.151 1.00 0.00 C ATOM 379 C LYS A1549 -1.283 10.084 -7.270 1.00 0.00 C ATOM 380 O LYS A1549 -1.903 10.909 -7.943 1.00 0.00 O ATOM 381 CB LYS A1549 -2.138 8.126 -8.519 1.00 0.00 C ATOM 382 CG LYS A1549 -2.578 6.675 -8.528 1.00 0.00 C ATOM 383 CD LYS A1549 -2.781 6.172 -9.947 1.00 0.00 C ATOM 384 CE LYS A1549 -3.814 6.995 -10.701 1.00 0.00 C ATOM 385 NZ LYS A1549 -4.002 6.512 -12.079 1.00 0.00 N1+ ATOM 0 H LYS A1549 -3.750 8.661 -6.625 1.00 0.00 H new ATOM 0 HA LYS A1549 -0.943 8.028 -6.788 1.00 0.00 H new ATOM 0 HB2 LYS A1549 -2.947 8.738 -8.918 1.00 0.00 H new ATOM 0 HB3 LYS A1549 -1.291 8.237 -9.196 1.00 0.00 H new ATOM 0 HG2 LYS A1549 -1.830 6.062 -8.026 1.00 0.00 H new ATOM 0 HG3 LYS A1549 -3.506 6.570 -7.966 1.00 0.00 H new ATOM 0 HD2 LYS A1549 -1.832 6.203 -10.482 1.00 0.00 H new ATOM 0 HD3 LYS A1549 -3.098 5.129 -9.920 1.00 0.00 H new ATOM 0 HE2 LYS A1549 -4.765 6.958 -10.170 1.00 0.00 H new ATOM 0 HE3 LYS A1549 -3.501 8.039 -10.722 1.00 0.00 H new ATOM 0 HZ1 LYS A1549 -4.416 7.270 -12.659 1.00 0.00 H new ATOM 0 HZ2 LYS A1549 -3.083 6.234 -12.478 1.00 0.00 H new ATOM 0 HZ3 LYS A1549 -4.640 5.691 -12.075 1.00 0.00 H new ATOM 399 N ASN A1550 -0.269 10.372 -6.550 1.00 0.00 N ATOM 400 CA ASN A1550 0.311 11.652 -6.505 1.00 0.00 C ATOM 401 C ASN A1550 1.777 11.512 -6.720 1.00 0.00 C ATOM 402 O ASN A1550 2.418 10.606 -6.170 1.00 0.00 O ATOM 403 CB ASN A1550 0.036 12.353 -5.165 1.00 0.00 C ATOM 404 CG ASN A1550 -1.380 12.880 -5.012 1.00 0.00 C ATOM 405 OD1 ASN A1550 -1.687 13.993 -5.433 1.00 0.00 O ATOM 406 ND2 ASN A1550 -2.224 12.138 -4.349 1.00 0.00 N ATOM 0 H ASN A1550 0.198 9.692 -5.951 1.00 0.00 H new ATOM 0 HA ASN A1550 -0.132 12.269 -7.287 1.00 0.00 H new ATOM 0 HB2 ASN A1550 0.240 11.654 -4.354 1.00 0.00 H new ATOM 0 HB3 ASN A1550 0.734 13.183 -5.053 1.00 0.00 H new ATOM 0 HD21 ASN A1550 -3.168 12.478 -4.167 1.00 0.00 H new ATOM 0 HD22 ASN A1550 -1.939 11.218 -4.012 1.00 0.00 H new ATOM 413 N ASP A1551 2.292 12.387 -7.509 1.00 0.00 N ATOM 414 CA ASP A1551 3.708 12.430 -7.855 1.00 0.00 C ATOM 415 C ASP A1551 4.504 12.949 -6.703 1.00 0.00 C ATOM 416 O ASP A1551 5.716 12.728 -6.621 1.00 0.00 O ATOM 417 CB ASP A1551 3.990 13.267 -9.115 1.00 0.00 C ATOM 418 CG ASP A1551 3.586 14.725 -9.018 1.00 0.00 C ATOM 419 OD1 ASP A1551 4.387 15.562 -8.572 1.00 0.00 O1- ATOM 420 OD2 ASP A1551 2.451 15.070 -9.427 1.00 0.00 O ATOM 0 H ASP A1551 1.743 13.122 -7.955 1.00 0.00 H new ATOM 0 HA ASP A1551 4.010 11.407 -8.080 1.00 0.00 H new ATOM 0 HB2 ASP A1551 5.056 13.215 -9.337 1.00 0.00 H new ATOM 0 HB3 ASP A1551 3.466 12.816 -9.958 1.00 0.00 H new ATOM 425 N SER A1552 3.829 13.658 -5.828 1.00 0.00 N ATOM 426 CA SER A1552 4.361 14.121 -4.624 1.00 0.00 C ATOM 427 C SER A1552 4.918 12.933 -3.834 1.00 0.00 C ATOM 428 O SER A1552 6.120 12.843 -3.596 1.00 0.00 O ATOM 429 CB SER A1552 3.234 14.802 -3.907 1.00 0.00 C ATOM 430 OG SER A1552 2.574 15.696 -4.797 1.00 0.00 O ATOM 0 H SER A1552 2.854 13.925 -5.968 1.00 0.00 H new ATOM 0 HA SER A1552 5.185 14.821 -4.764 1.00 0.00 H new ATOM 0 HB2 SER A1552 2.529 14.061 -3.530 1.00 0.00 H new ATOM 0 HB3 SER A1552 3.615 15.347 -3.044 1.00 0.00 H new ATOM 0 HG SER A1552 1.836 16.139 -4.328 1.00 0.00 H new ATOM 436 N GLY A1553 4.071 11.988 -3.526 1.00 0.00 N ATOM 437 CA GLY A1553 4.525 10.811 -2.856 1.00 0.00 C ATOM 438 C GLY A1553 4.294 10.836 -1.383 1.00 0.00 C ATOM 439 O GLY A1553 4.093 11.893 -0.780 1.00 0.00 O ATOM 0 H GLY A1553 3.072 12.014 -3.728 1.00 0.00 H new ATOM 0 HA2 GLY A1553 4.019 9.944 -3.280 1.00 0.00 H new ATOM 0 HA3 GLY A1553 5.591 10.683 -3.046 1.00 0.00 H new ATOM 443 N TYR A1554 4.372 9.686 -0.802 1.00 0.00 N ATOM 444 CA TYR A1554 4.057 9.486 0.584 1.00 0.00 C ATOM 445 C TYR A1554 5.287 9.067 1.347 1.00 0.00 C ATOM 446 O TYR A1554 6.328 8.775 0.751 1.00 0.00 O ATOM 447 CB TYR A1554 2.936 8.440 0.696 1.00 0.00 C ATOM 448 CG TYR A1554 1.704 8.875 -0.055 1.00 0.00 C ATOM 449 CD1 TYR A1554 1.585 8.622 -1.413 1.00 0.00 C ATOM 450 CD2 TYR A1554 0.691 9.582 0.570 1.00 0.00 C ATOM 451 CE1 TYR A1554 0.504 9.054 -2.122 1.00 0.00 C ATOM 452 CE2 TYR A1554 -0.411 10.013 -0.140 1.00 0.00 C ATOM 453 CZ TYR A1554 -0.494 9.748 -1.486 1.00 0.00 C ATOM 454 OH TYR A1554 -1.584 10.170 -2.207 1.00 0.00 O ATOM 0 H TYR A1554 4.663 8.835 -1.284 1.00 0.00 H new ATOM 0 HA TYR A1554 3.708 10.420 1.025 1.00 0.00 H new ATOM 0 HB2 TYR A1554 3.286 7.485 0.303 1.00 0.00 H new ATOM 0 HB3 TYR A1554 2.688 8.281 1.745 1.00 0.00 H new ATOM 0 HD1 TYR A1554 2.364 8.072 -1.919 1.00 0.00 H new ATOM 0 HD2 TYR A1554 0.764 9.799 1.626 1.00 0.00 H new ATOM 0 HE1 TYR A1554 0.433 8.851 -3.180 1.00 0.00 H new ATOM 0 HE2 TYR A1554 -1.202 10.554 0.358 1.00 0.00 H new ATOM 0 HH TYR A1554 -1.662 9.636 -3.025 1.00 0.00 H new ATOM 464 N SER A1555 5.166 9.048 2.632 1.00 0.00 N ATOM 465 CA SER A1555 6.234 8.711 3.522 1.00 0.00 C ATOM 466 C SER A1555 5.703 8.122 4.819 1.00 0.00 C ATOM 467 O SER A1555 4.607 8.471 5.279 1.00 0.00 O ATOM 468 CB SER A1555 7.127 9.926 3.772 1.00 0.00 C ATOM 469 OG SER A1555 6.368 11.120 3.935 1.00 0.00 O ATOM 0 H SER A1555 4.294 9.273 3.111 1.00 0.00 H new ATOM 0 HA SER A1555 6.846 7.942 3.050 1.00 0.00 H new ATOM 0 HB2 SER A1555 7.731 9.755 4.663 1.00 0.00 H new ATOM 0 HB3 SER A1555 7.818 10.046 2.938 1.00 0.00 H new ATOM 0 HG SER A1555 6.974 11.874 4.094 1.00 0.00 H new ATOM 475 N VAL A1556 6.464 7.215 5.368 1.00 0.00 N ATOM 476 CA VAL A1556 6.131 6.485 6.564 1.00 0.00 C ATOM 477 C VAL A1556 7.367 6.356 7.394 1.00 0.00 C ATOM 478 O VAL A1556 8.212 5.525 7.119 1.00 0.00 O ATOM 479 CB VAL A1556 5.607 5.053 6.209 1.00 0.00 C ATOM 480 CG1 VAL A1556 5.424 4.197 7.441 1.00 0.00 C ATOM 481 CG2 VAL A1556 4.307 5.124 5.473 1.00 0.00 C ATOM 0 H VAL A1556 7.370 6.953 4.980 1.00 0.00 H new ATOM 0 HA VAL A1556 5.350 7.018 7.106 1.00 0.00 H new ATOM 0 HB VAL A1556 6.365 4.595 5.573 1.00 0.00 H new ATOM 0 HG11 VAL A1556 5.059 3.212 7.149 1.00 0.00 H new ATOM 0 HG12 VAL A1556 6.379 4.092 7.956 1.00 0.00 H new ATOM 0 HG13 VAL A1556 4.702 4.668 8.108 1.00 0.00 H new ATOM 0 HG21 VAL A1556 3.966 4.116 5.239 1.00 0.00 H new ATOM 0 HG22 VAL A1556 3.564 5.623 6.095 1.00 0.00 H new ATOM 0 HG23 VAL A1556 4.443 5.685 4.548 1.00 0.00 H new ATOM 491 N ALA A1557 7.527 7.260 8.308 1.00 0.00 N ATOM 492 CA ALA A1557 8.618 7.213 9.257 1.00 0.00 C ATOM 493 C ALA A1557 8.706 5.840 9.922 1.00 0.00 C ATOM 494 O ALA A1557 7.716 5.329 10.462 1.00 0.00 O ATOM 495 CB ALA A1557 8.490 8.307 10.294 1.00 0.00 C ATOM 0 H ALA A1557 6.906 8.060 8.426 1.00 0.00 H new ATOM 0 HA ALA A1557 9.543 7.382 8.706 1.00 0.00 H new ATOM 0 HB1 ALA A1557 9.324 8.245 10.993 1.00 0.00 H new ATOM 0 HB2 ALA A1557 8.501 9.279 9.801 1.00 0.00 H new ATOM 0 HB3 ALA A1557 7.553 8.186 10.837 1.00 0.00 H new ATOM 501 N TYR A1558 9.870 5.250 9.867 1.00 0.00 N ATOM 502 CA TYR A1558 10.075 3.930 10.411 1.00 0.00 C ATOM 503 C TYR A1558 10.445 4.072 11.881 1.00 0.00 C ATOM 504 O TYR A1558 11.008 5.097 12.289 1.00 0.00 O ATOM 505 CB TYR A1558 11.171 3.189 9.602 1.00 0.00 C ATOM 506 CG TYR A1558 11.429 1.739 9.986 1.00 0.00 C ATOM 507 CD1 TYR A1558 10.664 0.715 9.459 1.00 0.00 C ATOM 508 CD2 TYR A1558 12.444 1.401 10.859 1.00 0.00 C ATOM 509 CE1 TYR A1558 10.905 -0.603 9.795 1.00 0.00 C ATOM 510 CE2 TYR A1558 12.687 0.089 11.198 1.00 0.00 C ATOM 511 CZ TYR A1558 11.918 -0.906 10.666 1.00 0.00 C ATOM 512 OH TYR A1558 12.163 -2.220 11.017 1.00 0.00 O ATOM 0 H TYR A1558 10.701 5.667 9.446 1.00 0.00 H new ATOM 0 HA TYR A1558 9.166 3.333 10.336 1.00 0.00 H new ATOM 0 HB2 TYR A1558 10.897 3.220 8.547 1.00 0.00 H new ATOM 0 HB3 TYR A1558 12.105 3.742 9.705 1.00 0.00 H new ATOM 0 HD1 TYR A1558 9.864 0.950 8.773 1.00 0.00 H new ATOM 0 HD2 TYR A1558 13.059 2.181 11.284 1.00 0.00 H new ATOM 0 HE1 TYR A1558 10.298 -1.390 9.373 1.00 0.00 H new ATOM 0 HE2 TYR A1558 13.485 -0.153 11.884 1.00 0.00 H new ATOM 0 HH TYR A1558 12.917 -2.256 11.642 1.00 0.00 H new ATOM 522 N SER A1559 10.120 3.060 12.650 1.00 0.00 N ATOM 523 CA SER A1559 10.282 3.012 14.092 1.00 0.00 C ATOM 524 C SER A1559 11.720 3.342 14.590 1.00 0.00 C ATOM 525 O SER A1559 11.887 3.769 15.741 1.00 0.00 O ATOM 526 CB SER A1559 9.884 1.613 14.525 1.00 0.00 C ATOM 527 OG SER A1559 8.730 1.198 13.793 1.00 0.00 O ATOM 0 H SER A1559 9.715 2.203 12.273 1.00 0.00 H new ATOM 0 HA SER A1559 9.654 3.785 14.535 1.00 0.00 H new ATOM 0 HB2 SER A1559 10.707 0.919 14.352 1.00 0.00 H new ATOM 0 HB3 SER A1559 9.674 1.598 15.595 1.00 0.00 H new ATOM 0 HG SER A1559 8.474 0.294 14.071 1.00 0.00 H new ATOM 533 N GLU A1560 12.735 3.152 13.744 1.00 0.00 N ATOM 534 CA GLU A1560 14.114 3.381 14.164 1.00 0.00 C ATOM 535 C GLU A1560 14.566 4.829 14.015 1.00 0.00 C ATOM 536 O GLU A1560 14.556 5.581 14.988 1.00 0.00 O ATOM 537 CB GLU A1560 15.105 2.457 13.465 1.00 0.00 C ATOM 538 CG GLU A1560 14.964 1.003 13.807 1.00 0.00 C ATOM 539 CD GLU A1560 16.013 0.158 13.122 1.00 0.00 C ATOM 540 OE1 GLU A1560 17.147 0.087 13.622 1.00 0.00 O1- ATOM 541 OE2 GLU A1560 15.722 -0.439 12.066 1.00 0.00 O ATOM 0 H GLU A1560 12.628 2.844 12.777 1.00 0.00 H new ATOM 0 HA GLU A1560 14.112 3.145 15.228 1.00 0.00 H new ATOM 0 HB2 GLU A1560 14.991 2.574 12.387 1.00 0.00 H new ATOM 0 HB3 GLU A1560 16.116 2.777 13.715 1.00 0.00 H new ATOM 0 HG2 GLU A1560 15.043 0.875 14.887 1.00 0.00 H new ATOM 0 HG3 GLU A1560 13.972 0.656 13.516 1.00 0.00 H new ATOM 548 N LYS A1561 14.945 5.240 12.806 1.00 0.00 N ATOM 549 CA LYS A1561 15.532 6.582 12.647 1.00 0.00 C ATOM 550 C LYS A1561 15.163 7.319 11.348 1.00 0.00 C ATOM 551 O LYS A1561 15.371 8.538 11.244 1.00 0.00 O ATOM 552 CB LYS A1561 17.080 6.590 12.853 1.00 0.00 C ATOM 553 CG LYS A1561 17.921 5.749 11.875 1.00 0.00 C ATOM 554 CD LYS A1561 17.691 4.271 12.062 1.00 0.00 C ATOM 555 CE LYS A1561 18.616 3.407 11.213 1.00 0.00 C ATOM 556 NZ LYS A1561 20.037 3.574 11.593 1.00 0.00 N1+ ATOM 0 H LYS A1561 14.864 4.693 11.949 1.00 0.00 H new ATOM 0 HA LYS A1561 15.063 7.149 13.451 1.00 0.00 H new ATOM 0 HB2 LYS A1561 17.424 7.623 12.794 1.00 0.00 H new ATOM 0 HB3 LYS A1561 17.289 6.242 13.865 1.00 0.00 H new ATOM 0 HG2 LYS A1561 17.673 6.028 10.851 1.00 0.00 H new ATOM 0 HG3 LYS A1561 18.978 5.973 12.020 1.00 0.00 H new ATOM 0 HD2 LYS A1561 17.831 4.018 13.113 1.00 0.00 H new ATOM 0 HD3 LYS A1561 16.656 4.037 11.813 1.00 0.00 H new ATOM 0 HE2 LYS A1561 18.333 2.360 11.320 1.00 0.00 H new ATOM 0 HE3 LYS A1561 18.489 3.665 10.162 1.00 0.00 H new ATOM 0 HZ1 LYS A1561 20.604 2.821 11.154 1.00 0.00 H new ATOM 0 HZ2 LYS A1561 20.378 4.500 11.265 1.00 0.00 H new ATOM 0 HZ3 LYS A1561 20.129 3.518 12.627 1.00 0.00 H new ATOM 570 N GLY A1562 14.622 6.622 10.384 1.00 0.00 N ATOM 571 CA GLY A1562 14.299 7.236 9.138 1.00 0.00 C ATOM 572 C GLY A1562 12.961 6.783 8.696 1.00 0.00 C ATOM 573 O GLY A1562 12.351 5.999 9.373 1.00 0.00 O ATOM 0 H GLY A1562 14.398 5.629 10.444 1.00 0.00 H new ATOM 0 HA2 GLY A1562 14.311 8.321 9.241 1.00 0.00 H new ATOM 0 HA3 GLY A1562 15.048 6.978 8.389 1.00 0.00 H new ATOM 577 N LEU A1563 12.536 7.229 7.575 1.00 0.00 N ATOM 578 CA LEU A1563 11.226 6.939 7.052 1.00 0.00 C ATOM 579 C LEU A1563 11.311 6.025 5.834 1.00 0.00 C ATOM 580 O LEU A1563 12.405 5.698 5.347 1.00 0.00 O ATOM 581 CB LEU A1563 10.512 8.276 6.718 1.00 0.00 C ATOM 582 CG LEU A1563 10.957 9.051 5.474 1.00 0.00 C ATOM 583 CD1 LEU A1563 10.252 8.514 4.262 1.00 0.00 C ATOM 584 CD2 LEU A1563 10.673 10.519 5.639 1.00 0.00 C ATOM 0 H LEU A1563 13.096 7.826 6.966 1.00 0.00 H new ATOM 0 HA LEU A1563 10.643 6.405 7.802 1.00 0.00 H new ATOM 0 HB2 LEU A1563 9.447 8.067 6.615 1.00 0.00 H new ATOM 0 HB3 LEU A1563 10.625 8.936 7.578 1.00 0.00 H new ATOM 0 HG LEU A1563 12.032 8.924 5.344 1.00 0.00 H new ATOM 0 HD11 LEU A1563 10.572 9.068 3.380 1.00 0.00 H new ATOM 0 HD12 LEU A1563 10.497 7.459 4.136 1.00 0.00 H new ATOM 0 HD13 LEU A1563 9.175 8.624 4.389 1.00 0.00 H new ATOM 0 HD21 LEU A1563 10.995 11.055 4.746 1.00 0.00 H new ATOM 0 HD22 LEU A1563 9.603 10.668 5.785 1.00 0.00 H new ATOM 0 HD23 LEU A1563 11.214 10.899 6.505 1.00 0.00 H new ATOM 596 N ILE A1564 10.158 5.623 5.370 1.00 0.00 N ATOM 597 CA ILE A1564 9.983 4.817 4.192 1.00 0.00 C ATOM 598 C ILE A1564 9.038 5.574 3.234 1.00 0.00 C ATOM 599 O ILE A1564 7.942 5.916 3.611 1.00 0.00 O ATOM 600 CB ILE A1564 9.322 3.471 4.582 1.00 0.00 C ATOM 601 CG1 ILE A1564 10.085 2.783 5.716 1.00 0.00 C ATOM 602 CG2 ILE A1564 9.245 2.554 3.382 1.00 0.00 C ATOM 603 CD1 ILE A1564 9.388 1.552 6.248 1.00 0.00 C ATOM 0 H ILE A1564 9.276 5.859 5.824 1.00 0.00 H new ATOM 0 HA ILE A1564 10.946 4.626 3.719 1.00 0.00 H new ATOM 0 HB ILE A1564 8.313 3.687 4.933 1.00 0.00 H new ATOM 0 HG12 ILE A1564 11.077 2.505 5.360 1.00 0.00 H new ATOM 0 HG13 ILE A1564 10.227 3.492 6.531 1.00 0.00 H new ATOM 0 HG21 ILE A1564 8.778 1.613 3.673 1.00 0.00 H new ATOM 0 HG22 ILE A1564 8.651 3.027 2.600 1.00 0.00 H new ATOM 0 HG23 ILE A1564 10.250 2.360 3.007 1.00 0.00 H new ATOM 0 HD11 ILE A1564 9.983 1.114 7.049 1.00 0.00 H new ATOM 0 HD12 ILE A1564 8.407 1.828 6.634 1.00 0.00 H new ATOM 0 HD13 ILE A1564 9.270 0.825 5.445 1.00 0.00 H new ATOM 615 N TYR A1565 9.493 5.875 2.051 1.00 0.00 N ATOM 616 CA TYR A1565 8.694 6.605 1.078 1.00 0.00 C ATOM 617 C TYR A1565 7.774 5.652 0.349 1.00 0.00 C ATOM 618 O TYR A1565 8.126 4.492 0.121 1.00 0.00 O ATOM 619 CB TYR A1565 9.563 7.363 0.062 1.00 0.00 C ATOM 620 CG TYR A1565 10.344 8.526 0.630 1.00 0.00 C ATOM 621 CD1 TYR A1565 9.701 9.705 0.990 1.00 0.00 C ATOM 622 CD2 TYR A1565 11.718 8.454 0.795 1.00 0.00 C ATOM 623 CE1 TYR A1565 10.406 10.778 1.500 1.00 0.00 C ATOM 624 CE2 TYR A1565 12.431 9.526 1.301 1.00 0.00 C ATOM 625 CZ TYR A1565 11.771 10.684 1.650 1.00 0.00 C ATOM 626 OH TYR A1565 12.486 11.753 2.155 1.00 0.00 O ATOM 0 H TYR A1565 10.426 5.626 1.723 1.00 0.00 H new ATOM 0 HA TYR A1565 8.109 7.343 1.627 1.00 0.00 H new ATOM 0 HB2 TYR A1565 10.264 6.661 -0.390 1.00 0.00 H new ATOM 0 HB3 TYR A1565 8.921 7.732 -0.738 1.00 0.00 H new ATOM 0 HD1 TYR A1565 8.631 9.783 0.869 1.00 0.00 H new ATOM 0 HD2 TYR A1565 12.240 7.548 0.525 1.00 0.00 H new ATOM 0 HE1 TYR A1565 9.890 11.685 1.779 1.00 0.00 H new ATOM 0 HE2 TYR A1565 13.502 9.455 1.422 1.00 0.00 H new ATOM 0 HH TYR A1565 13.437 11.520 2.197 1.00 0.00 H new ATOM 636 N ILE A1566 6.603 6.129 0.003 1.00 0.00 N ATOM 637 CA ILE A1566 5.614 5.315 -0.659 1.00 0.00 C ATOM 638 C ILE A1566 5.034 6.025 -1.902 1.00 0.00 C ATOM 639 O ILE A1566 4.814 7.240 -1.897 1.00 0.00 O ATOM 640 CB ILE A1566 4.437 4.985 0.317 1.00 0.00 C ATOM 641 CG1 ILE A1566 4.909 4.144 1.511 1.00 0.00 C ATOM 642 CG2 ILE A1566 3.283 4.304 -0.399 1.00 0.00 C ATOM 643 CD1 ILE A1566 3.791 3.726 2.440 1.00 0.00 C ATOM 0 H ILE A1566 6.309 7.091 0.172 1.00 0.00 H new ATOM 0 HA ILE A1566 6.112 4.398 -0.973 1.00 0.00 H new ATOM 0 HB ILE A1566 4.073 5.937 0.702 1.00 0.00 H new ATOM 0 HG12 ILE A1566 5.413 3.252 1.139 1.00 0.00 H new ATOM 0 HG13 ILE A1566 5.646 4.714 2.077 1.00 0.00 H new ATOM 0 HG21 ILE A1566 2.487 4.092 0.314 1.00 0.00 H new ATOM 0 HG22 ILE A1566 2.903 4.960 -1.183 1.00 0.00 H new ATOM 0 HG23 ILE A1566 3.630 3.371 -0.843 1.00 0.00 H new ATOM 0 HD11 ILE A1566 4.201 3.135 3.259 1.00 0.00 H new ATOM 0 HD12 ILE A1566 3.301 4.613 2.842 1.00 0.00 H new ATOM 0 HD13 ILE A1566 3.065 3.128 1.889 1.00 0.00 H new ATOM 655 N GLY A1567 4.843 5.268 -2.947 1.00 0.00 N ATOM 656 CA GLY A1567 4.143 5.701 -4.116 1.00 0.00 C ATOM 657 C GLY A1567 2.959 4.778 -4.318 1.00 0.00 C ATOM 658 O GLY A1567 3.112 3.561 -4.281 1.00 0.00 O ATOM 0 H GLY A1567 5.181 4.307 -3.007 1.00 0.00 H new ATOM 0 HA2 GLY A1567 3.808 6.732 -4.000 1.00 0.00 H new ATOM 0 HA3 GLY A1567 4.800 5.675 -4.986 1.00 0.00 H new ATOM 662 N ILE A1568 1.790 5.323 -4.500 1.00 0.00 N ATOM 663 CA ILE A1568 0.584 4.499 -4.601 1.00 0.00 C ATOM 664 C ILE A1568 0.134 4.377 -6.040 1.00 0.00 C ATOM 665 O ILE A1568 -0.469 5.303 -6.577 1.00 0.00 O ATOM 666 CB ILE A1568 -0.583 5.079 -3.723 1.00 0.00 C ATOM 667 CG1 ILE A1568 -0.197 5.085 -2.239 1.00 0.00 C ATOM 668 CG2 ILE A1568 -1.887 4.282 -3.915 1.00 0.00 C ATOM 669 CD1 ILE A1568 0.035 3.696 -1.666 1.00 0.00 C ATOM 0 H ILE A1568 1.630 6.327 -4.583 1.00 0.00 H new ATOM 0 HA ILE A1568 0.836 3.508 -4.224 1.00 0.00 H new ATOM 0 HB ILE A1568 -0.755 6.104 -4.053 1.00 0.00 H new ATOM 0 HG12 ILE A1568 0.708 5.678 -2.110 1.00 0.00 H new ATOM 0 HG13 ILE A1568 -0.985 5.577 -1.669 1.00 0.00 H new ATOM 0 HG21 ILE A1568 -2.671 4.712 -3.292 1.00 0.00 H new ATOM 0 HG22 ILE A1568 -2.190 4.326 -4.961 1.00 0.00 H new ATOM 0 HG23 ILE A1568 -1.724 3.243 -3.628 1.00 0.00 H new ATOM 0 HD11 ILE A1568 0.304 3.777 -0.613 1.00 0.00 H new ATOM 0 HD12 ILE A1568 -0.876 3.106 -1.763 1.00 0.00 H new ATOM 0 HD13 ILE A1568 0.843 3.208 -2.211 1.00 0.00 H new ATOM 681 N CYS A1569 0.524 3.248 -6.691 1.00 0.00 N ATOM 682 CA CYS A1569 0.104 2.913 -8.069 1.00 0.00 C ATOM 683 C CYS A1569 0.606 3.967 -9.084 1.00 0.00 C ATOM 684 O CYS A1569 0.222 3.974 -10.261 1.00 0.00 O ATOM 685 CB CYS A1569 -1.430 2.818 -8.092 1.00 0.00 C ATOM 686 SG CYS A1569 -2.185 2.276 -9.656 1.00 0.00 S ATOM 0 H CYS A1569 1.137 2.549 -6.271 1.00 0.00 H new ATOM 0 HA CYS A1569 0.543 1.960 -8.363 1.00 0.00 H new ATOM 0 HB2 CYS A1569 -1.741 2.130 -7.306 1.00 0.00 H new ATOM 0 HB3 CYS A1569 -1.837 3.797 -7.838 1.00 0.00 H new ATOM 691 N GLY A1570 1.512 4.787 -8.639 1.00 0.00 N ATOM 692 CA GLY A1570 1.980 5.891 -9.422 1.00 0.00 C ATOM 693 C GLY A1570 3.352 6.299 -8.996 1.00 0.00 C ATOM 694 O GLY A1570 3.792 5.951 -7.890 1.00 0.00 O ATOM 0 H GLY A1570 1.948 4.708 -7.720 1.00 0.00 H new ATOM 0 HA2 GLY A1570 1.988 5.617 -10.477 1.00 0.00 H new ATOM 0 HA3 GLY A1570 1.296 6.733 -9.317 1.00 0.00 H new ATOM 698 N GLY A1571 4.034 7.004 -9.857 1.00 0.00 N ATOM 699 CA GLY A1571 5.379 7.398 -9.598 1.00 0.00 C ATOM 700 C GLY A1571 5.472 8.676 -8.826 1.00 0.00 C ATOM 701 O GLY A1571 4.762 9.655 -9.111 1.00 0.00 O ATOM 0 H GLY A1571 3.667 7.318 -10.755 1.00 0.00 H new ATOM 0 HA2 GLY A1571 5.884 6.607 -9.044 1.00 0.00 H new ATOM 0 HA3 GLY A1571 5.908 7.512 -10.544 1.00 0.00 H new ATOM 705 N THR A1572 6.336 8.668 -7.871 1.00 0.00 N ATOM 706 CA THR A1572 6.588 9.783 -7.031 1.00 0.00 C ATOM 707 C THR A1572 7.991 10.335 -7.266 1.00 0.00 C ATOM 708 O THR A1572 8.799 9.727 -7.954 1.00 0.00 O ATOM 709 CB THR A1572 6.299 9.477 -5.516 1.00 0.00 C ATOM 710 OG1 THR A1572 6.964 10.395 -4.624 1.00 0.00 O ATOM 711 CG2 THR A1572 6.636 8.049 -5.156 1.00 0.00 C ATOM 0 H THR A1572 6.907 7.853 -7.647 1.00 0.00 H new ATOM 0 HA THR A1572 5.882 10.566 -7.306 1.00 0.00 H new ATOM 0 HB THR A1572 5.226 9.618 -5.384 1.00 0.00 H new ATOM 0 HG1 THR A1572 6.681 11.311 -4.827 1.00 0.00 H new ATOM 0 HG21 THR A1572 6.422 7.880 -4.101 1.00 0.00 H new ATOM 0 HG22 THR A1572 6.036 7.370 -5.762 1.00 0.00 H new ATOM 0 HG23 THR A1572 7.694 7.866 -5.345 1.00 0.00 H new ATOM 719 N LYS A1573 8.227 11.516 -6.785 1.00 0.00 N ATOM 720 CA LYS A1573 9.515 12.131 -6.839 1.00 0.00 C ATOM 721 C LYS A1573 10.319 11.771 -5.587 1.00 0.00 C ATOM 722 O LYS A1573 11.537 11.957 -5.532 1.00 0.00 O ATOM 723 CB LYS A1573 9.325 13.632 -6.943 1.00 0.00 C ATOM 724 CG LYS A1573 8.613 14.244 -5.738 1.00 0.00 C ATOM 725 CD LYS A1573 7.880 15.505 -6.118 1.00 0.00 C ATOM 726 CE LYS A1573 8.803 16.585 -6.655 1.00 0.00 C ATOM 727 NZ LYS A1573 8.027 17.708 -7.206 1.00 0.00 N1+ ATOM 0 H LYS A1573 7.514 12.090 -6.335 1.00 0.00 H new ATOM 0 HA LYS A1573 10.069 11.774 -7.707 1.00 0.00 H new ATOM 0 HB2 LYS A1573 10.300 14.106 -7.058 1.00 0.00 H new ATOM 0 HB3 LYS A1573 8.754 13.856 -7.844 1.00 0.00 H new ATOM 0 HG2 LYS A1573 7.909 13.522 -5.324 1.00 0.00 H new ATOM 0 HG3 LYS A1573 9.340 14.465 -4.957 1.00 0.00 H new ATOM 0 HD2 LYS A1573 7.128 15.269 -6.871 1.00 0.00 H new ATOM 0 HD3 LYS A1573 7.349 15.888 -5.246 1.00 0.00 H new ATOM 0 HE2 LYS A1573 9.454 16.943 -5.857 1.00 0.00 H new ATOM 0 HE3 LYS A1573 9.447 16.168 -7.429 1.00 0.00 H new ATOM 0 HZ1 LYS A1573 8.677 18.435 -7.568 1.00 0.00 H new ATOM 0 HZ2 LYS A1573 7.424 17.366 -7.981 1.00 0.00 H new ATOM 0 HZ3 LYS A1573 7.431 18.118 -6.459 1.00 0.00 H new ATOM 741 N ASN A1574 9.628 11.263 -4.584 1.00 0.00 N ATOM 742 CA ASN A1574 10.250 10.898 -3.322 1.00 0.00 C ATOM 743 C ASN A1574 10.726 9.467 -3.347 1.00 0.00 C ATOM 744 O ASN A1574 11.609 9.081 -2.582 1.00 0.00 O ATOM 745 CB ASN A1574 9.291 11.089 -2.137 1.00 0.00 C ATOM 746 CG ASN A1574 8.976 12.536 -1.807 1.00 0.00 C ATOM 747 OD1 ASN A1574 9.766 13.441 -2.084 1.00 0.00 O ATOM 748 ND2 ASN A1574 7.848 12.764 -1.173 1.00 0.00 N ATOM 0 H ASN A1574 8.623 11.092 -4.619 1.00 0.00 H new ATOM 0 HA ASN A1574 11.104 11.563 -3.190 1.00 0.00 H new ATOM 0 HB2 ASN A1574 8.358 10.568 -2.354 1.00 0.00 H new ATOM 0 HB3 ASN A1574 9.724 10.615 -1.256 1.00 0.00 H new ATOM 0 HD21 ASN A1574 7.603 13.714 -0.894 1.00 0.00 H new ATOM 0 HD22 ASN A1574 7.217 11.991 -0.960 1.00 0.00 H new ATOM 755 N CYS A1575 10.164 8.695 -4.225 1.00 0.00 N ATOM 756 CA CYS A1575 10.520 7.308 -4.356 1.00 0.00 C ATOM 757 C CYS A1575 10.629 7.055 -5.855 1.00 0.00 C ATOM 758 O CYS A1575 9.857 7.624 -6.609 1.00 0.00 O ATOM 759 CB CYS A1575 9.407 6.468 -3.704 1.00 0.00 C ATOM 760 SG CYS A1575 9.855 4.765 -3.285 1.00 0.00 S ATOM 0 H CYS A1575 9.442 9.006 -4.875 1.00 0.00 H new ATOM 0 HA CYS A1575 11.458 7.044 -3.867 1.00 0.00 H new ATOM 0 HB2 CYS A1575 9.081 6.973 -2.795 1.00 0.00 H new ATOM 0 HB3 CYS A1575 8.552 6.444 -4.379 1.00 0.00 H new ATOM 765 N PRO A1576 11.596 6.239 -6.303 1.00 0.00 N ATOM 766 CA PRO A1576 11.875 6.012 -7.738 1.00 0.00 C ATOM 767 C PRO A1576 10.700 5.511 -8.577 1.00 0.00 C ATOM 768 O PRO A1576 9.799 4.829 -8.092 1.00 0.00 O ATOM 769 CB PRO A1576 12.958 4.942 -7.718 1.00 0.00 C ATOM 770 CG PRO A1576 13.628 5.116 -6.410 1.00 0.00 C ATOM 771 CD PRO A1576 12.540 5.490 -5.455 1.00 0.00 C ATOM 0 HA PRO A1576 12.141 6.959 -8.207 1.00 0.00 H new ATOM 0 HB2 PRO A1576 12.531 3.944 -7.815 1.00 0.00 H new ATOM 0 HB3 PRO A1576 13.659 5.071 -8.543 1.00 0.00 H new ATOM 0 HG2 PRO A1576 14.126 4.198 -6.098 1.00 0.00 H new ATOM 0 HG3 PRO A1576 14.392 5.892 -6.460 1.00 0.00 H new ATOM 0 HD2 PRO A1576 12.073 4.611 -5.011 1.00 0.00 H new ATOM 0 HD3 PRO A1576 12.916 6.100 -4.634 1.00 0.00 H new ATOM 779 N SER A1577 10.737 5.844 -9.846 1.00 0.00 N ATOM 780 CA SER A1577 9.791 5.353 -10.793 1.00 0.00 C ATOM 781 C SER A1577 10.057 3.853 -10.976 1.00 0.00 C ATOM 782 O SER A1577 11.198 3.439 -11.269 1.00 0.00 O ATOM 783 CB SER A1577 10.005 6.102 -12.089 1.00 0.00 C ATOM 784 OG SER A1577 9.955 7.508 -11.865 1.00 0.00 O ATOM 0 H SER A1577 11.436 6.471 -10.244 1.00 0.00 H new ATOM 0 HA SER A1577 8.762 5.498 -10.465 1.00 0.00 H new ATOM 0 HB2 SER A1577 10.969 5.830 -12.518 1.00 0.00 H new ATOM 0 HB3 SER A1577 9.242 5.815 -12.812 1.00 0.00 H new ATOM 0 HG SER A1577 10.097 7.979 -12.712 1.00 0.00 H new ATOM 790 N GLY A1578 9.051 3.050 -10.757 1.00 0.00 N ATOM 791 CA GLY A1578 9.230 1.624 -10.800 1.00 0.00 C ATOM 792 C GLY A1578 9.352 1.068 -9.401 1.00 0.00 C ATOM 793 O GLY A1578 9.433 -0.144 -9.198 1.00 0.00 O ATOM 0 H GLY A1578 8.101 3.358 -10.548 1.00 0.00 H new ATOM 0 HA2 GLY A1578 8.386 1.160 -11.311 1.00 0.00 H new ATOM 0 HA3 GLY A1578 10.123 1.380 -11.375 1.00 0.00 H new ATOM 797 N VAL A1579 9.348 1.961 -8.434 1.00 0.00 N ATOM 798 CA VAL A1579 9.436 1.614 -7.049 1.00 0.00 C ATOM 799 C VAL A1579 8.164 2.077 -6.347 1.00 0.00 C ATOM 800 O VAL A1579 7.768 3.229 -6.475 1.00 0.00 O ATOM 801 CB VAL A1579 10.686 2.258 -6.412 1.00 0.00 C ATOM 802 CG1 VAL A1579 10.656 2.088 -4.932 1.00 0.00 C ATOM 803 CG2 VAL A1579 11.946 1.606 -6.959 1.00 0.00 C ATOM 0 H VAL A1579 9.282 2.965 -8.602 1.00 0.00 H new ATOM 0 HA VAL A1579 9.532 0.534 -6.942 1.00 0.00 H new ATOM 0 HB VAL A1579 10.687 3.320 -6.656 1.00 0.00 H new ATOM 0 HG11 VAL A1579 11.543 2.547 -4.495 1.00 0.00 H new ATOM 0 HG12 VAL A1579 9.764 2.567 -4.529 1.00 0.00 H new ATOM 0 HG13 VAL A1579 10.639 1.026 -4.688 1.00 0.00 H new ATOM 0 HG21 VAL A1579 12.822 2.068 -6.503 1.00 0.00 H new ATOM 0 HG22 VAL A1579 11.935 0.541 -6.727 1.00 0.00 H new ATOM 0 HG23 VAL A1579 11.986 1.741 -8.040 1.00 0.00 H new ATOM 813 N GLY A1580 7.506 1.169 -5.671 1.00 0.00 N ATOM 814 CA GLY A1580 6.275 1.504 -5.013 1.00 0.00 C ATOM 815 C GLY A1580 6.521 1.956 -3.610 1.00 0.00 C ATOM 816 O GLY A1580 5.852 2.832 -3.111 1.00 0.00 O ATOM 0 H GLY A1580 7.802 0.199 -5.564 1.00 0.00 H new ATOM 0 HA2 GLY A1580 5.765 2.291 -5.568 1.00 0.00 H new ATOM 0 HA3 GLY A1580 5.614 0.637 -5.009 1.00 0.00 H new ATOM 820 N VAL A1581 7.473 1.346 -2.974 1.00 0.00 N ATOM 821 CA VAL A1581 7.845 1.679 -1.619 1.00 0.00 C ATOM 822 C VAL A1581 9.345 1.604 -1.498 1.00 0.00 C ATOM 823 O VAL A1581 9.955 0.722 -2.066 1.00 0.00 O ATOM 824 CB VAL A1581 7.165 0.712 -0.595 1.00 0.00 C ATOM 825 CG1 VAL A1581 7.782 0.840 0.769 1.00 0.00 C ATOM 826 CG2 VAL A1581 5.695 1.016 -0.485 1.00 0.00 C ATOM 0 H VAL A1581 8.026 0.591 -3.380 1.00 0.00 H new ATOM 0 HA VAL A1581 7.504 2.689 -1.391 1.00 0.00 H new ATOM 0 HB VAL A1581 7.312 -0.304 -0.961 1.00 0.00 H new ATOM 0 HG11 VAL A1581 7.287 0.155 1.458 1.00 0.00 H new ATOM 0 HG12 VAL A1581 8.843 0.595 0.713 1.00 0.00 H new ATOM 0 HG13 VAL A1581 7.664 1.863 1.127 1.00 0.00 H new ATOM 0 HG21 VAL A1581 5.235 0.335 0.231 1.00 0.00 H new ATOM 0 HG22 VAL A1581 5.560 2.043 -0.147 1.00 0.00 H new ATOM 0 HG23 VAL A1581 5.223 0.890 -1.460 1.00 0.00 H new ATOM 836 N CYS A1582 9.939 2.536 -0.810 1.00 0.00 N ATOM 837 CA CYS A1582 11.382 2.539 -0.646 1.00 0.00 C ATOM 838 C CYS A1582 11.806 3.229 0.643 1.00 0.00 C ATOM 839 O CYS A1582 11.268 4.255 1.001 1.00 0.00 O ATOM 840 CB CYS A1582 12.061 3.202 -1.858 1.00 0.00 C ATOM 841 SG CYS A1582 11.551 4.938 -2.165 1.00 0.00 S ATOM 0 H CYS A1582 9.456 3.307 -0.350 1.00 0.00 H new ATOM 0 HA CYS A1582 11.705 1.500 -0.583 1.00 0.00 H new ATOM 0 HB2 CYS A1582 13.141 3.175 -1.713 1.00 0.00 H new ATOM 0 HB3 CYS A1582 11.844 2.611 -2.748 1.00 0.00 H new ATOM 846 N PHE A1583 12.757 2.643 1.355 1.00 0.00 N ATOM 847 CA PHE A1583 13.304 3.264 2.552 1.00 0.00 C ATOM 848 C PHE A1583 13.980 4.565 2.171 1.00 0.00 C ATOM 849 O PHE A1583 14.617 4.651 1.140 1.00 0.00 O ATOM 850 CB PHE A1583 14.304 2.353 3.273 1.00 0.00 C ATOM 851 CG PHE A1583 13.703 1.191 4.023 1.00 0.00 C ATOM 852 CD1 PHE A1583 13.305 0.037 3.367 1.00 0.00 C ATOM 853 CD2 PHE A1583 13.566 1.251 5.401 1.00 0.00 C ATOM 854 CE1 PHE A1583 12.781 -1.029 4.069 1.00 0.00 C ATOM 855 CE2 PHE A1583 13.041 0.188 6.108 1.00 0.00 C ATOM 856 CZ PHE A1583 12.649 -0.954 5.442 1.00 0.00 C ATOM 0 H PHE A1583 13.166 1.738 1.124 1.00 0.00 H new ATOM 0 HA PHE A1583 12.480 3.449 3.241 1.00 0.00 H new ATOM 0 HB2 PHE A1583 15.008 1.963 2.538 1.00 0.00 H new ATOM 0 HB3 PHE A1583 14.878 2.958 3.975 1.00 0.00 H new ATOM 0 HD1 PHE A1583 13.406 -0.029 2.294 1.00 0.00 H new ATOM 0 HD2 PHE A1583 13.874 2.141 5.929 1.00 0.00 H new ATOM 0 HE1 PHE A1583 12.474 -1.922 3.545 1.00 0.00 H new ATOM 0 HE2 PHE A1583 12.937 0.251 7.181 1.00 0.00 H new ATOM 0 HZ PHE A1583 12.240 -1.788 5.993 1.00 0.00 H new ATOM 866 N GLY A1584 13.873 5.528 3.016 1.00 0.00 N ATOM 867 CA GLY A1584 14.346 6.856 2.717 1.00 0.00 C ATOM 868 C GLY A1584 15.745 7.088 3.174 1.00 0.00 C ATOM 869 O GLY A1584 16.401 8.022 2.728 1.00 0.00 O ATOM 0 H GLY A1584 13.455 5.429 3.941 1.00 0.00 H new ATOM 0 HA2 GLY A1584 14.288 7.024 1.642 1.00 0.00 H new ATOM 0 HA3 GLY A1584 13.689 7.586 3.190 1.00 0.00 H new ATOM 873 N LEU A1585 16.202 6.242 4.063 1.00 0.00 N ATOM 874 CA LEU A1585 17.503 6.303 4.586 1.00 0.00 C ATOM 875 C LEU A1585 18.535 6.025 3.516 1.00 0.00 C ATOM 876 O LEU A1585 19.207 6.930 3.015 1.00 0.00 O ATOM 877 CB LEU A1585 17.628 5.250 5.646 1.00 0.00 C ATOM 878 CG LEU A1585 16.950 5.473 6.973 1.00 0.00 C ATOM 879 CD1 LEU A1585 17.191 4.254 7.829 1.00 0.00 C ATOM 880 CD2 LEU A1585 17.502 6.717 7.655 1.00 0.00 C ATOM 0 H LEU A1585 15.645 5.476 4.441 1.00 0.00 H new ATOM 0 HA LEU A1585 17.676 7.302 4.987 1.00 0.00 H new ATOM 0 HB2 LEU A1585 17.245 4.317 5.232 1.00 0.00 H new ATOM 0 HB3 LEU A1585 18.690 5.100 5.839 1.00 0.00 H new ATOM 0 HG LEU A1585 15.881 5.625 6.825 1.00 0.00 H new ATOM 0 HD11 LEU A1585 16.710 4.389 8.798 1.00 0.00 H new ATOM 0 HD12 LEU A1585 16.775 3.375 7.336 1.00 0.00 H new ATOM 0 HD13 LEU A1585 18.263 4.116 7.972 1.00 0.00 H new ATOM 0 HD21 LEU A1585 17.000 6.861 8.612 1.00 0.00 H new ATOM 0 HD22 LEU A1585 18.572 6.596 7.822 1.00 0.00 H new ATOM 0 HD23 LEU A1585 17.330 7.586 7.021 1.00 0.00 H new ATOM 892 N THR A1586 18.623 4.780 3.142 1.00 0.00 N ATOM 893 CA THR A1586 19.623 4.351 2.223 1.00 0.00 C ATOM 894 C THR A1586 18.987 3.947 0.887 1.00 0.00 C ATOM 895 O THR A1586 19.616 3.292 0.046 1.00 0.00 O ATOM 896 CB THR A1586 20.435 3.186 2.842 1.00 0.00 C ATOM 897 OG1 THR A1586 19.570 2.088 3.028 1.00 0.00 O ATOM 898 CG2 THR A1586 20.956 3.568 4.220 1.00 0.00 C ATOM 0 H THR A1586 18.002 4.040 3.468 1.00 0.00 H new ATOM 0 HA THR A1586 20.307 5.176 2.022 1.00 0.00 H new ATOM 0 HB THR A1586 21.265 2.952 2.176 1.00 0.00 H new ATOM 0 HG1 THR A1586 20.097 1.266 3.107 1.00 0.00 H new ATOM 0 HG21 THR A1586 21.524 2.736 4.638 1.00 0.00 H new ATOM 0 HG22 THR A1586 21.602 4.442 4.135 1.00 0.00 H new ATOM 0 HG23 THR A1586 20.116 3.800 4.875 1.00 0.00 H new ATOM 906 N LYS A1587 17.732 4.395 0.706 1.00 0.00 N ATOM 907 CA LYS A1587 16.940 4.181 -0.510 1.00 0.00 C ATOM 908 C LYS A1587 16.832 2.715 -0.873 1.00 0.00 C ATOM 909 O LYS A1587 17.475 2.222 -1.804 1.00 0.00 O ATOM 910 CB LYS A1587 17.407 5.055 -1.682 1.00 0.00 C ATOM 911 CG LYS A1587 17.374 6.553 -1.376 1.00 0.00 C ATOM 912 CD LYS A1587 15.978 7.014 -0.970 1.00 0.00 C ATOM 913 CE LYS A1587 15.946 8.494 -0.611 1.00 0.00 C ATOM 914 NZ LYS A1587 16.314 9.350 -1.751 1.00 0.00 N1+ ATOM 0 H LYS A1587 17.233 4.927 1.419 1.00 0.00 H new ATOM 0 HA LYS A1587 15.927 4.512 -0.281 1.00 0.00 H new ATOM 0 HB2 LYS A1587 18.423 4.770 -1.955 1.00 0.00 H new ATOM 0 HB3 LYS A1587 16.776 4.855 -2.548 1.00 0.00 H new ATOM 0 HG2 LYS A1587 18.079 6.777 -0.575 1.00 0.00 H new ATOM 0 HG3 LYS A1587 17.701 7.111 -2.253 1.00 0.00 H new ATOM 0 HD2 LYS A1587 15.282 6.824 -1.787 1.00 0.00 H new ATOM 0 HD3 LYS A1587 15.636 6.427 -0.117 1.00 0.00 H new ATOM 0 HE2 LYS A1587 14.947 8.761 -0.266 1.00 0.00 H new ATOM 0 HE3 LYS A1587 16.630 8.680 0.217 1.00 0.00 H new ATOM 0 HZ1 LYS A1587 16.133 10.345 -1.510 1.00 0.00 H new ATOM 0 HZ2 LYS A1587 17.323 9.224 -1.968 1.00 0.00 H new ATOM 0 HZ3 LYS A1587 15.746 9.086 -2.581 1.00 0.00 H new ATOM 928 N ILE A1588 16.112 2.006 -0.041 1.00 0.00 N ATOM 929 CA ILE A1588 15.904 0.587 -0.210 1.00 0.00 C ATOM 930 C ILE A1588 14.510 0.328 -0.712 1.00 0.00 C ATOM 931 O ILE A1588 13.570 0.451 0.065 1.00 0.00 O ATOM 932 CB ILE A1588 16.020 -0.101 1.134 1.00 0.00 C ATOM 933 CG1 ILE A1588 17.243 0.404 1.861 1.00 0.00 C ATOM 934 CG2 ILE A1588 16.145 -1.588 0.891 1.00 0.00 C ATOM 935 CD1 ILE A1588 17.259 0.084 3.323 1.00 0.00 C ATOM 0 H ILE A1588 15.650 2.398 0.779 1.00 0.00 H new ATOM 0 HA ILE A1588 16.646 0.213 -0.915 1.00 0.00 H new ATOM 0 HB ILE A1588 15.141 0.109 1.744 1.00 0.00 H new ATOM 0 HG12 ILE A1588 18.131 -0.024 1.396 1.00 0.00 H new ATOM 0 HG13 ILE A1588 17.307 1.485 1.736 1.00 0.00 H new ATOM 0 HG21 ILE A1588 16.230 -2.107 1.846 1.00 0.00 H new ATOM 0 HG22 ILE A1588 15.262 -1.946 0.361 1.00 0.00 H new ATOM 0 HG23 ILE A1588 17.033 -1.785 0.291 1.00 0.00 H new ATOM 0 HD11 ILE A1588 18.169 0.481 3.772 1.00 0.00 H new ATOM 0 HD12 ILE A1588 16.391 0.535 3.804 1.00 0.00 H new ATOM 0 HD13 ILE A1588 17.228 -0.997 3.459 1.00 0.00 H new ATOM 947 N ASN A1589 14.356 0.100 -1.997 1.00 0.00 N ATOM 948 CA ASN A1589 13.062 -0.307 -2.565 1.00 0.00 C ATOM 949 C ASN A1589 12.471 -1.473 -1.764 1.00 0.00 C ATOM 950 O ASN A1589 12.944 -2.588 -1.802 1.00 0.00 O ATOM 951 CB ASN A1589 13.192 -0.643 -4.076 1.00 0.00 C ATOM 952 CG ASN A1589 11.949 -1.288 -4.689 1.00 0.00 C ATOM 953 OD1 ASN A1589 10.850 -1.101 -4.228 1.00 0.00 O ATOM 954 ND2 ASN A1589 12.123 -2.003 -5.768 1.00 0.00 N ATOM 0 H ASN A1589 15.106 0.186 -2.683 1.00 0.00 H new ATOM 0 HA ASN A1589 12.370 0.531 -2.488 1.00 0.00 H new ATOM 0 HB2 ASN A1589 13.417 0.273 -4.621 1.00 0.00 H new ATOM 0 HB3 ASN A1589 14.040 -1.313 -4.215 1.00 0.00 H new ATOM 0 HD21 ASN A1589 11.320 -2.418 -6.240 1.00 0.00 H new ATOM 0 HD22 ASN A1589 13.062 -2.147 -6.139 1.00 0.00 H new ATOM 961 N ALA A1590 11.457 -1.176 -1.039 1.00 0.00 N ATOM 962 CA ALA A1590 10.846 -2.102 -0.142 1.00 0.00 C ATOM 963 C ALA A1590 9.640 -2.755 -0.775 1.00 0.00 C ATOM 964 O ALA A1590 8.888 -3.432 -0.116 1.00 0.00 O ATOM 965 CB ALA A1590 10.469 -1.402 1.149 1.00 0.00 C ATOM 0 H ALA A1590 11.012 -0.258 -1.049 1.00 0.00 H new ATOM 0 HA ALA A1590 11.564 -2.890 0.086 1.00 0.00 H new ATOM 0 HB1 ALA A1590 10.003 -2.117 1.828 1.00 0.00 H new ATOM 0 HB2 ALA A1590 11.364 -0.990 1.614 1.00 0.00 H new ATOM 0 HB3 ALA A1590 9.768 -0.595 0.934 1.00 0.00 H new ATOM 971 N GLY A1591 9.470 -2.542 -2.045 1.00 0.00 N ATOM 972 CA GLY A1591 8.386 -3.156 -2.765 1.00 0.00 C ATOM 973 C GLY A1591 8.164 -2.466 -4.072 1.00 0.00 C ATOM 974 O GLY A1591 7.995 -1.239 -4.104 1.00 0.00 O ATOM 0 H GLY A1591 10.071 -1.943 -2.611 1.00 0.00 H new ATOM 0 HA2 GLY A1591 8.607 -4.209 -2.937 1.00 0.00 H new ATOM 0 HA3 GLY A1591 7.476 -3.115 -2.167 1.00 0.00 H new ATOM 978 N SER A1592 8.156 -3.208 -5.156 1.00 0.00 N ATOM 979 CA SER A1592 8.051 -2.580 -6.435 1.00 0.00 C ATOM 980 C SER A1592 6.672 -2.135 -6.771 1.00 0.00 C ATOM 981 O SER A1592 5.677 -2.724 -6.361 1.00 0.00 O ATOM 982 CB SER A1592 8.625 -3.399 -7.574 1.00 0.00 C ATOM 983 OG SER A1592 10.036 -3.572 -7.417 1.00 0.00 O ATOM 0 H SER A1592 8.220 -4.226 -5.171 1.00 0.00 H new ATOM 0 HA SER A1592 8.672 -1.690 -6.328 1.00 0.00 H new ATOM 0 HB2 SER A1592 8.137 -4.373 -7.609 1.00 0.00 H new ATOM 0 HB3 SER A1592 8.418 -2.904 -8.523 1.00 0.00 H new ATOM 0 HG SER A1592 10.218 -4.466 -7.060 1.00 0.00 H new ATOM 989 N TRP A1593 6.686 -1.070 -7.497 1.00 0.00 N ATOM 990 CA TRP A1593 5.569 -0.362 -8.080 1.00 0.00 C ATOM 991 C TRP A1593 4.538 -1.340 -8.637 1.00 0.00 C ATOM 992 O TRP A1593 4.858 -2.135 -9.523 1.00 0.00 O ATOM 993 CB TRP A1593 6.182 0.319 -9.248 1.00 0.00 C ATOM 994 CG TRP A1593 5.665 1.629 -9.648 1.00 0.00 C ATOM 995 CD1 TRP A1593 6.056 2.811 -9.125 1.00 0.00 C ATOM 996 CD2 TRP A1593 4.733 1.929 -10.681 1.00 0.00 C ATOM 997 NE1 TRP A1593 5.463 3.830 -9.760 1.00 0.00 N ATOM 998 CE2 TRP A1593 4.615 3.326 -10.724 1.00 0.00 C ATOM 999 CE3 TRP A1593 3.986 1.159 -11.574 1.00 0.00 C ATOM 1000 CZ2 TRP A1593 3.781 3.974 -11.626 1.00 0.00 C ATOM 1001 CZ3 TRP A1593 3.156 1.804 -12.466 1.00 0.00 C ATOM 1002 CH2 TRP A1593 3.061 3.199 -12.486 1.00 0.00 C ATOM 0 H TRP A1593 7.569 -0.616 -7.728 1.00 0.00 H new ATOM 0 HA TRP A1593 5.076 0.287 -7.357 1.00 0.00 H new ATOM 0 HB2 TRP A1593 7.247 0.432 -9.044 1.00 0.00 H new ATOM 0 HB3 TRP A1593 6.091 -0.348 -10.105 1.00 0.00 H new ATOM 0 HD1 TRP A1593 6.752 2.920 -8.306 1.00 0.00 H new ATOM 0 HE1 TRP A1593 5.614 4.819 -9.563 1.00 0.00 H new ATOM 0 HE3 TRP A1593 4.057 0.081 -11.566 1.00 0.00 H new ATOM 0 HZ2 TRP A1593 3.706 5.051 -11.645 1.00 0.00 H new ATOM 0 HZ3 TRP A1593 2.569 1.222 -13.161 1.00 0.00 H new ATOM 0 HH2 TRP A1593 2.402 3.673 -13.199 1.00 0.00 H new ATOM 1013 N ASN A1594 3.325 -1.255 -8.165 1.00 0.00 N ATOM 1014 CA ASN A1594 2.246 -2.152 -8.597 1.00 0.00 C ATOM 1015 C ASN A1594 0.915 -1.455 -8.501 1.00 0.00 C ATOM 1016 O ASN A1594 0.804 -0.381 -7.914 1.00 0.00 O ATOM 1017 CB ASN A1594 2.138 -3.463 -7.750 1.00 0.00 C ATOM 1018 CG ASN A1594 3.199 -4.504 -7.965 1.00 0.00 C ATOM 1019 OD1 ASN A1594 3.794 -4.611 -9.032 1.00 0.00 O ATOM 1020 ND2 ASN A1594 3.370 -5.346 -6.977 1.00 0.00 N ATOM 0 H ASN A1594 3.039 -0.567 -7.469 1.00 0.00 H new ATOM 0 HA ASN A1594 2.495 -2.421 -9.623 1.00 0.00 H new ATOM 0 HB2 ASN A1594 2.144 -3.186 -6.696 1.00 0.00 H new ATOM 0 HB3 ASN A1594 1.169 -3.919 -7.954 1.00 0.00 H new ATOM 0 HD21 ASN A1594 4.018 -6.127 -7.079 1.00 0.00 H new ATOM 0 HD22 ASN A1594 2.855 -5.221 -6.105 1.00 0.00 H new ATOM 1027 N SER A1595 -0.083 -2.081 -9.059 1.00 0.00 N ATOM 1028 CA SER A1595 -1.451 -1.646 -8.957 1.00 0.00 C ATOM 1029 C SER A1595 -2.267 -2.815 -8.391 1.00 0.00 C ATOM 1030 O SER A1595 -3.502 -2.874 -8.507 1.00 0.00 O ATOM 1031 CB SER A1595 -1.967 -1.250 -10.342 1.00 0.00 C ATOM 1032 OG SER A1595 -1.684 -2.258 -11.300 1.00 0.00 O ATOM 0 H SER A1595 0.034 -2.930 -9.612 1.00 0.00 H new ATOM 0 HA SER A1595 -1.539 -0.778 -8.303 1.00 0.00 H new ATOM 0 HB2 SER A1595 -3.042 -1.078 -10.297 1.00 0.00 H new ATOM 0 HB3 SER A1595 -1.507 -0.311 -10.650 1.00 0.00 H new ATOM 0 HG SER A1595 -2.025 -1.982 -12.176 1.00 0.00 H new ATOM 1038 N GLN A1596 -1.547 -3.730 -7.760 1.00 0.00 N ATOM 1039 CA GLN A1596 -2.090 -4.959 -7.213 1.00 0.00 C ATOM 1040 C GLN A1596 -2.861 -4.681 -5.937 1.00 0.00 C ATOM 1041 O GLN A1596 -2.280 -4.660 -4.852 1.00 0.00 O ATOM 1042 CB GLN A1596 -0.960 -5.960 -6.919 1.00 0.00 C ATOM 1043 CG GLN A1596 -0.119 -6.351 -8.111 1.00 0.00 C ATOM 1044 CD GLN A1596 -0.924 -7.113 -9.103 1.00 0.00 C ATOM 1045 OE1 GLN A1596 -1.017 -8.328 -9.032 1.00 0.00 O ATOM 1046 NE2 GLN A1596 -1.489 -6.429 -10.039 1.00 0.00 N ATOM 0 H GLN A1596 -0.542 -3.633 -7.612 1.00 0.00 H new ATOM 0 HA GLN A1596 -2.767 -5.387 -7.952 1.00 0.00 H new ATOM 0 HB2 GLN A1596 -0.307 -5.532 -6.159 1.00 0.00 H new ATOM 0 HB3 GLN A1596 -1.398 -6.862 -6.492 1.00 0.00 H new ATOM 0 HG2 GLN A1596 0.292 -5.457 -8.580 1.00 0.00 H new ATOM 0 HG3 GLN A1596 0.726 -6.955 -7.782 1.00 0.00 H new ATOM 0 HE21 GLN A1596 -1.386 -5.414 -10.062 1.00 0.00 H new ATOM 0 HE22 GLN A1596 -2.038 -6.903 -10.756 1.00 0.00 H new ATOM 1055 N LEU A1597 -4.137 -4.413 -6.075 1.00 0.00 N ATOM 1056 CA LEU A1597 -4.973 -4.125 -4.946 1.00 0.00 C ATOM 1057 C LEU A1597 -5.924 -5.246 -4.706 1.00 0.00 C ATOM 1058 O LEU A1597 -6.433 -5.851 -5.639 1.00 0.00 O ATOM 1059 CB LEU A1597 -5.763 -2.849 -5.148 1.00 0.00 C ATOM 1060 CG LEU A1597 -6.632 -2.438 -3.955 1.00 0.00 C ATOM 1061 CD1 LEU A1597 -5.797 -2.144 -2.725 1.00 0.00 C ATOM 1062 CD2 LEU A1597 -7.444 -1.261 -4.303 1.00 0.00 C ATOM 0 H LEU A1597 -4.620 -4.390 -6.973 1.00 0.00 H new ATOM 0 HA LEU A1597 -4.318 -3.999 -4.084 1.00 0.00 H new ATOM 0 HB2 LEU A1597 -5.068 -2.039 -5.370 1.00 0.00 H new ATOM 0 HB3 LEU A1597 -6.403 -2.969 -6.022 1.00 0.00 H new ATOM 0 HG LEU A1597 -7.287 -3.277 -3.720 1.00 0.00 H new ATOM 0 HD11 LEU A1597 -6.451 -1.856 -1.902 1.00 0.00 H new ATOM 0 HD12 LEU A1597 -5.233 -3.034 -2.447 1.00 0.00 H new ATOM 0 HD13 LEU A1597 -5.106 -1.330 -2.941 1.00 0.00 H new ATOM 0 HD21 LEU A1597 -8.058 -0.977 -3.448 1.00 0.00 H new ATOM 0 HD22 LEU A1597 -6.788 -0.432 -4.570 1.00 0.00 H new ATOM 0 HD23 LEU A1597 -8.088 -1.501 -5.149 1.00 0.00 H new ATOM 1074 N MET A1598 -6.129 -5.529 -3.469 1.00 0.00 N ATOM 1075 CA MET A1598 -7.060 -6.532 -3.036 1.00 0.00 C ATOM 1076 C MET A1598 -7.838 -5.999 -1.861 1.00 0.00 C ATOM 1077 O MET A1598 -7.605 -4.892 -1.435 1.00 0.00 O ATOM 1078 CB MET A1598 -6.334 -7.821 -2.689 1.00 0.00 C ATOM 1079 CG MET A1598 -5.772 -8.532 -3.907 1.00 0.00 C ATOM 1080 SD MET A1598 -4.136 -9.201 -3.602 1.00 0.00 S ATOM 1081 CE MET A1598 -3.244 -7.664 -3.295 1.00 0.00 C ATOM 0 H MET A1598 -5.645 -5.062 -2.702 1.00 0.00 H new ATOM 0 HA MET A1598 -7.756 -6.765 -3.842 1.00 0.00 H new ATOM 0 HB2 MET A1598 -5.521 -7.599 -1.998 1.00 0.00 H new ATOM 0 HB3 MET A1598 -7.020 -8.490 -2.170 1.00 0.00 H new ATOM 0 HG2 MET A1598 -6.445 -9.339 -4.198 1.00 0.00 H new ATOM 0 HG3 MET A1598 -5.728 -7.836 -4.745 1.00 0.00 H new ATOM 0 HE1 MET A1598 -2.225 -7.754 -3.670 1.00 0.00 H new ATOM 0 HE2 MET A1598 -3.748 -6.843 -3.805 1.00 0.00 H new ATOM 0 HE3 MET A1598 -3.220 -7.465 -2.224 1.00 0.00 H new ATOM 1091 N TYR A1599 -8.748 -6.777 -1.369 1.00 0.00 N ATOM 1092 CA TYR A1599 -9.630 -6.408 -0.294 1.00 0.00 C ATOM 1093 C TYR A1599 -9.764 -7.612 0.593 1.00 0.00 C ATOM 1094 O TYR A1599 -10.500 -8.550 0.297 1.00 0.00 O ATOM 1095 CB TYR A1599 -10.988 -5.986 -0.865 1.00 0.00 C ATOM 1096 CG TYR A1599 -11.976 -5.549 0.165 1.00 0.00 C ATOM 1097 CD1 TYR A1599 -11.699 -4.484 0.987 1.00 0.00 C ATOM 1098 CD2 TYR A1599 -13.175 -6.211 0.325 1.00 0.00 C ATOM 1099 CE1 TYR A1599 -12.584 -4.078 1.947 1.00 0.00 C ATOM 1100 CE2 TYR A1599 -14.081 -5.815 1.289 1.00 0.00 C ATOM 1101 CZ TYR A1599 -13.781 -4.745 2.099 1.00 0.00 C ATOM 1102 OH TYR A1599 -14.672 -4.340 3.080 1.00 0.00 O ATOM 0 H TYR A1599 -8.908 -7.724 -1.714 1.00 0.00 H new ATOM 0 HA TYR A1599 -9.240 -5.565 0.276 1.00 0.00 H new ATOM 0 HB2 TYR A1599 -10.834 -5.172 -1.573 1.00 0.00 H new ATOM 0 HB3 TYR A1599 -11.409 -6.821 -1.425 1.00 0.00 H new ATOM 0 HD1 TYR A1599 -10.763 -3.957 0.873 1.00 0.00 H new ATOM 0 HD2 TYR A1599 -13.409 -7.051 -0.312 1.00 0.00 H new ATOM 0 HE1 TYR A1599 -12.346 -3.238 2.583 1.00 0.00 H new ATOM 0 HE2 TYR A1599 -15.017 -6.341 1.406 1.00 0.00 H new ATOM 0 HH TYR A1599 -15.468 -4.912 3.056 1.00 0.00 H new ATOM 1112 N VAL A1600 -9.010 -7.604 1.615 1.00 0.00 N ATOM 1113 CA VAL A1600 -8.876 -8.701 2.504 1.00 0.00 C ATOM 1114 C VAL A1600 -8.961 -8.207 3.953 1.00 0.00 C ATOM 1115 O VAL A1600 -8.223 -7.297 4.357 1.00 0.00 O ATOM 1116 CB VAL A1600 -7.525 -9.431 2.205 1.00 0.00 C ATOM 1117 CG1 VAL A1600 -6.343 -8.445 2.120 1.00 0.00 C ATOM 1118 CG2 VAL A1600 -7.263 -10.535 3.219 1.00 0.00 C ATOM 0 H VAL A1600 -8.439 -6.800 1.875 1.00 0.00 H new ATOM 0 HA VAL A1600 -9.687 -9.415 2.360 1.00 0.00 H new ATOM 0 HB VAL A1600 -7.617 -9.897 1.224 1.00 0.00 H new ATOM 0 HG11 VAL A1600 -5.425 -8.994 1.911 1.00 0.00 H new ATOM 0 HG12 VAL A1600 -6.525 -7.726 1.321 1.00 0.00 H new ATOM 0 HG13 VAL A1600 -6.241 -7.916 3.068 1.00 0.00 H new ATOM 0 HG21 VAL A1600 -6.318 -11.025 2.987 1.00 0.00 H new ATOM 0 HG22 VAL A1600 -7.213 -10.106 4.220 1.00 0.00 H new ATOM 0 HG23 VAL A1600 -8.071 -11.266 3.178 1.00 0.00 H new ATOM 1128 N ASP A1601 -9.896 -8.784 4.702 1.00 0.00 N ATOM 1129 CA ASP A1601 -10.182 -8.442 6.107 1.00 0.00 C ATOM 1130 C ASP A1601 -10.727 -7.040 6.237 1.00 0.00 C ATOM 1131 O ASP A1601 -10.417 -6.311 7.205 1.00 0.00 O ATOM 1132 CB ASP A1601 -8.942 -8.580 6.982 1.00 0.00 C ATOM 1133 CG ASP A1601 -8.485 -10.002 7.171 1.00 0.00 C ATOM 1134 OD1 ASP A1601 -9.174 -10.787 7.862 1.00 0.00 O1- ATOM 1135 OD2 ASP A1601 -7.426 -10.376 6.610 1.00 0.00 O ATOM 0 H ASP A1601 -10.498 -9.526 4.345 1.00 0.00 H new ATOM 0 HA ASP A1601 -10.937 -9.150 6.449 1.00 0.00 H new ATOM 0 HB2 ASP A1601 -8.130 -8.004 6.538 1.00 0.00 H new ATOM 0 HB3 ASP A1601 -9.148 -8.142 7.959 1.00 0.00 H new ATOM 1140 N GLN A1602 -11.566 -6.674 5.272 1.00 0.00 N ATOM 1141 CA GLN A1602 -12.197 -5.350 5.171 1.00 0.00 C ATOM 1142 C GLN A1602 -11.150 -4.282 4.926 1.00 0.00 C ATOM 1143 O GLN A1602 -11.409 -3.074 5.035 1.00 0.00 O ATOM 1144 CB GLN A1602 -13.064 -5.027 6.391 1.00 0.00 C ATOM 1145 CG GLN A1602 -14.265 -5.940 6.547 1.00 0.00 C ATOM 1146 CD GLN A1602 -15.088 -5.606 7.761 1.00 0.00 C ATOM 1147 OE1 GLN A1602 -14.870 -6.138 8.843 1.00 0.00 O ATOM 1148 NE2 GLN A1602 -16.025 -4.713 7.604 1.00 0.00 N ATOM 0 H GLN A1602 -11.837 -7.303 4.516 1.00 0.00 H new ATOM 0 HA GLN A1602 -12.871 -5.368 4.315 1.00 0.00 H new ATOM 0 HB2 GLN A1602 -12.450 -5.093 7.289 1.00 0.00 H new ATOM 0 HB3 GLN A1602 -13.410 -3.996 6.317 1.00 0.00 H new ATOM 0 HG2 GLN A1602 -14.890 -5.868 5.657 1.00 0.00 H new ATOM 0 HG3 GLN A1602 -13.925 -6.973 6.615 1.00 0.00 H new ATOM 0 HE21 GLN A1602 -16.179 -4.291 6.688 1.00 0.00 H new ATOM 0 HE22 GLN A1602 -16.604 -4.437 8.397 1.00 0.00 H new ATOM 1157 N VAL A1603 -9.990 -4.737 4.554 1.00 0.00 N ATOM 1158 CA VAL A1603 -8.867 -3.909 4.285 1.00 0.00 C ATOM 1159 C VAL A1603 -8.391 -4.091 2.844 1.00 0.00 C ATOM 1160 O VAL A1603 -8.178 -5.201 2.378 1.00 0.00 O ATOM 1161 CB VAL A1603 -7.739 -4.252 5.300 1.00 0.00 C ATOM 1162 CG1 VAL A1603 -6.422 -3.704 4.861 1.00 0.00 C ATOM 1163 CG2 VAL A1603 -8.062 -3.630 6.624 1.00 0.00 C ATOM 0 H VAL A1603 -9.800 -5.731 4.427 1.00 0.00 H new ATOM 0 HA VAL A1603 -9.147 -2.862 4.400 1.00 0.00 H new ATOM 0 HB VAL A1603 -7.676 -5.338 5.368 1.00 0.00 H new ATOM 0 HG11 VAL A1603 -5.658 -3.963 5.594 1.00 0.00 H new ATOM 0 HG12 VAL A1603 -6.155 -4.129 3.893 1.00 0.00 H new ATOM 0 HG13 VAL A1603 -6.490 -2.620 4.775 1.00 0.00 H new ATOM 0 HG21 VAL A1603 -7.275 -3.867 7.339 1.00 0.00 H new ATOM 0 HG22 VAL A1603 -8.135 -2.548 6.510 1.00 0.00 H new ATOM 0 HG23 VAL A1603 -9.012 -4.021 6.988 1.00 0.00 H new ATOM 1173 N LEU A1604 -8.254 -2.998 2.154 1.00 0.00 N ATOM 1174 CA LEU A1604 -7.730 -2.980 0.804 1.00 0.00 C ATOM 1175 C LEU A1604 -6.257 -3.180 0.977 1.00 0.00 C ATOM 1176 O LEU A1604 -5.687 -2.628 1.891 1.00 0.00 O ATOM 1177 CB LEU A1604 -7.956 -1.595 0.178 1.00 0.00 C ATOM 1178 CG LEU A1604 -9.360 -1.216 -0.282 1.00 0.00 C ATOM 1179 CD1 LEU A1604 -10.383 -1.388 0.795 1.00 0.00 C ATOM 1180 CD2 LEU A1604 -9.347 0.203 -0.735 1.00 0.00 C ATOM 0 H LEU A1604 -8.504 -2.076 2.511 1.00 0.00 H new ATOM 0 HA LEU A1604 -8.202 -3.729 0.169 1.00 0.00 H new ATOM 0 HB2 LEU A1604 -7.634 -0.848 0.904 1.00 0.00 H new ATOM 0 HB3 LEU A1604 -7.293 -1.510 -0.683 1.00 0.00 H new ATOM 0 HG LEU A1604 -9.638 -1.885 -1.097 1.00 0.00 H new ATOM 0 HD11 LEU A1604 -11.364 -1.104 0.414 1.00 0.00 H new ATOM 0 HD12 LEU A1604 -10.405 -2.430 1.113 1.00 0.00 H new ATOM 0 HD13 LEU A1604 -10.127 -0.755 1.645 1.00 0.00 H new ATOM 0 HD21 LEU A1604 -10.345 0.488 -1.067 1.00 0.00 H new ATOM 0 HD22 LEU A1604 -9.042 0.846 0.091 1.00 0.00 H new ATOM 0 HD23 LEU A1604 -8.644 0.315 -1.561 1.00 0.00 H new ATOM 1192 N GLN A1605 -5.639 -3.972 0.197 1.00 0.00 N ATOM 1193 CA GLN A1605 -4.272 -4.212 0.443 1.00 0.00 C ATOM 1194 C GLN A1605 -3.482 -4.233 -0.827 1.00 0.00 C ATOM 1195 O GLN A1605 -3.836 -4.933 -1.770 1.00 0.00 O ATOM 1196 CB GLN A1605 -4.142 -5.499 1.250 1.00 0.00 C ATOM 1197 CG GLN A1605 -2.759 -5.835 1.695 1.00 0.00 C ATOM 1198 CD GLN A1605 -2.750 -6.874 2.785 1.00 0.00 C ATOM 1199 OE1 GLN A1605 -1.835 -7.685 2.870 1.00 0.00 O ATOM 1200 NE2 GLN A1605 -3.730 -6.818 3.671 1.00 0.00 N ATOM 0 H GLN A1605 -6.044 -4.459 -0.603 1.00 0.00 H new ATOM 0 HA GLN A1605 -3.849 -3.396 1.029 1.00 0.00 H new ATOM 0 HB2 GLN A1605 -4.781 -5.423 2.130 1.00 0.00 H new ATOM 0 HB3 GLN A1605 -4.524 -6.325 0.650 1.00 0.00 H new ATOM 0 HG2 GLN A1605 -2.183 -6.199 0.844 1.00 0.00 H new ATOM 0 HG3 GLN A1605 -2.264 -4.932 2.052 1.00 0.00 H new ATOM 0 HE21 GLN A1605 -4.474 -6.128 3.566 1.00 0.00 H new ATOM 0 HE22 GLN A1605 -3.742 -7.464 4.460 1.00 0.00 H new ATOM 1209 N LEU A1606 -2.464 -3.408 -0.872 1.00 0.00 N ATOM 1210 CA LEU A1606 -1.554 -3.379 -1.989 1.00 0.00 C ATOM 1211 C LEU A1606 -0.336 -4.159 -1.613 1.00 0.00 C ATOM 1212 O LEU A1606 0.304 -3.869 -0.592 1.00 0.00 O ATOM 1213 CB LEU A1606 -1.110 -1.945 -2.348 1.00 0.00 C ATOM 1214 CG LEU A1606 -2.142 -0.999 -2.961 1.00 0.00 C ATOM 1215 CD1 LEU A1606 -1.533 0.374 -3.154 1.00 0.00 C ATOM 1216 CD2 LEU A1606 -2.618 -1.525 -4.291 1.00 0.00 C ATOM 0 H LEU A1606 -2.244 -2.738 -0.135 1.00 0.00 H new ATOM 0 HA LEU A1606 -2.067 -3.800 -2.854 1.00 0.00 H new ATOM 0 HB2 LEU A1606 -0.729 -1.478 -1.440 1.00 0.00 H new ATOM 0 HB3 LEU A1606 -0.274 -2.020 -3.043 1.00 0.00 H new ATOM 0 HG LEU A1606 -2.992 -0.931 -2.282 1.00 0.00 H new ATOM 0 HD11 LEU A1606 -2.274 1.043 -3.591 1.00 0.00 H new ATOM 0 HD12 LEU A1606 -1.212 0.769 -2.190 1.00 0.00 H new ATOM 0 HD13 LEU A1606 -0.673 0.300 -3.820 1.00 0.00 H new ATOM 0 HD21 LEU A1606 -3.352 -0.838 -4.712 1.00 0.00 H new ATOM 0 HD22 LEU A1606 -1.771 -1.613 -4.972 1.00 0.00 H new ATOM 0 HD23 LEU A1606 -3.075 -2.505 -4.152 1.00 0.00 H new ATOM 1228 N VAL A1607 -0.014 -5.123 -2.409 1.00 0.00 N ATOM 1229 CA VAL A1607 1.163 -5.910 -2.195 1.00 0.00 C ATOM 1230 C VAL A1607 2.190 -5.532 -3.232 1.00 0.00 C ATOM 1231 O VAL A1607 2.119 -5.946 -4.399 1.00 0.00 O ATOM 1232 CB VAL A1607 0.879 -7.435 -2.251 1.00 0.00 C ATOM 1233 CG1 VAL A1607 2.185 -8.237 -2.039 1.00 0.00 C ATOM 1234 CG2 VAL A1607 -0.138 -7.826 -1.182 1.00 0.00 C ATOM 0 H VAL A1607 -0.558 -5.391 -3.229 1.00 0.00 H new ATOM 0 HA VAL A1607 1.535 -5.701 -1.192 1.00 0.00 H new ATOM 0 HB VAL A1607 0.473 -7.669 -3.235 1.00 0.00 H new ATOM 0 HG11 VAL A1607 1.968 -9.304 -2.081 1.00 0.00 H new ATOM 0 HG12 VAL A1607 2.900 -7.981 -2.821 1.00 0.00 H new ATOM 0 HG13 VAL A1607 2.609 -7.991 -1.065 1.00 0.00 H new ATOM 0 HG21 VAL A1607 -0.327 -8.898 -1.234 1.00 0.00 H new ATOM 0 HG22 VAL A1607 0.255 -7.574 -0.197 1.00 0.00 H new ATOM 0 HG23 VAL A1607 -1.069 -7.285 -1.351 1.00 0.00 H new ATOM 1244 N TYR A1608 3.048 -4.656 -2.845 1.00 0.00 N ATOM 1245 CA TYR A1608 4.154 -4.259 -3.661 1.00 0.00 C ATOM 1246 C TYR A1608 5.243 -5.269 -3.461 1.00 0.00 C ATOM 1247 O TYR A1608 5.997 -5.173 -2.516 1.00 0.00 O ATOM 1248 CB TYR A1608 4.681 -2.873 -3.280 1.00 0.00 C ATOM 1249 CG TYR A1608 3.771 -1.720 -3.594 1.00 0.00 C ATOM 1250 CD1 TYR A1608 3.277 -1.541 -4.866 1.00 0.00 C ATOM 1251 CD2 TYR A1608 3.439 -0.789 -2.633 1.00 0.00 C ATOM 1252 CE1 TYR A1608 2.475 -0.477 -5.177 1.00 0.00 C ATOM 1253 CE2 TYR A1608 2.641 0.291 -2.943 1.00 0.00 C ATOM 1254 CZ TYR A1608 2.165 0.435 -4.220 1.00 0.00 C ATOM 1255 OH TYR A1608 1.392 1.511 -4.544 1.00 0.00 O ATOM 0 H TYR A1608 3.006 -4.185 -1.941 1.00 0.00 H new ATOM 0 HA TYR A1608 3.829 -4.209 -4.700 1.00 0.00 H new ATOM 0 HB2 TYR A1608 4.890 -2.866 -2.210 1.00 0.00 H new ATOM 0 HB3 TYR A1608 5.630 -2.712 -3.791 1.00 0.00 H new ATOM 0 HD1 TYR A1608 3.528 -2.256 -5.636 1.00 0.00 H new ATOM 0 HD2 TYR A1608 3.809 -0.907 -1.625 1.00 0.00 H new ATOM 0 HE1 TYR A1608 2.090 -0.363 -6.180 1.00 0.00 H new ATOM 0 HE2 TYR A1608 2.392 1.019 -2.185 1.00 0.00 H new ATOM 0 HH TYR A1608 1.965 2.291 -4.699 1.00 0.00 H new ATOM 1265 N ASP A1609 5.277 -6.266 -4.285 1.00 0.00 N ATOM 1266 CA ASP A1609 6.231 -7.323 -4.141 1.00 0.00 C ATOM 1267 C ASP A1609 7.389 -7.140 -5.055 1.00 0.00 C ATOM 1268 O ASP A1609 7.406 -6.214 -5.891 1.00 0.00 O ATOM 1269 CB ASP A1609 5.592 -8.701 -4.372 1.00 0.00 C ATOM 1270 CG ASP A1609 5.085 -8.939 -5.790 1.00 0.00 C ATOM 1271 OD1 ASP A1609 4.167 -8.219 -6.246 1.00 0.00 O ATOM 1272 OD2 ASP A1609 5.572 -9.893 -6.458 1.00 0.00 O1- ATOM 0 H ASP A1609 4.645 -6.373 -5.078 1.00 0.00 H new ATOM 0 HA ASP A1609 6.591 -7.281 -3.113 1.00 0.00 H new ATOM 0 HB2 ASP A1609 6.324 -9.471 -4.128 1.00 0.00 H new ATOM 0 HB3 ASP A1609 4.760 -8.821 -3.678 1.00 0.00 H new ATOM 1277 N ASP A1610 8.356 -8.016 -4.875 1.00 0.00 N ATOM 1278 CA ASP A1610 9.584 -8.074 -5.659 1.00 0.00 C ATOM 1279 C ASP A1610 10.312 -6.724 -5.656 1.00 0.00 C ATOM 1280 O ASP A1610 10.539 -6.112 -6.694 1.00 0.00 O ATOM 1281 CB ASP A1610 9.272 -8.560 -7.090 1.00 0.00 C ATOM 1282 CG ASP A1610 10.502 -8.899 -7.901 1.00 0.00 C ATOM 1283 OD1 ASP A1610 11.046 -10.020 -7.731 1.00 0.00 O1- ATOM 1284 OD2 ASP A1610 10.952 -8.080 -8.722 1.00 0.00 O ATOM 0 H ASP A1610 8.312 -8.736 -4.154 1.00 0.00 H new ATOM 0 HA ASP A1610 10.261 -8.793 -5.198 1.00 0.00 H new ATOM 0 HB2 ASP A1610 8.632 -9.440 -7.033 1.00 0.00 H new ATOM 0 HB3 ASP A1610 8.706 -7.787 -7.611 1.00 0.00 H new ATOM 1289 N GLY A1611 10.620 -6.238 -4.474 1.00 0.00 N ATOM 1290 CA GLY A1611 11.330 -4.984 -4.353 1.00 0.00 C ATOM 1291 C GLY A1611 12.830 -5.169 -4.450 1.00 0.00 C ATOM 1292 O GLY A1611 13.326 -5.917 -5.312 1.00 0.00 O ATOM 0 H GLY A1611 10.392 -6.689 -3.588 1.00 0.00 H new ATOM 0 HA2 GLY A1611 10.998 -4.302 -5.136 1.00 0.00 H new ATOM 0 HA3 GLY A1611 11.083 -4.518 -3.399 1.00 0.00 H new ATOM 1296 N ALA A1612 13.554 -4.500 -3.594 1.00 0.00 N ATOM 1297 CA ALA A1612 14.994 -4.623 -3.557 1.00 0.00 C ATOM 1298 C ALA A1612 15.361 -5.814 -2.691 1.00 0.00 C ATOM 1299 O ALA A1612 14.534 -6.258 -1.888 1.00 0.00 O ATOM 1300 CB ALA A1612 15.624 -3.354 -3.010 1.00 0.00 C ATOM 0 H ALA A1612 13.169 -3.856 -2.903 1.00 0.00 H new ATOM 0 HA ALA A1612 15.373 -4.775 -4.568 1.00 0.00 H new ATOM 0 HB1 ALA A1612 16.708 -3.466 -2.990 1.00 0.00 H new ATOM 0 HB2 ALA A1612 15.358 -2.511 -3.648 1.00 0.00 H new ATOM 0 HB3 ALA A1612 15.259 -3.173 -1.999 1.00 0.00 H new ATOM 1306 N PRO A1613 16.580 -6.354 -2.819 1.00 0.00 N ATOM 1307 CA PRO A1613 16.984 -7.508 -2.052 1.00 0.00 C ATOM 1308 C PRO A1613 17.102 -7.170 -0.574 1.00 0.00 C ATOM 1309 O PRO A1613 17.736 -6.173 -0.192 1.00 0.00 O ATOM 1310 CB PRO A1613 18.329 -7.921 -2.640 1.00 0.00 C ATOM 1311 CG PRO A1613 18.823 -6.754 -3.416 1.00 0.00 C ATOM 1312 CD PRO A1613 17.660 -5.849 -3.682 1.00 0.00 C ATOM 0 HA PRO A1613 16.254 -8.315 -2.111 1.00 0.00 H new ATOM 0 HB2 PRO A1613 19.032 -8.189 -1.851 1.00 0.00 H new ATOM 0 HB3 PRO A1613 18.221 -8.796 -3.281 1.00 0.00 H new ATOM 0 HG2 PRO A1613 19.597 -6.226 -2.859 1.00 0.00 H new ATOM 0 HG3 PRO A1613 19.273 -7.082 -4.353 1.00 0.00 H new ATOM 0 HD2 PRO A1613 17.903 -4.813 -3.445 1.00 0.00 H new ATOM 0 HD3 PRO A1613 17.371 -5.876 -4.733 1.00 0.00 H new ATOM 1320 N CYS A1614 16.481 -7.984 0.230 1.00 0.00 N ATOM 1321 CA CYS A1614 16.406 -7.805 1.647 1.00 0.00 C ATOM 1322 C CYS A1614 17.627 -8.403 2.314 1.00 0.00 C ATOM 1323 O CYS A1614 17.813 -9.617 2.318 1.00 0.00 O ATOM 1324 CB CYS A1614 15.122 -8.455 2.172 1.00 0.00 C ATOM 1325 SG CYS A1614 14.954 -8.507 3.980 1.00 0.00 S ATOM 0 H CYS A1614 15.996 -8.820 -0.097 1.00 0.00 H new ATOM 0 HA CYS A1614 16.383 -6.741 1.881 1.00 0.00 H new ATOM 0 HB2 CYS A1614 14.268 -7.916 1.761 1.00 0.00 H new ATOM 0 HB3 CYS A1614 15.069 -9.475 1.790 1.00 0.00 H new ATOM 1401 N LEU A1620 15.359 -13.258 0.752 1.00 0.00 N ATOM 1402 CA LEU A1620 14.252 -12.676 0.024 1.00 0.00 C ATOM 1403 C LEU A1620 14.484 -11.232 -0.312 1.00 0.00 C ATOM 1404 O LEU A1620 15.523 -10.652 0.031 1.00 0.00 O ATOM 1405 CB LEU A1620 12.925 -12.797 0.779 1.00 0.00 C ATOM 1406 CG LEU A1620 12.485 -14.191 1.186 1.00 0.00 C ATOM 1407 CD1 LEU A1620 13.059 -14.589 2.535 1.00 0.00 C ATOM 1408 CD2 LEU A1620 10.990 -14.284 1.169 1.00 0.00 C ATOM 0 HA LEU A1620 14.188 -13.251 -0.900 1.00 0.00 H new ATOM 0 HB2 LEU A1620 12.992 -12.187 1.680 1.00 0.00 H new ATOM 0 HB3 LEU A1620 12.142 -12.363 0.158 1.00 0.00 H new ATOM 0 HG LEU A1620 12.879 -14.901 0.459 1.00 0.00 H new ATOM 0 HD11 LEU A1620 12.722 -15.593 2.792 1.00 0.00 H new ATOM 0 HD12 LEU A1620 14.148 -14.574 2.486 1.00 0.00 H new ATOM 0 HD13 LEU A1620 12.720 -13.886 3.296 1.00 0.00 H new ATOM 0 HD21 LEU A1620 10.685 -15.288 1.463 1.00 0.00 H new ATOM 0 HD22 LEU A1620 10.572 -13.559 1.868 1.00 0.00 H new ATOM 0 HD23 LEU A1620 10.624 -14.072 0.164 1.00 0.00 H new ATOM 1420 N LYS A1621 13.530 -10.664 -0.999 1.00 0.00 N ATOM 1421 CA LYS A1621 13.509 -9.267 -1.312 1.00 0.00 C ATOM 1422 C LYS A1621 12.499 -8.606 -0.411 1.00 0.00 C ATOM 1423 O LYS A1621 11.751 -9.291 0.301 1.00 0.00 O ATOM 1424 CB LYS A1621 13.078 -9.053 -2.757 1.00 0.00 C ATOM 1425 CG LYS A1621 13.994 -9.652 -3.775 1.00 0.00 C ATOM 1426 CD LYS A1621 13.397 -9.517 -5.142 1.00 0.00 C ATOM 1427 CE LYS A1621 14.246 -10.208 -6.185 1.00 0.00 C ATOM 1428 NZ LYS A1621 13.730 -10.005 -7.556 1.00 0.00 N1+ ATOM 0 H LYS A1621 12.727 -11.176 -1.364 1.00 0.00 H new ATOM 0 HA LYS A1621 14.505 -8.847 -1.172 1.00 0.00 H new ATOM 0 HB2 LYS A1621 12.082 -9.474 -2.891 1.00 0.00 H new ATOM 0 HB3 LYS A1621 12.999 -7.982 -2.944 1.00 0.00 H new ATOM 0 HG2 LYS A1621 14.963 -9.155 -3.742 1.00 0.00 H new ATOM 0 HG3 LYS A1621 14.167 -10.704 -3.547 1.00 0.00 H new ATOM 0 HD2 LYS A1621 12.394 -9.943 -5.146 1.00 0.00 H new ATOM 0 HD3 LYS A1621 13.296 -8.461 -5.394 1.00 0.00 H new ATOM 0 HE2 LYS A1621 15.268 -9.833 -6.125 1.00 0.00 H new ATOM 0 HE3 LYS A1621 14.285 -11.276 -5.969 1.00 0.00 H new ATOM 0 HZ1 LYS A1621 14.086 -10.760 -8.176 1.00 0.00 H new ATOM 0 HZ2 LYS A1621 12.690 -10.029 -7.543 1.00 0.00 H new ATOM 0 HZ3 LYS A1621 14.051 -9.083 -7.915 1.00 0.00 H new ATOM 1442 N TYR A1622 12.480 -7.313 -0.415 1.00 0.00 N ATOM 1443 CA TYR A1622 11.490 -6.589 0.321 1.00 0.00 C ATOM 1444 C TYR A1622 10.205 -6.546 -0.458 1.00 0.00 C ATOM 1445 O TYR A1622 10.212 -6.595 -1.702 1.00 0.00 O ATOM 1446 CB TYR A1622 11.927 -5.162 0.592 1.00 0.00 C ATOM 1447 CG TYR A1622 12.989 -4.983 1.632 1.00 0.00 C ATOM 1448 CD1 TYR A1622 12.679 -5.097 2.973 1.00 0.00 C ATOM 1449 CD2 TYR A1622 14.283 -4.653 1.282 1.00 0.00 C ATOM 1450 CE1 TYR A1622 13.624 -4.892 3.943 1.00 0.00 C ATOM 1451 CE2 TYR A1622 15.245 -4.450 2.246 1.00 0.00 C ATOM 1452 CZ TYR A1622 14.909 -4.567 3.579 1.00 0.00 C ATOM 1453 OH TYR A1622 15.861 -4.366 4.554 1.00 0.00 O ATOM 0 H TYR A1622 13.144 -6.730 -0.924 1.00 0.00 H new ATOM 0 HA TYR A1622 11.350 -7.104 1.271 1.00 0.00 H new ATOM 0 HB2 TYR A1622 12.286 -4.730 -0.342 1.00 0.00 H new ATOM 0 HB3 TYR A1622 11.052 -4.587 0.893 1.00 0.00 H new ATOM 0 HD1 TYR A1622 11.671 -5.353 3.263 1.00 0.00 H new ATOM 0 HD2 TYR A1622 14.544 -4.553 0.239 1.00 0.00 H new ATOM 0 HE1 TYR A1622 13.361 -4.985 4.986 1.00 0.00 H new ATOM 0 HE2 TYR A1622 16.256 -4.201 1.960 1.00 0.00 H new ATOM 0 HH TYR A1622 16.718 -4.145 4.134 1.00 0.00 H new ATOM 1463 N LYS A1623 9.124 -6.489 0.247 1.00 0.00 N ATOM 1464 CA LYS A1623 7.847 -6.280 -0.346 1.00 0.00 C ATOM 1465 C LYS A1623 6.992 -5.579 0.665 1.00 0.00 C ATOM 1466 O LYS A1623 7.259 -5.654 1.853 1.00 0.00 O ATOM 1467 CB LYS A1623 7.189 -7.563 -0.842 1.00 0.00 C ATOM 1468 CG LYS A1623 6.747 -8.495 0.212 1.00 0.00 C ATOM 1469 CD LYS A1623 6.168 -9.727 -0.420 1.00 0.00 C ATOM 1470 CE LYS A1623 5.806 -10.765 0.595 1.00 0.00 C ATOM 1471 NZ LYS A1623 5.349 -12.008 -0.042 1.00 0.00 N1+ ATOM 0 H LYS A1623 9.103 -6.587 1.262 1.00 0.00 H new ATOM 0 HA LYS A1623 7.970 -5.671 -1.242 1.00 0.00 H new ATOM 0 HB2 LYS A1623 6.326 -7.296 -1.453 1.00 0.00 H new ATOM 0 HB3 LYS A1623 7.892 -8.084 -1.493 1.00 0.00 H new ATOM 0 HG2 LYS A1623 7.588 -8.762 0.852 1.00 0.00 H new ATOM 0 HG3 LYS A1623 6.003 -8.015 0.848 1.00 0.00 H new ATOM 0 HD2 LYS A1623 5.281 -9.457 -0.993 1.00 0.00 H new ATOM 0 HD3 LYS A1623 6.888 -10.145 -1.124 1.00 0.00 H new ATOM 0 HE2 LYS A1623 6.670 -10.975 1.226 1.00 0.00 H new ATOM 0 HE3 LYS A1623 5.022 -10.380 1.247 1.00 0.00 H new ATOM 0 HZ1 LYS A1623 5.107 -12.705 0.691 1.00 0.00 H new ATOM 0 HZ2 LYS A1623 4.510 -11.812 -0.624 1.00 0.00 H new ATOM 0 HZ3 LYS A1623 6.107 -12.388 -0.644 1.00 0.00 H new ATOM 1485 N SER A1624 5.998 -4.932 0.213 1.00 0.00 N ATOM 1486 CA SER A1624 5.180 -4.110 1.049 1.00 0.00 C ATOM 1487 C SER A1624 3.736 -4.516 0.965 1.00 0.00 C ATOM 1488 O SER A1624 3.255 -4.938 -0.080 1.00 0.00 O ATOM 1489 CB SER A1624 5.335 -2.648 0.656 1.00 0.00 C ATOM 1490 OG SER A1624 6.672 -2.221 0.797 1.00 0.00 O ATOM 0 H SER A1624 5.711 -4.948 -0.766 1.00 0.00 H new ATOM 0 HA SER A1624 5.509 -4.242 2.080 1.00 0.00 H new ATOM 0 HB2 SER A1624 5.013 -2.510 -0.376 1.00 0.00 H new ATOM 0 HB3 SER A1624 4.686 -2.031 1.277 1.00 0.00 H new ATOM 0 HG SER A1624 7.260 -2.812 0.282 1.00 0.00 H new ATOM 1496 N VAL A1625 3.078 -4.412 2.069 1.00 0.00 N ATOM 1497 CA VAL A1625 1.676 -4.696 2.205 1.00 0.00 C ATOM 1498 C VAL A1625 0.989 -3.562 2.899 1.00 0.00 C ATOM 1499 O VAL A1625 0.950 -3.463 4.134 1.00 0.00 O ATOM 1500 CB VAL A1625 1.410 -5.995 2.950 1.00 0.00 C ATOM 1501 CG1 VAL A1625 1.479 -7.166 1.986 1.00 0.00 C ATOM 1502 CG2 VAL A1625 2.446 -6.175 3.994 1.00 0.00 C ATOM 0 H VAL A1625 3.514 -4.115 2.942 1.00 0.00 H new ATOM 0 HA VAL A1625 1.275 -4.815 1.198 1.00 0.00 H new ATOM 0 HB VAL A1625 0.419 -5.953 3.403 1.00 0.00 H new ATOM 0 HG11 VAL A1625 1.288 -8.093 2.526 1.00 0.00 H new ATOM 0 HG12 VAL A1625 0.729 -7.039 1.205 1.00 0.00 H new ATOM 0 HG13 VAL A1625 2.470 -7.207 1.534 1.00 0.00 H new ATOM 0 HG21 VAL A1625 2.262 -7.105 4.533 1.00 0.00 H new ATOM 0 HG22 VAL A1625 3.430 -6.215 3.527 1.00 0.00 H new ATOM 0 HG23 VAL A1625 2.409 -5.338 4.691 1.00 0.00 H new ATOM 1512 N ILE A1626 0.515 -2.680 2.120 1.00 0.00 N ATOM 1513 CA ILE A1626 -0.146 -1.532 2.623 1.00 0.00 C ATOM 1514 C ILE A1626 -1.595 -1.892 2.840 1.00 0.00 C ATOM 1515 O ILE A1626 -2.325 -2.178 1.891 1.00 0.00 O ATOM 1516 CB ILE A1626 -0.042 -0.366 1.635 1.00 0.00 C ATOM 1517 CG1 ILE A1626 1.417 -0.146 1.248 1.00 0.00 C ATOM 1518 CG2 ILE A1626 -0.582 0.883 2.296 1.00 0.00 C ATOM 1519 CD1 ILE A1626 1.629 0.938 0.229 1.00 0.00 C ATOM 0 H ILE A1626 0.570 -2.726 1.103 1.00 0.00 H new ATOM 0 HA ILE A1626 0.319 -1.218 3.558 1.00 0.00 H new ATOM 0 HB ILE A1626 -0.618 -0.592 0.738 1.00 0.00 H new ATOM 0 HG12 ILE A1626 1.986 0.098 2.145 1.00 0.00 H new ATOM 0 HG13 ILE A1626 1.822 -1.080 0.858 1.00 0.00 H new ATOM 0 HG21 ILE A1626 -0.513 1.721 1.602 1.00 0.00 H new ATOM 0 HG22 ILE A1626 -1.624 0.726 2.573 1.00 0.00 H new ATOM 0 HG23 ILE A1626 0.002 1.103 3.190 1.00 0.00 H new ATOM 0 HD11 ILE A1626 2.693 1.029 0.010 1.00 0.00 H new ATOM 0 HD12 ILE A1626 1.091 0.688 -0.685 1.00 0.00 H new ATOM 0 HD13 ILE A1626 1.257 1.884 0.622 1.00 0.00 H new ATOM 1531 N SER A1627 -1.959 -1.966 4.081 1.00 0.00 N ATOM 1532 CA SER A1627 -3.272 -2.310 4.492 1.00 0.00 C ATOM 1533 C SER A1627 -4.097 -1.025 4.613 1.00 0.00 C ATOM 1534 O SER A1627 -3.813 -0.174 5.451 1.00 0.00 O ATOM 1535 CB SER A1627 -3.170 -3.004 5.850 1.00 0.00 C ATOM 1536 OG SER A1627 -2.199 -4.054 5.805 1.00 0.00 O ATOM 0 H SER A1627 -1.324 -1.781 4.858 1.00 0.00 H new ATOM 0 HA SER A1627 -3.753 -2.975 3.774 1.00 0.00 H new ATOM 0 HB2 SER A1627 -2.895 -2.279 6.616 1.00 0.00 H new ATOM 0 HB3 SER A1627 -4.141 -3.411 6.131 1.00 0.00 H new ATOM 0 HG SER A1627 -2.145 -4.487 6.682 1.00 0.00 H new ATOM 1542 N PHE A1628 -5.080 -0.897 3.770 1.00 0.00 N ATOM 1543 CA PHE A1628 -5.916 0.271 3.714 1.00 0.00 C ATOM 1544 C PHE A1628 -7.127 0.056 4.545 1.00 0.00 C ATOM 1545 O PHE A1628 -7.974 -0.802 4.263 1.00 0.00 O ATOM 1546 CB PHE A1628 -6.308 0.634 2.290 1.00 0.00 C ATOM 1547 CG PHE A1628 -5.152 0.979 1.417 1.00 0.00 C ATOM 1548 CD1 PHE A1628 -4.443 -0.003 0.786 1.00 0.00 C ATOM 1549 CD2 PHE A1628 -4.782 2.287 1.232 1.00 0.00 C ATOM 1550 CE1 PHE A1628 -3.381 0.302 -0.013 1.00 0.00 C ATOM 1551 CE2 PHE A1628 -3.715 2.615 0.429 1.00 0.00 C ATOM 1552 CZ PHE A1628 -3.010 1.620 -0.196 1.00 0.00 C ATOM 0 H PHE A1628 -5.329 -1.614 3.089 1.00 0.00 H new ATOM 0 HA PHE A1628 -5.342 1.110 4.108 1.00 0.00 H new ATOM 0 HB2 PHE A1628 -6.848 -0.203 1.847 1.00 0.00 H new ATOM 0 HB3 PHE A1628 -6.996 1.479 2.317 1.00 0.00 H new ATOM 0 HD1 PHE A1628 -4.728 -1.036 0.922 1.00 0.00 H new ATOM 0 HD2 PHE A1628 -5.337 3.071 1.725 1.00 0.00 H new ATOM 0 HE1 PHE A1628 -2.830 -0.487 -0.503 1.00 0.00 H new ATOM 0 HE2 PHE A1628 -3.435 3.649 0.292 1.00 0.00 H new ATOM 0 HZ PHE A1628 -2.169 1.865 -0.828 1.00 0.00 H new ATOM 1562 N VAL A1629 -7.185 0.825 5.537 1.00 0.00 N ATOM 1563 CA VAL A1629 -8.172 0.794 6.542 1.00 0.00 C ATOM 1564 C VAL A1629 -9.056 2.010 6.411 1.00 0.00 C ATOM 1565 O VAL A1629 -8.564 3.118 6.264 1.00 0.00 O ATOM 1566 CB VAL A1629 -7.448 0.804 7.890 1.00 0.00 C ATOM 1567 CG1 VAL A1629 -8.397 1.112 9.022 1.00 0.00 C ATOM 1568 CG2 VAL A1629 -6.732 -0.527 8.098 1.00 0.00 C ATOM 0 H VAL A1629 -6.492 1.558 5.692 1.00 0.00 H new ATOM 0 HA VAL A1629 -8.798 -0.094 6.456 1.00 0.00 H new ATOM 0 HB VAL A1629 -6.702 1.599 7.883 1.00 0.00 H new ATOM 0 HG11 VAL A1629 -7.851 1.111 9.965 1.00 0.00 H new ATOM 0 HG12 VAL A1629 -8.846 2.092 8.864 1.00 0.00 H new ATOM 0 HG13 VAL A1629 -9.181 0.355 9.056 1.00 0.00 H new ATOM 0 HG21 VAL A1629 -6.217 -0.517 9.059 1.00 0.00 H new ATOM 0 HG22 VAL A1629 -7.460 -1.338 8.085 1.00 0.00 H new ATOM 0 HG23 VAL A1629 -6.006 -0.678 7.299 1.00 0.00 H new ATOM 1578 N CYS A1630 -10.335 1.775 6.400 1.00 0.00 N ATOM 1579 CA CYS A1630 -11.349 2.814 6.281 1.00 0.00 C ATOM 1580 C CYS A1630 -11.176 3.902 7.348 1.00 0.00 C ATOM 1581 O CYS A1630 -11.043 3.600 8.541 1.00 0.00 O ATOM 1582 CB CYS A1630 -12.747 2.180 6.369 1.00 0.00 C ATOM 1583 SG CYS A1630 -14.140 3.353 6.489 1.00 0.00 S ATOM 0 H CYS A1630 -10.725 0.836 6.475 1.00 0.00 H new ATOM 0 HA CYS A1630 -11.232 3.298 5.311 1.00 0.00 H new ATOM 0 HB2 CYS A1630 -12.898 1.553 5.490 1.00 0.00 H new ATOM 0 HB3 CYS A1630 -12.774 1.522 7.238 1.00 0.00 H new ATOM 1588 N THR A1631 -11.132 5.146 6.901 1.00 0.00 N ATOM 1589 CA THR A1631 -11.031 6.293 7.797 1.00 0.00 C ATOM 1590 C THR A1631 -12.173 7.262 7.513 1.00 0.00 C ATOM 1591 O THR A1631 -12.610 7.396 6.363 1.00 0.00 O ATOM 1592 CB THR A1631 -9.641 7.033 7.759 1.00 0.00 C ATOM 1593 OG1 THR A1631 -9.539 7.986 8.839 1.00 0.00 O ATOM 1594 CG2 THR A1631 -9.440 7.783 6.467 1.00 0.00 C ATOM 0 H THR A1631 -11.165 5.392 5.912 1.00 0.00 H new ATOM 0 HA THR A1631 -11.110 5.900 8.811 1.00 0.00 H new ATOM 0 HB THR A1631 -8.878 6.260 7.855 1.00 0.00 H new ATOM 0 HG1 THR A1631 -9.471 8.892 8.471 1.00 0.00 H new ATOM 0 HG21 THR A1631 -8.470 8.279 6.481 1.00 0.00 H new ATOM 0 HG22 THR A1631 -9.478 7.084 5.631 1.00 0.00 H new ATOM 0 HG23 THR A1631 -10.227 8.529 6.353 1.00 0.00 H new ATOM 1602 N HIS A1632 -12.672 7.897 8.562 1.00 0.00 N ATOM 1603 CA HIS A1632 -13.826 8.847 8.519 1.00 0.00 C ATOM 1604 C HIS A1632 -13.569 10.104 7.656 1.00 0.00 C ATOM 1605 O HIS A1632 -14.441 10.971 7.549 1.00 0.00 O ATOM 1606 CB HIS A1632 -14.203 9.315 9.932 1.00 0.00 C ATOM 1607 CG HIS A1632 -14.549 8.231 10.892 1.00 0.00 C ATOM 1608 ND1 HIS A1632 -13.801 7.966 12.012 1.00 0.00 N ATOM 1609 CD2 HIS A1632 -15.578 7.360 10.917 1.00 0.00 C ATOM 1610 CE1 HIS A1632 -14.350 6.983 12.681 1.00 0.00 C ATOM 1611 NE2 HIS A1632 -15.429 6.594 12.041 1.00 0.00 N ATOM 0 H HIS A1632 -12.292 7.778 9.501 1.00 0.00 H new ATOM 0 HA HIS A1632 -14.638 8.282 8.061 1.00 0.00 H new ATOM 0 HB2 HIS A1632 -13.371 9.888 10.341 1.00 0.00 H new ATOM 0 HB3 HIS A1632 -15.051 9.995 9.857 1.00 0.00 H new ATOM 0 HD2 HIS A1632 -16.370 7.282 10.187 1.00 0.00 H new ATOM 0 HE1 HIS A1632 -13.978 6.563 13.604 1.00 0.00 H new ATOM 0 HE2 HIS A1632 -16.054 5.843 12.334 1.00 0.00 H new ATOM 1620 N ASP A1633 -12.405 10.195 7.052 1.00 0.00 N ATOM 1621 CA ASP A1633 -12.016 11.356 6.222 1.00 0.00 C ATOM 1622 C ASP A1633 -12.689 11.254 4.842 1.00 0.00 C ATOM 1623 O ASP A1633 -13.538 10.376 4.629 1.00 0.00 O ATOM 1624 CB ASP A1633 -10.478 11.396 6.040 1.00 0.00 C ATOM 1625 CG ASP A1633 -9.696 11.573 7.330 1.00 0.00 C ATOM 1626 OD1 ASP A1633 -9.472 10.572 8.053 1.00 0.00 O1- ATOM 1627 OD2 ASP A1633 -9.280 12.710 7.638 1.00 0.00 O ATOM 0 H ASP A1633 -11.687 9.473 7.111 1.00 0.00 H new ATOM 0 HA ASP A1633 -12.339 12.268 6.723 1.00 0.00 H new ATOM 0 HB2 ASP A1633 -10.157 10.472 5.559 1.00 0.00 H new ATOM 0 HB3 ASP A1633 -10.226 12.212 5.362 1.00 0.00 H new ATOM 1632 N SER A1634 -12.339 12.126 3.916 1.00 0.00 N ATOM 1633 CA SER A1634 -12.856 12.032 2.569 1.00 0.00 C ATOM 1634 C SER A1634 -11.712 12.225 1.562 1.00 0.00 C ATOM 1635 O SER A1634 -11.065 13.268 1.566 1.00 0.00 O ATOM 1636 CB SER A1634 -13.983 13.058 2.337 1.00 0.00 C ATOM 1637 OG SER A1634 -14.614 12.859 1.068 1.00 0.00 O ATOM 0 H SER A1634 -11.700 12.905 4.074 1.00 0.00 H new ATOM 0 HA SER A1634 -13.286 11.041 2.424 1.00 0.00 H new ATOM 0 HB2 SER A1634 -14.724 12.973 3.132 1.00 0.00 H new ATOM 0 HB3 SER A1634 -13.575 14.067 2.388 1.00 0.00 H new ATOM 0 HG SER A1634 -15.325 13.522 0.949 1.00 0.00 H new ATOM 1643 N GLY A1635 -11.460 11.204 0.719 1.00 0.00 N ATOM 1644 CA GLY A1635 -10.423 11.271 -0.305 1.00 0.00 C ATOM 1645 C GLY A1635 -9.055 11.656 0.222 1.00 0.00 C ATOM 1646 O GLY A1635 -8.326 12.448 -0.394 1.00 0.00 O ATOM 0 H GLY A1635 -11.970 10.321 0.736 1.00 0.00 H new ATOM 0 HA2 GLY A1635 -10.351 10.301 -0.797 1.00 0.00 H new ATOM 0 HA3 GLY A1635 -10.724 11.993 -1.065 1.00 0.00 H new ATOM 1650 N ALA A1636 -8.707 11.097 1.339 1.00 0.00 N ATOM 1651 CA ALA A1636 -7.470 11.413 1.991 1.00 0.00 C ATOM 1652 C ALA A1636 -6.626 10.163 2.140 1.00 0.00 C ATOM 1653 O ALA A1636 -7.053 9.056 1.753 1.00 0.00 O ATOM 1654 CB ALA A1636 -7.762 12.028 3.355 1.00 0.00 C ATOM 0 H ALA A1636 -9.274 10.405 1.828 1.00 0.00 H new ATOM 0 HA ALA A1636 -6.913 12.131 1.389 1.00 0.00 H new ATOM 0 HB1 ALA A1636 -6.823 12.270 3.854 1.00 0.00 H new ATOM 0 HB2 ALA A1636 -8.349 12.937 3.226 1.00 0.00 H new ATOM 0 HB3 ALA A1636 -8.323 11.317 3.962 1.00 0.00 H new ATOM 1660 N ASN A1637 -5.454 10.319 2.688 1.00 0.00 N ATOM 1661 CA ASN A1637 -4.592 9.214 2.953 1.00 0.00 C ATOM 1662 C ASN A1637 -4.405 9.167 4.435 1.00 0.00 C ATOM 1663 O ASN A1637 -3.853 8.208 4.972 1.00 0.00 O ATOM 1664 CB ASN A1637 -3.216 9.374 2.250 1.00 0.00 C ATOM 1665 CG ASN A1637 -2.276 10.404 2.888 1.00 0.00 C ATOM 1666 OD1 ASN A1637 -2.313 11.583 2.553 1.00 0.00 O ATOM 1667 ND2 ASN A1637 -1.395 9.958 3.774 1.00 0.00 N ATOM 0 H ASN A1637 -5.072 11.224 2.963 1.00 0.00 H new ATOM 0 HA ASN A1637 -5.034 8.294 2.569 1.00 0.00 H new ATOM 0 HB2 ASN A1637 -2.716 8.406 2.240 1.00 0.00 H new ATOM 0 HB3 ASN A1637 -3.387 9.655 1.211 1.00 0.00 H new ATOM 0 HD21 ASN A1637 -0.725 10.601 4.195 1.00 0.00 H new ATOM 0 HD22 ASN A1637 -1.388 8.972 4.034 1.00 0.00 H new ATOM 1674 N ASN A1638 -4.873 10.261 5.077 1.00 0.00 N ATOM 1675 CA ASN A1638 -4.799 10.516 6.500 1.00 0.00 C ATOM 1676 C ASN A1638 -3.359 10.527 6.940 1.00 0.00 C ATOM 1677 O ASN A1638 -2.734 11.584 7.032 1.00 0.00 O ATOM 1678 CB ASN A1638 -5.712 9.561 7.330 1.00 0.00 C ATOM 1679 CG ASN A1638 -5.718 9.839 8.805 1.00 0.00 C ATOM 1680 OD1 ASN A1638 -4.859 9.358 9.548 1.00 0.00 O ATOM 1681 ND2 ASN A1638 -6.717 10.516 9.255 1.00 0.00 N ATOM 0 H ASN A1638 -5.334 11.019 4.573 1.00 0.00 H new ATOM 0 HA ASN A1638 -5.205 11.507 6.702 1.00 0.00 H new ATOM 0 HB2 ASN A1638 -6.732 9.635 6.954 1.00 0.00 H new ATOM 0 HB3 ASN A1638 -5.386 8.534 7.167 1.00 0.00 H new ATOM 0 HD21 ASN A1638 -6.818 10.670 10.258 1.00 0.00 H new ATOM 0 HD22 ASN A1638 -7.407 10.898 8.608 1.00 0.00 H new ATOM 1688 N LYS A1639 -2.842 9.369 7.129 1.00 0.00 N ATOM 1689 CA LYS A1639 -1.462 9.148 7.489 1.00 0.00 C ATOM 1690 C LYS A1639 -1.173 7.629 7.479 1.00 0.00 C ATOM 1691 O LYS A1639 -1.884 6.858 8.140 1.00 0.00 O ATOM 1692 CB LYS A1639 -1.123 9.811 8.853 1.00 0.00 C ATOM 1693 CG LYS A1639 0.362 10.158 9.096 1.00 0.00 C ATOM 1694 CD LYS A1639 1.249 8.945 9.329 1.00 0.00 C ATOM 1695 CE LYS A1639 0.885 8.207 10.611 1.00 0.00 C ATOM 1696 NZ LYS A1639 1.091 9.039 11.809 1.00 0.00 N1+ ATOM 0 H LYS A1639 -3.377 8.505 7.037 1.00 0.00 H new ATOM 0 HA LYS A1639 -0.811 9.623 6.755 1.00 0.00 H new ATOM 0 HB2 LYS A1639 -1.707 10.727 8.943 1.00 0.00 H new ATOM 0 HB3 LYS A1639 -1.453 9.143 9.649 1.00 0.00 H new ATOM 0 HG2 LYS A1639 0.740 10.713 8.237 1.00 0.00 H new ATOM 0 HG3 LYS A1639 0.434 10.819 9.960 1.00 0.00 H new ATOM 0 HD2 LYS A1639 1.162 8.264 8.482 1.00 0.00 H new ATOM 0 HD3 LYS A1639 2.291 9.262 9.377 1.00 0.00 H new ATOM 0 HE2 LYS A1639 -0.158 7.893 10.564 1.00 0.00 H new ATOM 0 HE3 LYS A1639 1.487 7.302 10.691 1.00 0.00 H new ATOM 0 HZ1 LYS A1639 1.046 8.441 12.659 1.00 0.00 H new ATOM 0 HZ2 LYS A1639 2.023 9.497 11.757 1.00 0.00 H new ATOM 0 HZ3 LYS A1639 0.350 9.767 11.858 1.00 0.00 H new ATOM 1710 N PRO A1640 -0.187 7.180 6.691 1.00 0.00 N ATOM 1711 CA PRO A1640 0.247 5.784 6.687 1.00 0.00 C ATOM 1712 C PRO A1640 1.219 5.488 7.845 1.00 0.00 C ATOM 1713 O PRO A1640 2.207 6.201 8.047 1.00 0.00 O ATOM 1714 CB PRO A1640 0.963 5.618 5.348 1.00 0.00 C ATOM 1715 CG PRO A1640 1.010 6.978 4.704 1.00 0.00 C ATOM 1716 CD PRO A1640 0.547 7.982 5.714 1.00 0.00 C ATOM 0 HA PRO A1640 -0.592 5.100 6.815 1.00 0.00 H new ATOM 0 HB2 PRO A1640 1.969 5.225 5.495 1.00 0.00 H new ATOM 0 HB3 PRO A1640 0.433 4.908 4.713 1.00 0.00 H new ATOM 0 HG2 PRO A1640 2.023 7.209 4.373 1.00 0.00 H new ATOM 0 HG3 PRO A1640 0.372 7.004 3.820 1.00 0.00 H new ATOM 0 HD2 PRO A1640 1.387 8.503 6.174 1.00 0.00 H new ATOM 0 HD3 PRO A1640 -0.090 8.741 5.260 1.00 0.00 H new ATOM 1724 N VAL A1641 0.933 4.446 8.586 1.00 0.00 N ATOM 1725 CA VAL A1641 1.705 4.068 9.764 1.00 0.00 C ATOM 1726 C VAL A1641 2.347 2.713 9.511 1.00 0.00 C ATOM 1727 O VAL A1641 1.682 1.805 9.030 1.00 0.00 O ATOM 1728 CB VAL A1641 0.777 3.858 10.992 1.00 0.00 C ATOM 1729 CG1 VAL A1641 1.537 3.984 12.302 1.00 0.00 C ATOM 1730 CG2 VAL A1641 -0.491 4.716 10.951 1.00 0.00 C ATOM 0 H VAL A1641 0.149 3.823 8.393 1.00 0.00 H new ATOM 0 HA VAL A1641 2.431 4.859 9.953 1.00 0.00 H new ATOM 0 HB VAL A1641 0.421 2.830 10.933 1.00 0.00 H new ATOM 0 HG11 VAL A1641 0.852 3.831 13.136 1.00 0.00 H new ATOM 0 HG12 VAL A1641 2.327 3.234 12.338 1.00 0.00 H new ATOM 0 HG13 VAL A1641 1.978 4.978 12.373 1.00 0.00 H new ATOM 0 HG21 VAL A1641 -1.093 4.519 11.838 1.00 0.00 H new ATOM 0 HG22 VAL A1641 -0.216 5.770 10.926 1.00 0.00 H new ATOM 0 HG23 VAL A1641 -1.068 4.470 10.060 1.00 0.00 H new ATOM 1740 N PHE A1642 3.603 2.576 9.792 1.00 0.00 N ATOM 1741 CA PHE A1642 4.252 1.315 9.717 1.00 0.00 C ATOM 1742 C PHE A1642 3.874 0.537 10.948 1.00 0.00 C ATOM 1743 O PHE A1642 4.176 0.941 12.075 1.00 0.00 O ATOM 1744 CB PHE A1642 5.762 1.509 9.624 1.00 0.00 C ATOM 1745 CG PHE A1642 6.520 0.236 9.555 1.00 0.00 C ATOM 1746 CD1 PHE A1642 6.660 -0.422 8.354 1.00 0.00 C ATOM 1747 CD2 PHE A1642 7.076 -0.314 10.690 1.00 0.00 C ATOM 1748 CE1 PHE A1642 7.343 -1.600 8.282 1.00 0.00 C ATOM 1749 CE2 PHE A1642 7.759 -1.492 10.629 1.00 0.00 C ATOM 1750 CZ PHE A1642 7.895 -2.141 9.419 1.00 0.00 C ATOM 0 H PHE A1642 4.208 3.344 10.082 1.00 0.00 H new ATOM 0 HA PHE A1642 3.942 0.768 8.827 1.00 0.00 H new ATOM 0 HB2 PHE A1642 5.990 2.106 8.741 1.00 0.00 H new ATOM 0 HB3 PHE A1642 6.101 2.078 10.490 1.00 0.00 H new ATOM 0 HD1 PHE A1642 6.225 -0.001 7.460 1.00 0.00 H new ATOM 0 HD2 PHE A1642 6.969 0.194 11.637 1.00 0.00 H new ATOM 0 HE1 PHE A1642 7.450 -2.107 7.334 1.00 0.00 H new ATOM 0 HE2 PHE A1642 8.192 -1.915 11.523 1.00 0.00 H new ATOM 0 HZ PHE A1642 8.435 -3.075 9.365 1.00 0.00 H new ATOM 1760 N VAL A1643 3.180 -0.535 10.743 1.00 0.00 N ATOM 1761 CA VAL A1643 2.729 -1.340 11.827 1.00 0.00 C ATOM 1762 C VAL A1643 3.761 -2.406 12.205 1.00 0.00 C ATOM 1763 O VAL A1643 4.181 -2.477 13.360 1.00 0.00 O ATOM 1764 CB VAL A1643 1.286 -1.923 11.573 1.00 0.00 C ATOM 1765 CG1 VAL A1643 1.100 -2.409 10.149 1.00 0.00 C ATOM 1766 CG2 VAL A1643 0.996 -3.052 12.524 1.00 0.00 C ATOM 0 H VAL A1643 2.911 -0.876 9.820 1.00 0.00 H new ATOM 0 HA VAL A1643 2.631 -0.694 12.699 1.00 0.00 H new ATOM 0 HB VAL A1643 0.586 -1.105 11.743 1.00 0.00 H new ATOM 0 HG11 VAL A1643 0.090 -2.801 10.027 1.00 0.00 H new ATOM 0 HG12 VAL A1643 1.253 -1.580 9.459 1.00 0.00 H new ATOM 0 HG13 VAL A1643 1.823 -3.197 9.936 1.00 0.00 H new ATOM 0 HG21 VAL A1643 -0.004 -3.441 12.333 1.00 0.00 H new ATOM 0 HG22 VAL A1643 1.728 -3.847 12.379 1.00 0.00 H new ATOM 0 HG23 VAL A1643 1.054 -2.688 13.550 1.00 0.00 H new ATOM 1776 N SER A1644 4.213 -3.181 11.248 1.00 0.00 N ATOM 1777 CA SER A1644 5.135 -4.263 11.561 1.00 0.00 C ATOM 1778 C SER A1644 5.903 -4.712 10.324 1.00 0.00 C ATOM 1779 O SER A1644 5.449 -4.520 9.197 1.00 0.00 O ATOM 1780 CB SER A1644 4.355 -5.456 12.173 1.00 0.00 C ATOM 1781 OG SER A1644 5.223 -6.510 12.581 1.00 0.00 O ATOM 0 H SER A1644 3.967 -3.092 10.262 1.00 0.00 H new ATOM 0 HA SER A1644 5.860 -3.895 12.287 1.00 0.00 H new ATOM 0 HB2 SER A1644 3.778 -5.110 13.030 1.00 0.00 H new ATOM 0 HB3 SER A1644 3.642 -5.836 11.441 1.00 0.00 H new ATOM 0 HG SER A1644 4.693 -7.241 12.962 1.00 0.00 H new ATOM 1787 N LEU A1645 7.080 -5.256 10.538 1.00 0.00 N ATOM 1788 CA LEU A1645 7.857 -5.834 9.471 1.00 0.00 C ATOM 1789 C LEU A1645 7.729 -7.329 9.593 1.00 0.00 C ATOM 1790 O LEU A1645 7.706 -7.870 10.704 1.00 0.00 O ATOM 1791 CB LEU A1645 9.346 -5.374 9.547 1.00 0.00 C ATOM 1792 CG LEU A1645 10.314 -5.745 8.368 1.00 0.00 C ATOM 1793 CD1 LEU A1645 10.804 -7.194 8.388 1.00 0.00 C ATOM 1794 CD2 LEU A1645 9.694 -5.410 7.028 1.00 0.00 C ATOM 0 H LEU A1645 7.523 -5.309 11.455 1.00 0.00 H new ATOM 0 HA LEU A1645 7.489 -5.503 8.500 1.00 0.00 H new ATOM 0 HB2 LEU A1645 9.351 -4.289 9.649 1.00 0.00 H new ATOM 0 HB3 LEU A1645 9.771 -5.782 10.464 1.00 0.00 H new ATOM 0 HG LEU A1645 11.201 -5.130 8.520 1.00 0.00 H new ATOM 0 HD11 LEU A1645 11.467 -7.366 7.540 1.00 0.00 H new ATOM 0 HD12 LEU A1645 11.345 -7.382 9.315 1.00 0.00 H new ATOM 0 HD13 LEU A1645 9.950 -7.868 8.323 1.00 0.00 H new ATOM 0 HD21 LEU A1645 10.386 -5.677 6.230 1.00 0.00 H new ATOM 0 HD22 LEU A1645 8.766 -5.969 6.906 1.00 0.00 H new ATOM 0 HD23 LEU A1645 9.482 -4.342 6.982 1.00 0.00 H new ATOM 1806 N ASP A1646 7.636 -7.977 8.490 1.00 0.00 N ATOM 1807 CA ASP A1646 7.492 -9.406 8.448 1.00 0.00 C ATOM 1808 C ASP A1646 8.822 -9.964 8.207 1.00 0.00 C ATOM 1809 O ASP A1646 9.371 -9.831 7.129 1.00 0.00 O ATOM 1810 CB ASP A1646 6.557 -9.874 7.353 1.00 0.00 C ATOM 1811 CG ASP A1646 6.370 -11.366 7.370 1.00 0.00 C ATOM 1812 OD1 ASP A1646 7.234 -12.074 6.879 1.00 0.00 O1- ATOM 1813 OD2 ASP A1646 5.356 -11.858 7.924 1.00 0.00 O ATOM 0 H ASP A1646 7.657 -7.534 7.572 1.00 0.00 H new ATOM 0 HA ASP A1646 7.061 -9.740 9.392 1.00 0.00 H new ATOM 0 HB2 ASP A1646 5.589 -9.386 7.470 1.00 0.00 H new ATOM 0 HB3 ASP A1646 6.953 -9.569 6.384 1.00 0.00 H new ATOM 1818 N LYS A1647 9.342 -10.550 9.194 1.00 0.00 N ATOM 1819 CA LYS A1647 10.694 -11.044 9.183 1.00 0.00 C ATOM 1820 C LYS A1647 10.771 -12.437 8.617 1.00 0.00 C ATOM 1821 O LYS A1647 11.800 -13.087 8.678 1.00 0.00 O ATOM 1822 CB LYS A1647 11.215 -10.983 10.592 1.00 0.00 C ATOM 1823 CG LYS A1647 10.950 -9.629 11.180 1.00 0.00 C ATOM 1824 CD LYS A1647 11.399 -9.513 12.605 1.00 0.00 C ATOM 1825 CE LYS A1647 11.200 -8.099 13.109 1.00 0.00 C ATOM 1826 NZ LYS A1647 11.674 -7.923 14.492 1.00 0.00 N1+ ATOM 0 H LYS A1647 8.848 -10.718 10.071 1.00 0.00 H new ATOM 0 HA LYS A1647 11.313 -10.425 8.533 1.00 0.00 H new ATOM 0 HB2 LYS A1647 10.737 -11.752 11.199 1.00 0.00 H new ATOM 0 HB3 LYS A1647 12.285 -11.189 10.602 1.00 0.00 H new ATOM 0 HG2 LYS A1647 11.458 -8.873 10.582 1.00 0.00 H new ATOM 0 HG3 LYS A1647 9.883 -9.416 11.122 1.00 0.00 H new ATOM 0 HD2 LYS A1647 10.838 -10.210 13.227 1.00 0.00 H new ATOM 0 HD3 LYS A1647 12.450 -9.790 12.685 1.00 0.00 H new ATOM 0 HE2 LYS A1647 11.729 -7.406 12.456 1.00 0.00 H new ATOM 0 HE3 LYS A1647 10.142 -7.843 13.055 1.00 0.00 H new ATOM 0 HZ1 LYS A1647 11.516 -6.939 14.791 1.00 0.00 H new ATOM 0 HZ2 LYS A1647 11.152 -8.564 15.122 1.00 0.00 H new ATOM 0 HZ3 LYS A1647 12.690 -8.141 14.541 1.00 0.00 H new ATOM 1840 N GLN A1648 9.696 -12.887 8.077 1.00 0.00 N ATOM 1841 CA GLN A1648 9.686 -14.175 7.440 1.00 0.00 C ATOM 1842 C GLN A1648 9.950 -13.990 5.954 1.00 0.00 C ATOM 1843 O GLN A1648 10.669 -14.781 5.326 1.00 0.00 O ATOM 1844 CB GLN A1648 8.360 -14.894 7.663 1.00 0.00 C ATOM 1845 CG GLN A1648 8.345 -16.328 7.179 1.00 0.00 C ATOM 1846 CD GLN A1648 7.006 -16.994 7.384 1.00 0.00 C ATOM 1847 OE1 GLN A1648 5.954 -16.351 7.323 1.00 0.00 O ATOM 1848 NE2 GLN A1648 7.026 -18.260 7.673 1.00 0.00 N ATOM 0 H GLN A1648 8.806 -12.390 8.058 1.00 0.00 H new ATOM 0 HA GLN A1648 10.467 -14.795 7.880 1.00 0.00 H new ATOM 0 HB2 GLN A1648 8.125 -14.879 8.727 1.00 0.00 H new ATOM 0 HB3 GLN A1648 7.570 -14.342 7.154 1.00 0.00 H new ATOM 0 HG2 GLN A1648 8.601 -16.353 6.120 1.00 0.00 H new ATOM 0 HG3 GLN A1648 9.113 -16.894 7.706 1.00 0.00 H new ATOM 0 HE21 GLN A1648 7.914 -18.760 7.715 1.00 0.00 H new ATOM 0 HE22 GLN A1648 6.153 -18.755 7.858 1.00 0.00 H new ATOM 1857 N THR A1649 9.367 -12.941 5.394 1.00 0.00 N ATOM 1858 CA THR A1649 9.485 -12.676 3.977 1.00 0.00 C ATOM 1859 C THR A1649 9.814 -11.193 3.646 1.00 0.00 C ATOM 1860 O THR A1649 9.641 -10.750 2.506 1.00 0.00 O ATOM 1861 CB THR A1649 8.239 -13.253 3.186 1.00 0.00 C ATOM 1862 OG1 THR A1649 8.190 -12.831 1.806 1.00 0.00 O ATOM 1863 CG2 THR A1649 6.938 -12.938 3.886 1.00 0.00 C ATOM 0 H THR A1649 8.806 -12.260 5.906 1.00 0.00 H new ATOM 0 HA THR A1649 10.360 -13.218 3.620 1.00 0.00 H new ATOM 0 HB THR A1649 8.375 -14.334 3.177 1.00 0.00 H new ATOM 0 HG1 THR A1649 8.700 -12.001 1.699 1.00 0.00 H new ATOM 0 HG21 THR A1649 6.107 -13.350 3.313 1.00 0.00 H new ATOM 0 HG22 THR A1649 6.945 -13.379 4.883 1.00 0.00 H new ATOM 0 HG23 THR A1649 6.821 -11.857 3.968 1.00 0.00 H new ATOM 1871 N CYS A1650 10.328 -10.457 4.644 1.00 0.00 N ATOM 1872 CA CYS A1650 10.729 -9.042 4.503 1.00 0.00 C ATOM 1873 C CYS A1650 9.570 -8.196 3.979 1.00 0.00 C ATOM 1874 O CYS A1650 9.711 -7.388 3.062 1.00 0.00 O ATOM 1875 CB CYS A1650 11.962 -8.926 3.617 1.00 0.00 C ATOM 1876 SG CYS A1650 13.431 -9.814 4.263 1.00 0.00 S ATOM 0 H CYS A1650 10.480 -10.828 5.582 1.00 0.00 H new ATOM 0 HA CYS A1650 10.990 -8.653 5.487 1.00 0.00 H new ATOM 0 HB2 CYS A1650 11.723 -9.313 2.627 1.00 0.00 H new ATOM 0 HB3 CYS A1650 12.212 -7.872 3.496 1.00 0.00 H new ATOM 1881 N THR A1651 8.439 -8.381 4.599 1.00 0.00 N ATOM 1882 CA THR A1651 7.210 -7.759 4.183 1.00 0.00 C ATOM 1883 C THR A1651 6.857 -6.548 5.076 1.00 0.00 C ATOM 1884 O THR A1651 6.633 -6.680 6.273 1.00 0.00 O ATOM 1885 CB THR A1651 6.133 -8.823 4.248 1.00 0.00 C ATOM 1886 OG1 THR A1651 6.618 -9.943 3.528 1.00 0.00 O ATOM 1887 CG2 THR A1651 4.864 -8.363 3.604 1.00 0.00 C ATOM 0 H THR A1651 8.342 -8.977 5.421 1.00 0.00 H new ATOM 0 HA THR A1651 7.305 -7.368 3.170 1.00 0.00 H new ATOM 0 HB THR A1651 5.916 -9.056 5.290 1.00 0.00 H new ATOM 0 HG1 THR A1651 7.242 -9.641 2.835 1.00 0.00 H new ATOM 0 HG21 THR A1651 4.115 -9.153 3.670 1.00 0.00 H new ATOM 0 HG22 THR A1651 4.498 -7.473 4.115 1.00 0.00 H new ATOM 0 HG23 THR A1651 5.052 -8.128 2.556 1.00 0.00 H new ATOM 1895 N LEU A1652 6.900 -5.394 4.479 1.00 0.00 N ATOM 1896 CA LEU A1652 6.610 -4.112 5.103 1.00 0.00 C ATOM 1897 C LEU A1652 5.098 -3.948 5.289 1.00 0.00 C ATOM 1898 O LEU A1652 4.391 -3.654 4.327 1.00 0.00 O ATOM 1899 CB LEU A1652 7.100 -2.956 4.183 1.00 0.00 C ATOM 1900 CG LEU A1652 8.618 -2.658 4.021 1.00 0.00 C ATOM 1901 CD1 LEU A1652 9.184 -2.027 5.257 1.00 0.00 C ATOM 1902 CD2 LEU A1652 9.430 -3.886 3.631 1.00 0.00 C ATOM 0 H LEU A1652 7.150 -5.304 3.494 1.00 0.00 H new ATOM 0 HA LEU A1652 7.117 -4.078 6.067 1.00 0.00 H new ATOM 0 HB2 LEU A1652 6.703 -3.149 3.186 1.00 0.00 H new ATOM 0 HB3 LEU A1652 6.630 -2.040 4.541 1.00 0.00 H new ATOM 0 HG LEU A1652 8.698 -1.950 3.196 1.00 0.00 H new ATOM 0 HD11 LEU A1652 10.246 -1.831 5.112 1.00 0.00 H new ATOM 0 HD12 LEU A1652 8.666 -1.089 5.456 1.00 0.00 H new ATOM 0 HD13 LEU A1652 9.052 -2.701 6.103 1.00 0.00 H new ATOM 0 HD21 LEU A1652 10.480 -3.612 3.534 1.00 0.00 H new ATOM 0 HD22 LEU A1652 9.324 -4.651 4.400 1.00 0.00 H new ATOM 0 HD23 LEU A1652 9.067 -4.275 2.680 1.00 0.00 H new ATOM 1914 N TYR A1653 4.599 -4.171 6.482 1.00 0.00 N ATOM 1915 CA TYR A1653 3.186 -3.974 6.749 1.00 0.00 C ATOM 1916 C TYR A1653 2.909 -2.529 7.068 1.00 0.00 C ATOM 1917 O TYR A1653 3.448 -1.967 8.043 1.00 0.00 O ATOM 1918 CB TYR A1653 2.655 -4.881 7.878 1.00 0.00 C ATOM 1919 CG TYR A1653 2.413 -6.320 7.479 1.00 0.00 C ATOM 1920 CD1 TYR A1653 3.414 -7.278 7.558 1.00 0.00 C ATOM 1921 CD2 TYR A1653 1.163 -6.718 7.016 1.00 0.00 C ATOM 1922 CE1 TYR A1653 3.170 -8.589 7.181 1.00 0.00 C ATOM 1923 CE2 TYR A1653 0.921 -8.020 6.645 1.00 0.00 C ATOM 1924 CZ TYR A1653 1.923 -8.949 6.727 1.00 0.00 C ATOM 1925 OH TYR A1653 1.677 -10.253 6.342 1.00 0.00 O ATOM 0 H TYR A1653 5.145 -4.488 7.283 1.00 0.00 H new ATOM 0 HA TYR A1653 2.654 -4.256 5.841 1.00 0.00 H new ATOM 0 HB2 TYR A1653 3.367 -4.863 8.704 1.00 0.00 H new ATOM 0 HB3 TYR A1653 1.721 -4.461 8.253 1.00 0.00 H new ATOM 0 HD1 TYR A1653 4.394 -6.999 7.917 1.00 0.00 H new ATOM 0 HD2 TYR A1653 0.368 -5.991 6.947 1.00 0.00 H new ATOM 0 HE1 TYR A1653 3.957 -9.326 7.244 1.00 0.00 H new ATOM 0 HE2 TYR A1653 -0.057 -8.309 6.290 1.00 0.00 H new ATOM 0 HH TYR A1653 0.746 -10.337 6.048 1.00 0.00 H new ATOM 1935 N PHE A1654 2.085 -1.923 6.265 1.00 0.00 N ATOM 1936 CA PHE A1654 1.714 -0.545 6.469 1.00 0.00 C ATOM 1937 C PHE A1654 0.247 -0.463 6.789 1.00 0.00 C ATOM 1938 O PHE A1654 -0.540 -1.208 6.242 1.00 0.00 O ATOM 1939 CB PHE A1654 1.999 0.306 5.223 1.00 0.00 C ATOM 1940 CG PHE A1654 3.446 0.407 4.851 1.00 0.00 C ATOM 1941 CD1 PHE A1654 4.320 1.141 5.625 1.00 0.00 C ATOM 1942 CD2 PHE A1654 3.929 -0.230 3.725 1.00 0.00 C ATOM 1943 CE1 PHE A1654 5.651 1.241 5.285 1.00 0.00 C ATOM 1944 CE2 PHE A1654 5.256 -0.132 3.379 1.00 0.00 C ATOM 1945 CZ PHE A1654 6.119 0.604 4.160 1.00 0.00 C ATOM 0 H PHE A1654 1.651 -2.363 5.453 1.00 0.00 H new ATOM 0 HA PHE A1654 2.309 -0.157 7.296 1.00 0.00 H new ATOM 0 HB2 PHE A1654 1.450 -0.113 4.380 1.00 0.00 H new ATOM 0 HB3 PHE A1654 1.610 1.310 5.389 1.00 0.00 H new ATOM 0 HD1 PHE A1654 3.956 1.644 6.509 1.00 0.00 H new ATOM 0 HD2 PHE A1654 3.258 -0.811 3.110 1.00 0.00 H new ATOM 0 HE1 PHE A1654 6.325 1.818 5.900 1.00 0.00 H new ATOM 0 HE2 PHE A1654 5.622 -0.632 2.495 1.00 0.00 H new ATOM 0 HZ PHE A1654 7.162 0.681 3.889 1.00 0.00 H new ATOM 1955 N SER A1655 -0.103 0.414 7.666 1.00 0.00 N ATOM 1956 CA SER A1655 -1.471 0.665 7.991 1.00 0.00 C ATOM 1957 C SER A1655 -1.828 2.025 7.441 1.00 0.00 C ATOM 1958 O SER A1655 -1.213 3.028 7.792 1.00 0.00 O ATOM 1959 CB SER A1655 -1.709 0.556 9.518 1.00 0.00 C ATOM 1960 OG SER A1655 -0.678 1.174 10.282 1.00 0.00 O ATOM 0 H SER A1655 0.561 0.987 8.187 1.00 0.00 H new ATOM 0 HA SER A1655 -2.121 -0.085 7.540 1.00 0.00 H new ATOM 0 HB2 SER A1655 -2.665 1.017 9.766 1.00 0.00 H new ATOM 0 HB3 SER A1655 -1.781 -0.496 9.796 1.00 0.00 H new ATOM 0 HG SER A1655 0.055 1.440 9.688 1.00 0.00 H new ATOM 1966 N TRP A1656 -2.761 2.057 6.559 1.00 0.00 N ATOM 1967 CA TRP A1656 -3.106 3.254 5.881 1.00 0.00 C ATOM 1968 C TRP A1656 -4.543 3.571 6.178 1.00 0.00 C ATOM 1969 O TRP A1656 -5.412 2.764 5.930 1.00 0.00 O ATOM 1970 CB TRP A1656 -2.920 3.024 4.384 1.00 0.00 C ATOM 1971 CG TRP A1656 -2.929 4.259 3.546 1.00 0.00 C ATOM 1972 CD1 TRP A1656 -3.967 5.116 3.341 1.00 0.00 C ATOM 1973 CD2 TRP A1656 -1.849 4.744 2.756 1.00 0.00 C ATOM 1974 NE1 TRP A1656 -3.586 6.115 2.496 1.00 0.00 N ATOM 1975 CE2 TRP A1656 -2.286 5.906 2.120 1.00 0.00 C ATOM 1976 CE3 TRP A1656 -0.544 4.309 2.538 1.00 0.00 C ATOM 1977 CZ2 TRP A1656 -1.468 6.638 1.273 1.00 0.00 C ATOM 1978 CZ3 TRP A1656 0.265 5.033 1.700 1.00 0.00 C ATOM 1979 CH2 TRP A1656 -0.199 6.187 1.080 1.00 0.00 C ATOM 0 H TRP A1656 -3.313 1.244 6.285 1.00 0.00 H new ATOM 0 HA TRP A1656 -2.478 4.084 6.204 1.00 0.00 H new ATOM 0 HB2 TRP A1656 -1.975 2.504 4.227 1.00 0.00 H new ATOM 0 HB3 TRP A1656 -3.711 2.360 4.033 1.00 0.00 H new ATOM 0 HD1 TRP A1656 -4.948 5.018 3.783 1.00 0.00 H new ATOM 0 HE1 TRP A1656 -4.173 6.892 2.193 1.00 0.00 H new ATOM 0 HE3 TRP A1656 -0.175 3.416 3.021 1.00 0.00 H new ATOM 0 HZ2 TRP A1656 -1.825 7.533 0.785 1.00 0.00 H new ATOM 0 HZ3 TRP A1656 1.277 4.702 1.519 1.00 0.00 H new ATOM 0 HH2 TRP A1656 0.463 6.739 0.430 1.00 0.00 H new ATOM 1990 N HIS A1657 -4.788 4.716 6.713 1.00 0.00 N ATOM 1991 CA HIS A1657 -6.132 5.126 7.019 1.00 0.00 C ATOM 1992 C HIS A1657 -6.682 5.860 5.798 1.00 0.00 C ATOM 1993 O HIS A1657 -6.315 6.987 5.547 1.00 0.00 O ATOM 1994 CB HIS A1657 -6.145 6.072 8.240 1.00 0.00 C ATOM 1995 CG HIS A1657 -5.572 5.498 9.509 1.00 0.00 C ATOM 1996 ND1 HIS A1657 -6.305 4.768 10.402 1.00 0.00 N ATOM 1997 CD2 HIS A1657 -4.320 5.568 10.030 1.00 0.00 C ATOM 1998 CE1 HIS A1657 -5.547 4.411 11.414 1.00 0.00 C ATOM 1999 NE2 HIS A1657 -4.332 4.882 11.217 1.00 0.00 N ATOM 0 H HIS A1657 -4.071 5.400 6.954 1.00 0.00 H new ATOM 0 HA HIS A1657 -6.742 4.255 7.258 1.00 0.00 H new ATOM 0 HB2 HIS A1657 -5.588 6.974 7.985 1.00 0.00 H new ATOM 0 HB3 HIS A1657 -7.174 6.376 8.431 1.00 0.00 H new ATOM 0 HD2 HIS A1657 -3.471 6.071 9.590 1.00 0.00 H new ATOM 0 HE1 HIS A1657 -5.866 3.829 12.266 1.00 0.00 H new ATOM 0 HE2 HIS A1657 -3.535 4.757 11.842 1.00 0.00 H new ATOM 2008 N THR A1658 -7.525 5.231 5.031 1.00 0.00 N ATOM 2009 CA THR A1658 -8.042 5.872 3.856 1.00 0.00 C ATOM 2010 C THR A1658 -9.572 5.688 3.730 1.00 0.00 C ATOM 2011 O THR A1658 -10.117 4.628 4.018 1.00 0.00 O ATOM 2012 CB THR A1658 -7.302 5.427 2.555 1.00 0.00 C ATOM 2013 OG1 THR A1658 -7.733 6.223 1.451 1.00 0.00 O ATOM 2014 CG2 THR A1658 -7.576 3.985 2.243 1.00 0.00 C ATOM 0 H THR A1658 -7.867 4.284 5.195 1.00 0.00 H new ATOM 0 HA THR A1658 -7.847 6.938 3.976 1.00 0.00 H new ATOM 0 HB THR A1658 -6.233 5.559 2.720 1.00 0.00 H new ATOM 0 HG1 THR A1658 -7.482 7.158 1.604 1.00 0.00 H new ATOM 0 HG21 THR A1658 -7.048 3.703 1.332 1.00 0.00 H new ATOM 0 HG22 THR A1658 -7.232 3.362 3.069 1.00 0.00 H new ATOM 0 HG23 THR A1658 -8.647 3.841 2.101 1.00 0.00 H new ATOM 2022 N PRO A1659 -10.288 6.757 3.341 1.00 0.00 N ATOM 2023 CA PRO A1659 -11.758 6.748 3.128 1.00 0.00 C ATOM 2024 C PRO A1659 -12.116 5.954 1.890 1.00 0.00 C ATOM 2025 O PRO A1659 -13.272 5.663 1.605 1.00 0.00 O ATOM 2026 CB PRO A1659 -12.075 8.222 2.900 1.00 0.00 C ATOM 2027 CG PRO A1659 -10.876 8.942 3.396 1.00 0.00 C ATOM 2028 CD PRO A1659 -9.737 8.077 3.076 1.00 0.00 C ATOM 0 HA PRO A1659 -12.306 6.298 3.956 1.00 0.00 H new ATOM 0 HB2 PRO A1659 -12.255 8.431 1.845 1.00 0.00 H new ATOM 0 HB3 PRO A1659 -12.971 8.524 3.442 1.00 0.00 H new ATOM 0 HG2 PRO A1659 -10.776 9.915 2.915 1.00 0.00 H new ATOM 0 HG3 PRO A1659 -10.943 9.122 4.469 1.00 0.00 H new ATOM 0 HD2 PRO A1659 -9.417 8.187 2.040 1.00 0.00 H new ATOM 0 HD3 PRO A1659 -8.871 8.292 3.701 1.00 0.00 H new ATOM 2036 N LEU A1660 -11.098 5.640 1.161 1.00 0.00 N ATOM 2037 CA LEU A1660 -11.166 4.898 -0.056 1.00 0.00 C ATOM 2038 C LEU A1660 -11.325 3.450 0.275 1.00 0.00 C ATOM 2039 O LEU A1660 -11.791 2.661 -0.527 1.00 0.00 O ATOM 2040 CB LEU A1660 -9.883 5.108 -0.841 1.00 0.00 C ATOM 2041 CG LEU A1660 -9.603 6.507 -1.474 1.00 0.00 C ATOM 2042 CD1 LEU A1660 -9.893 7.653 -0.526 1.00 0.00 C ATOM 2043 CD2 LEU A1660 -8.152 6.579 -1.879 1.00 0.00 C ATOM 0 H LEU A1660 -10.146 5.908 1.410 1.00 0.00 H new ATOM 0 HA LEU A1660 -12.012 5.233 -0.656 1.00 0.00 H new ATOM 0 HB2 LEU A1660 -9.050 4.874 -0.178 1.00 0.00 H new ATOM 0 HB3 LEU A1660 -9.866 4.373 -1.646 1.00 0.00 H new ATOM 0 HG LEU A1660 -10.268 6.611 -2.331 1.00 0.00 H new ATOM 0 HD11 LEU A1660 -9.679 8.599 -1.023 1.00 0.00 H new ATOM 0 HD12 LEU A1660 -10.943 7.626 -0.233 1.00 0.00 H new ATOM 0 HD13 LEU A1660 -9.266 7.559 0.361 1.00 0.00 H new ATOM 0 HD21 LEU A1660 -7.946 7.553 -2.323 1.00 0.00 H new ATOM 0 HD22 LEU A1660 -7.522 6.440 -1.001 1.00 0.00 H new ATOM 0 HD23 LEU A1660 -7.938 5.796 -2.607 1.00 0.00 H new ATOM 2055 N ALA A1661 -10.932 3.117 1.498 1.00 0.00 N ATOM 2056 CA ALA A1661 -11.051 1.786 2.012 1.00 0.00 C ATOM 2057 C ALA A1661 -12.413 1.629 2.600 1.00 0.00 C ATOM 2058 O ALA A1661 -12.807 0.548 3.051 1.00 0.00 O ATOM 2059 CB ALA A1661 -10.007 1.543 3.064 1.00 0.00 C ATOM 0 H ALA A1661 -10.520 3.779 2.156 1.00 0.00 H new ATOM 0 HA ALA A1661 -10.904 1.063 1.210 1.00 0.00 H new ATOM 0 HB1 ALA A1661 -10.107 0.528 3.448 1.00 0.00 H new ATOM 0 HB2 ALA A1661 -9.016 1.671 2.629 1.00 0.00 H new ATOM 0 HB3 ALA A1661 -10.140 2.254 3.879 1.00 0.00 H new ATOM 2065 N CYS A1662 -13.122 2.720 2.626 1.00 0.00 N ATOM 2066 CA CYS A1662 -14.466 2.709 3.099 1.00 0.00 C ATOM 2067 C CYS A1662 -15.354 2.340 1.952 1.00 0.00 C ATOM 2068 O CYS A1662 -15.239 2.929 0.849 1.00 0.00 O ATOM 2069 CB CYS A1662 -14.859 4.074 3.638 1.00 0.00 C ATOM 2070 SG CYS A1662 -13.808 4.674 4.997 1.00 0.00 S ATOM 0 H CYS A1662 -12.784 3.633 2.322 1.00 0.00 H new ATOM 0 HA CYS A1662 -14.566 1.989 3.911 1.00 0.00 H new ATOM 0 HB2 CYS A1662 -14.826 4.797 2.823 1.00 0.00 H new ATOM 0 HB3 CYS A1662 -15.892 4.031 3.985 1.00 0.00 H new