USER MOD reduce.3.24.130724 H: found=0, std=0, add=1086, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1089 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A1631 THR OG1 : rot -96:sc= 1.28 USER MOD Set 1.2: A1638 ASN : amide:sc= -0.202 K(o=1.1,f=-0.4) USER MOD Set 2.1: A1589 ASN : amide:sc= -0.505 K(o=1.2,f=-7.3!) USER MOD Set 2.2: A1592 SER OG : rot 128:sc= 1.7 USER MOD Set 3.1: A1550 ASN : amide:sc= 0.195 K(o=1.6,f=0.37) USER MOD Set 3.2: A1554 TYR OH : rot 33:sc= 1.44 USER MOD Set 4.1: A1546 ASN : amide:sc= 0.149! K(o=0.27!,f=-3.8) USER MOD Set 4.2: A1549 LYS NZ :NH3+ -117:sc= 0.123 (180deg=0) USER MOD Set 5.1: A1536 ASN : amide:sc= 1.44 K(o=2.2,f=-9.9!) USER MOD Set 5.2: A1539 THR OG1 : rot -163:sc= 0.803 USER MOD Set 6.1: A1529 GLN : amide:sc= -0.369 K(o=-2.7,f=-6.1!) USER MOD Set 6.2: A1531 ASN :FLIP amide:sc= -0.905 F(o=-3.6,f=-2.7) USER MOD Set 6.3: A1533 GLN :FLIP amide:sc= -0.703 X(o=-3.1,f=-2.7) USER MOD Set 6.4: A1535 THR OG1 : rot 68:sc= -0.767 USER MOD Single : A1524 MET CE :methyl -165:sc= -0.108 (180deg=-0.543) USER MOD Single : A1525 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1526 SER OG : rot 170:sc= 0 USER MOD Single : A1527 ASN : amide:sc= -0.107 K(o=-0.11,f=-5.6!) USER MOD Single : A1541 HIS :FLIP no HE2:sc= -0.0556 F(o=-1.1,f=-0.056) USER MOD Single : A1547 SER OG : rot 180:sc= 0.00184 USER MOD Single : A1552 SER OG : rot 180:sc= -0.749 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 USER MOD Single : A1561 LYS NZ :NH3+ 169:sc= 1.25 (180deg=1.17) USER MOD Single : A1565 TYR OH : rot 180:sc= 0 USER MOD Single : A1572 THR OG1 : rot 60:sc= -0.724 USER MOD Single : A1573 LYS NZ :NH3+ 172:sc=-0.00129 (180deg=-0.0731) USER MOD Single : A1574 ASN : amide:sc= -0.0422 K(o=-0.042,f=-1.4!) USER MOD Single : A1577 SER OG : rot 180:sc= 0 USER MOD Single : A1586 THR OG1 : rot 180:sc= -0.611 USER MOD Single : A1587 LYS NZ :NH3+ -142:sc= 0.105 (180deg=-0.0758) USER MOD Single : A1594 ASN : amide:sc= 1.41 K(o=1.4,f=-1) USER MOD Single : A1595 SER OG : rot 180:sc= 0 USER MOD Single : A1596 GLN :FLIP amide:sc= -0.899 F(o=-1.9!,f=-0.9) USER MOD Single : A1598 MET CE :methyl -142:sc= -0.762 (180deg=-3.67!) USER MOD Single : A1599 TYR OH : rot 180:sc= -0.578 USER MOD Single : A1602 GLN :FLIP amide:sc= 0 F(o=-0.74,f=0) USER MOD Single : A1605 GLN :FLIP amide:sc= -0.323 F(o=-2.4!,f=-0.32) USER MOD Single : A1608 TYR OH : rot -90:sc= -1.11! USER MOD Single : A1616 SER OG : rot 180:sc= 0 USER MOD Single : A1617 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1618 ASN : amide:sc= 0.768 K(o=0.77,f=-0.16) USER MOD Single : A1621 LYS NZ :NH3+ -142:sc= 1.13 (180deg=0.469) USER MOD Single : A1622 TYR OH : rot 180:sc= 0 USER MOD Single : A1623 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1624 SER OG : rot 67:sc= -0.241 USER MOD Single : A1627 SER OG : rot 180:sc= -0.0555 USER MOD Single : A1632 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A1634 SER OG : rot 180:sc= 0 USER MOD Single : A1637 ASN : amide:sc= -0.0614 X(o=-0.061,f=-0.058) USER MOD Single : A1639 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1644 SER OG : rot 180:sc= 0 USER MOD Single : A1647 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1648 GLN :FLIP amide:sc= -0.0145 F(o=-1.1,f=-0.014) USER MOD Single : A1649 THR OG1 : rot -33:sc= 0.812 USER MOD Single : A1651 THR OG1 : rot -158:sc= -2.44! USER MOD Single : A1653 TYR OH : rot 180:sc= 0 USER MOD Single : A1655 SER OG : rot 180:sc= -1.91! USER MOD Single : A1657 HIS : no HD1:sc= -0.0229 X(o=-0.023,f=0) USER MOD Single : A1658 THR OG1 : rot 76:sc= -0.782! USER MOD Single : A1664 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1669 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A1670 HIS : no HD1:sc= -0.147 X(o=-0.15,f=-0.04) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A1524 -14.439 -16.824 -3.806 1.00 0.00 N ATOM 2 CA MET A1524 -13.227 -17.638 -3.739 1.00 0.00 C ATOM 3 C MET A1524 -12.041 -16.733 -3.494 1.00 0.00 C ATOM 4 O MET A1524 -11.702 -15.917 -4.349 1.00 0.00 O ATOM 5 CB MET A1524 -13.027 -18.412 -5.047 1.00 0.00 C ATOM 6 CG MET A1524 -11.779 -19.285 -5.066 1.00 0.00 C ATOM 7 SD MET A1524 -11.523 -20.114 -6.652 1.00 0.00 S ATOM 8 CE MET A1524 -13.006 -21.120 -6.758 1.00 0.00 C ATOM 0 HA MET A1524 -13.322 -18.357 -2.925 1.00 0.00 H new ATOM 0 HB2 MET A1524 -13.900 -19.040 -5.222 1.00 0.00 H new ATOM 0 HB3 MET A1524 -12.974 -17.702 -5.873 1.00 0.00 H new ATOM 0 HG2 MET A1524 -10.908 -18.670 -4.839 1.00 0.00 H new ATOM 0 HG3 MET A1524 -11.854 -20.035 -4.278 1.00 0.00 H new ATOM 0 HE1 MET A1524 -12.877 -21.878 -7.531 1.00 0.00 H new ATOM 0 HE2 MET A1524 -13.185 -21.607 -5.799 1.00 0.00 H new ATOM 0 HE3 MET A1524 -13.858 -20.487 -7.008 1.00 0.00 H new ATOM 20 N LYS A1525 -11.435 -16.866 -2.307 1.00 0.00 N ATOM 21 CA LYS A1525 -10.298 -16.029 -1.866 1.00 0.00 C ATOM 22 C LYS A1525 -10.734 -14.570 -1.726 1.00 0.00 C ATOM 23 O LYS A1525 -11.921 -14.242 -1.867 1.00 0.00 O ATOM 24 CB LYS A1525 -9.080 -16.104 -2.826 1.00 0.00 C ATOM 25 CG LYS A1525 -8.357 -17.440 -2.909 1.00 0.00 C ATOM 26 CD LYS A1525 -7.144 -17.305 -3.825 1.00 0.00 C ATOM 27 CE LYS A1525 -6.289 -18.567 -3.887 1.00 0.00 C ATOM 28 NZ LYS A1525 -6.988 -19.722 -4.492 1.00 0.00 N1+ ATOM 0 H LYS A1525 -11.718 -17.561 -1.616 1.00 0.00 H new ATOM 0 HA LYS A1525 -9.983 -16.427 -0.901 1.00 0.00 H new ATOM 0 HB2 LYS A1525 -9.419 -15.838 -3.827 1.00 0.00 H new ATOM 0 HB3 LYS A1525 -8.359 -15.345 -2.521 1.00 0.00 H new ATOM 0 HG2 LYS A1525 -8.042 -17.758 -1.915 1.00 0.00 H new ATOM 0 HG3 LYS A1525 -9.031 -18.207 -3.290 1.00 0.00 H new ATOM 0 HD2 LYS A1525 -7.483 -17.055 -4.830 1.00 0.00 H new ATOM 0 HD3 LYS A1525 -6.528 -16.474 -3.480 1.00 0.00 H new ATOM 0 HE2 LYS A1525 -5.386 -18.357 -4.461 1.00 0.00 H new ATOM 0 HE3 LYS A1525 -5.972 -18.832 -2.878 1.00 0.00 H new ATOM 0 HZ1 LYS A1525 -6.352 -20.545 -4.504 1.00 0.00 H new ATOM 0 HZ2 LYS A1525 -7.835 -19.947 -3.933 1.00 0.00 H new ATOM 0 HZ3 LYS A1525 -7.268 -19.487 -5.466 1.00 0.00 H new ATOM 42 N SER A1526 -9.799 -13.713 -1.432 1.00 0.00 N ATOM 43 CA SER A1526 -10.060 -12.316 -1.374 1.00 0.00 C ATOM 44 C SER A1526 -9.935 -11.749 -2.780 1.00 0.00 C ATOM 45 O SER A1526 -9.304 -12.373 -3.655 1.00 0.00 O ATOM 46 CB SER A1526 -9.056 -11.666 -0.443 1.00 0.00 C ATOM 47 OG SER A1526 -9.033 -12.353 0.806 1.00 0.00 O ATOM 0 H SER A1526 -8.834 -13.971 -1.226 1.00 0.00 H new ATOM 0 HA SER A1526 -11.063 -12.121 -0.995 1.00 0.00 H new ATOM 0 HB2 SER A1526 -8.064 -11.683 -0.895 1.00 0.00 H new ATOM 0 HB3 SER A1526 -9.317 -10.619 -0.287 1.00 0.00 H new ATOM 0 HG SER A1526 -8.276 -12.034 1.341 1.00 0.00 H new ATOM 53 N ASN A1527 -10.537 -10.620 -3.021 1.00 0.00 N ATOM 54 CA ASN A1527 -10.451 -10.013 -4.330 1.00 0.00 C ATOM 55 C ASN A1527 -9.074 -9.386 -4.493 1.00 0.00 C ATOM 56 O ASN A1527 -8.650 -8.625 -3.660 1.00 0.00 O ATOM 57 CB ASN A1527 -11.563 -8.972 -4.553 1.00 0.00 C ATOM 58 CG ASN A1527 -11.677 -8.518 -6.020 1.00 0.00 C ATOM 59 OD1 ASN A1527 -10.709 -8.480 -6.769 1.00 0.00 O ATOM 60 ND2 ASN A1527 -12.853 -8.167 -6.422 1.00 0.00 N ATOM 0 H ASN A1527 -11.090 -10.100 -2.339 1.00 0.00 H new ATOM 0 HA ASN A1527 -10.593 -10.786 -5.086 1.00 0.00 H new ATOM 0 HB2 ASN A1527 -12.516 -9.393 -4.234 1.00 0.00 H new ATOM 0 HB3 ASN A1527 -11.371 -8.103 -3.923 1.00 0.00 H new ATOM 0 HD21 ASN A1527 -12.990 -7.850 -7.382 1.00 0.00 H new ATOM 0 HD22 ASN A1527 -13.645 -8.207 -5.780 1.00 0.00 H new ATOM 67 N ILE A1528 -8.405 -9.794 -5.537 1.00 0.00 N ATOM 68 CA ILE A1528 -7.078 -9.406 -5.953 1.00 0.00 C ATOM 69 C ILE A1528 -7.207 -8.863 -7.381 1.00 0.00 C ATOM 70 O ILE A1528 -7.260 -9.639 -8.347 1.00 0.00 O ATOM 71 CB ILE A1528 -6.158 -10.675 -6.014 1.00 0.00 C ATOM 72 CG1 ILE A1528 -6.219 -11.469 -4.688 1.00 0.00 C ATOM 73 CG2 ILE A1528 -4.713 -10.277 -6.340 1.00 0.00 C ATOM 74 CD1 ILE A1528 -5.428 -12.762 -4.689 1.00 0.00 C ATOM 0 H ILE A1528 -8.812 -10.472 -6.182 1.00 0.00 H new ATOM 0 HA ILE A1528 -6.657 -8.675 -5.263 1.00 0.00 H new ATOM 0 HB ILE A1528 -6.526 -11.322 -6.810 1.00 0.00 H new ATOM 0 HG12 ILE A1528 -5.851 -10.834 -3.882 1.00 0.00 H new ATOM 0 HG13 ILE A1528 -7.261 -11.696 -4.464 1.00 0.00 H new ATOM 0 HG21 ILE A1528 -4.089 -11.170 -6.378 1.00 0.00 H new ATOM 0 HG22 ILE A1528 -4.684 -9.772 -7.306 1.00 0.00 H new ATOM 0 HG23 ILE A1528 -4.338 -9.605 -5.568 1.00 0.00 H new ATOM 0 HD11 ILE A1528 -5.529 -13.251 -3.720 1.00 0.00 H new ATOM 0 HD12 ILE A1528 -5.809 -13.421 -5.469 1.00 0.00 H new ATOM 0 HD13 ILE A1528 -4.377 -12.545 -4.879 1.00 0.00 H new ATOM 86 N GLN A1529 -7.349 -7.585 -7.519 1.00 0.00 N ATOM 87 CA GLN A1529 -7.579 -6.992 -8.815 1.00 0.00 C ATOM 88 C GLN A1529 -6.381 -6.116 -9.193 1.00 0.00 C ATOM 89 O GLN A1529 -5.654 -5.628 -8.324 1.00 0.00 O ATOM 90 CB GLN A1529 -8.890 -6.215 -8.764 1.00 0.00 C ATOM 91 CG GLN A1529 -9.439 -5.717 -10.087 1.00 0.00 C ATOM 92 CD GLN A1529 -10.889 -5.265 -9.962 1.00 0.00 C ATOM 93 OE1 GLN A1529 -11.347 -4.829 -8.902 1.00 0.00 O ATOM 94 NE2 GLN A1529 -11.610 -5.342 -11.036 1.00 0.00 N ATOM 0 H GLN A1529 -7.311 -6.918 -6.748 1.00 0.00 H new ATOM 0 HA GLN A1529 -7.672 -7.752 -9.591 1.00 0.00 H new ATOM 0 HB2 GLN A1529 -9.644 -6.851 -8.300 1.00 0.00 H new ATOM 0 HB3 GLN A1529 -8.751 -5.355 -8.108 1.00 0.00 H new ATOM 0 HG2 GLN A1529 -8.829 -4.888 -10.445 1.00 0.00 H new ATOM 0 HG3 GLN A1529 -9.368 -6.510 -10.832 1.00 0.00 H new ATOM 0 HE21 GLN A1529 -11.204 -5.707 -11.898 1.00 0.00 H new ATOM 0 HE22 GLN A1529 -12.583 -5.038 -11.020 1.00 0.00 H new ATOM 103 N ASP A1530 -6.184 -5.906 -10.466 1.00 0.00 N ATOM 104 CA ASP A1530 -4.994 -5.226 -10.942 1.00 0.00 C ATOM 105 C ASP A1530 -5.337 -4.028 -11.774 1.00 0.00 C ATOM 106 O ASP A1530 -5.435 -4.108 -12.992 1.00 0.00 O ATOM 107 CB ASP A1530 -4.075 -6.165 -11.737 1.00 0.00 C ATOM 108 CG ASP A1530 -2.744 -5.522 -12.113 1.00 0.00 C ATOM 109 OD1 ASP A1530 -1.796 -5.589 -11.305 1.00 0.00 O ATOM 110 OD2 ASP A1530 -2.610 -4.978 -13.242 1.00 0.00 O1- ATOM 0 H ASP A1530 -6.830 -6.194 -11.200 1.00 0.00 H new ATOM 0 HA ASP A1530 -4.457 -4.892 -10.054 1.00 0.00 H new ATOM 0 HB2 ASP A1530 -3.885 -7.062 -11.148 1.00 0.00 H new ATOM 0 HB3 ASP A1530 -4.588 -6.483 -12.645 1.00 0.00 H new ATOM 115 N ASN A1531 -5.642 -2.966 -11.104 1.00 0.00 N ATOM 116 CA ASN A1531 -5.858 -1.658 -11.741 1.00 0.00 C ATOM 117 C ASN A1531 -5.871 -0.602 -10.640 1.00 0.00 C ATOM 118 O ASN A1531 -6.334 0.514 -10.824 1.00 0.00 O ATOM 119 CB ASN A1531 -7.194 -1.645 -12.544 1.00 0.00 C ATOM 120 CG ASN A1531 -7.383 -0.402 -13.414 1.00 0.00 C ATOM 121 OD1 ASN A1531 -8.618 -0.022 -13.645 1.00 0.00 O flip ATOM 122 ND2 ASN A1531 -6.412 0.198 -13.885 1.00 0.00 N flip ATOM 0 H ASN A1531 -5.755 -2.955 -10.090 1.00 0.00 H new ATOM 0 HA ASN A1531 -5.059 -1.448 -12.452 1.00 0.00 H new ATOM 0 HB2 ASN A1531 -7.233 -2.530 -13.179 1.00 0.00 H new ATOM 0 HB3 ASN A1531 -8.027 -1.717 -11.845 1.00 0.00 H new ATOM 0 HD21 ASN A1531 -5.466 -0.126 -13.684 1.00 0.00 H new ATOM 0 HD22 ASN A1531 -6.556 1.018 -14.475 1.00 0.00 H new ATOM 129 N CYS A1532 -5.288 -0.979 -9.487 1.00 0.00 N ATOM 130 CA CYS A1532 -5.294 -0.176 -8.258 1.00 0.00 C ATOM 131 C CYS A1532 -6.741 0.038 -7.806 1.00 0.00 C ATOM 132 O CYS A1532 -7.100 1.029 -7.158 1.00 0.00 O ATOM 133 CB CYS A1532 -4.562 1.151 -8.458 1.00 0.00 C ATOM 134 SG CYS A1532 -4.093 1.951 -6.908 1.00 0.00 S ATOM 0 H CYS A1532 -4.793 -1.865 -9.385 1.00 0.00 H new ATOM 0 HA CYS A1532 -4.757 -0.712 -7.476 1.00 0.00 H new ATOM 0 HB2 CYS A1532 -3.666 0.977 -9.054 1.00 0.00 H new ATOM 0 HB3 CYS A1532 -5.199 1.827 -9.029 1.00 0.00 H new ATOM 139 N GLN A1533 -7.547 -0.945 -8.113 1.00 0.00 N ATOM 140 CA GLN A1533 -8.928 -0.955 -7.802 1.00 0.00 C ATOM 141 C GLN A1533 -9.255 -2.342 -7.331 1.00 0.00 C ATOM 142 O GLN A1533 -8.549 -3.281 -7.704 1.00 0.00 O ATOM 143 CB GLN A1533 -9.766 -0.611 -9.033 1.00 0.00 C ATOM 144 CG GLN A1533 -9.677 -1.629 -10.169 1.00 0.00 C ATOM 145 CD GLN A1533 -10.605 -1.329 -11.329 1.00 0.00 C ATOM 146 OE1 GLN A1533 -10.844 -0.079 -11.590 1.00 0.00 O flip ATOM 147 NE2 GLN A1533 -11.069 -2.237 -12.022 1.00 0.00 N flip ATOM 0 H GLN A1533 -7.236 -1.784 -8.603 1.00 0.00 H new ATOM 0 HA GLN A1533 -9.153 -0.211 -7.038 1.00 0.00 H new ATOM 0 HB2 GLN A1533 -10.809 -0.514 -8.731 1.00 0.00 H new ATOM 0 HB3 GLN A1533 -9.452 0.362 -9.410 1.00 0.00 H new ATOM 0 HG2 GLN A1533 -8.651 -1.663 -10.535 1.00 0.00 H new ATOM 0 HG3 GLN A1533 -9.908 -2.619 -9.777 1.00 0.00 H new ATOM 0 HE21 GLN A1533 -10.864 -3.209 -11.792 1.00 0.00 H new ATOM 0 HE22 GLN A1533 -11.658 -2.016 -12.825 1.00 0.00 H new ATOM 156 N VAL A1534 -10.248 -2.475 -6.495 1.00 0.00 N ATOM 157 CA VAL A1534 -10.659 -3.771 -6.026 1.00 0.00 C ATOM 158 C VAL A1534 -12.151 -3.708 -5.786 1.00 0.00 C ATOM 159 O VAL A1534 -12.653 -2.675 -5.413 1.00 0.00 O ATOM 160 CB VAL A1534 -9.879 -4.186 -4.738 1.00 0.00 C ATOM 161 CG1 VAL A1534 -10.223 -3.356 -3.538 1.00 0.00 C ATOM 162 CG2 VAL A1534 -10.057 -5.618 -4.414 1.00 0.00 C ATOM 0 H VAL A1534 -10.791 -1.696 -6.122 1.00 0.00 H new ATOM 0 HA VAL A1534 -10.432 -4.536 -6.768 1.00 0.00 H new ATOM 0 HB VAL A1534 -8.832 -4.002 -4.978 1.00 0.00 H new ATOM 0 HG11 VAL A1534 -9.645 -3.699 -2.680 1.00 0.00 H new ATOM 0 HG12 VAL A1534 -9.988 -2.311 -3.739 1.00 0.00 H new ATOM 0 HG13 VAL A1534 -11.287 -3.454 -3.321 1.00 0.00 H new ATOM 0 HG21 VAL A1534 -9.496 -5.859 -3.511 1.00 0.00 H new ATOM 0 HG22 VAL A1534 -11.115 -5.825 -4.251 1.00 0.00 H new ATOM 0 HG23 VAL A1534 -9.692 -6.226 -5.241 1.00 0.00 H new ATOM 172 N THR A1535 -12.859 -4.749 -6.045 1.00 0.00 N ATOM 173 CA THR A1535 -14.288 -4.694 -5.915 1.00 0.00 C ATOM 174 C THR A1535 -14.729 -5.577 -4.763 1.00 0.00 C ATOM 175 O THR A1535 -14.264 -6.704 -4.639 1.00 0.00 O ATOM 176 CB THR A1535 -14.925 -5.195 -7.208 1.00 0.00 C ATOM 177 OG1 THR A1535 -14.250 -4.601 -8.322 1.00 0.00 O ATOM 178 CG2 THR A1535 -16.389 -4.817 -7.260 1.00 0.00 C ATOM 0 H THR A1535 -12.484 -5.648 -6.347 1.00 0.00 H new ATOM 0 HA THR A1535 -14.599 -3.667 -5.722 1.00 0.00 H new ATOM 0 HB THR A1535 -14.839 -6.281 -7.246 1.00 0.00 H new ATOM 0 HG1 THR A1535 -13.336 -4.951 -8.375 1.00 0.00 H new ATOM 0 HG21 THR A1535 -16.826 -5.183 -8.189 1.00 0.00 H new ATOM 0 HG22 THR A1535 -16.910 -5.263 -6.413 1.00 0.00 H new ATOM 0 HG23 THR A1535 -16.487 -3.732 -7.215 1.00 0.00 H new ATOM 186 N ASN A1536 -15.545 -5.042 -3.880 1.00 0.00 N ATOM 187 CA ASN A1536 -16.094 -5.846 -2.784 1.00 0.00 C ATOM 188 C ASN A1536 -16.934 -6.955 -3.387 1.00 0.00 C ATOM 189 O ASN A1536 -17.918 -6.670 -4.061 1.00 0.00 O ATOM 190 CB ASN A1536 -17.038 -5.040 -1.882 1.00 0.00 C ATOM 191 CG ASN A1536 -17.420 -5.814 -0.590 1.00 0.00 C ATOM 192 OD1 ASN A1536 -17.328 -7.025 -0.521 1.00 0.00 O ATOM 193 ND2 ASN A1536 -17.950 -5.151 0.360 1.00 0.00 N ATOM 0 H ASN A1536 -15.846 -4.067 -3.889 1.00 0.00 H new ATOM 0 HA ASN A1536 -15.252 -6.209 -2.194 1.00 0.00 H new ATOM 0 HB2 ASN A1536 -16.562 -4.097 -1.611 1.00 0.00 H new ATOM 0 HB3 ASN A1536 -17.943 -4.792 -2.436 1.00 0.00 H new ATOM 0 HD21 ASN A1536 -18.301 -5.635 1.186 1.00 0.00 H new ATOM 0 HD22 ASN A1536 -18.023 -4.136 0.294 1.00 0.00 H new ATOM 200 N PRO A1537 -16.601 -8.211 -3.131 1.00 0.00 N ATOM 201 CA PRO A1537 -17.363 -9.345 -3.647 1.00 0.00 C ATOM 202 C PRO A1537 -18.769 -9.472 -3.017 1.00 0.00 C ATOM 203 O PRO A1537 -19.544 -10.354 -3.397 1.00 0.00 O ATOM 204 CB PRO A1537 -16.514 -10.541 -3.247 1.00 0.00 C ATOM 205 CG PRO A1537 -15.742 -10.080 -2.072 1.00 0.00 C ATOM 206 CD PRO A1537 -15.433 -8.652 -2.336 1.00 0.00 C ATOM 0 HA PRO A1537 -17.542 -9.248 -4.718 1.00 0.00 H new ATOM 0 HB2 PRO A1537 -17.135 -11.402 -2.999 1.00 0.00 H new ATOM 0 HB3 PRO A1537 -15.854 -10.847 -4.059 1.00 0.00 H new ATOM 0 HG2 PRO A1537 -16.319 -10.194 -1.154 1.00 0.00 H new ATOM 0 HG3 PRO A1537 -14.829 -10.663 -1.949 1.00 0.00 H new ATOM 0 HD2 PRO A1537 -15.332 -8.082 -1.413 1.00 0.00 H new ATOM 0 HD3 PRO A1537 -14.500 -8.534 -2.887 1.00 0.00 H new ATOM 214 N ALA A1538 -19.093 -8.616 -2.053 1.00 0.00 N ATOM 215 CA ALA A1538 -20.385 -8.677 -1.412 1.00 0.00 C ATOM 216 C ALA A1538 -21.338 -7.654 -1.997 1.00 0.00 C ATOM 217 O ALA A1538 -22.546 -7.876 -2.046 1.00 0.00 O ATOM 218 CB ALA A1538 -20.243 -8.455 0.084 1.00 0.00 C ATOM 0 H ALA A1538 -18.478 -7.880 -1.706 1.00 0.00 H new ATOM 0 HA ALA A1538 -20.799 -9.670 -1.590 1.00 0.00 H new ATOM 0 HB1 ALA A1538 -21.225 -8.504 0.554 1.00 0.00 H new ATOM 0 HB2 ALA A1538 -19.600 -9.227 0.507 1.00 0.00 H new ATOM 0 HB3 ALA A1538 -19.802 -7.475 0.266 1.00 0.00 H new ATOM 224 N THR A1539 -20.806 -6.549 -2.449 1.00 0.00 N ATOM 225 CA THR A1539 -21.638 -5.458 -2.912 1.00 0.00 C ATOM 226 C THR A1539 -21.400 -5.131 -4.358 1.00 0.00 C ATOM 227 O THR A1539 -22.304 -4.676 -5.068 1.00 0.00 O ATOM 228 CB THR A1539 -21.344 -4.213 -2.087 1.00 0.00 C ATOM 229 OG1 THR A1539 -19.950 -3.911 -2.217 1.00 0.00 O ATOM 230 CG2 THR A1539 -21.667 -4.457 -0.627 1.00 0.00 C ATOM 0 H THR A1539 -19.803 -6.376 -2.508 1.00 0.00 H new ATOM 0 HA THR A1539 -22.675 -5.774 -2.799 1.00 0.00 H new ATOM 0 HB THR A1539 -21.956 -3.384 -2.444 1.00 0.00 H new ATOM 0 HG1 THR A1539 -19.681 -3.294 -1.505 1.00 0.00 H new ATOM 0 HG21 THR A1539 -21.451 -3.557 -0.051 1.00 0.00 H new ATOM 0 HG22 THR A1539 -22.723 -4.708 -0.525 1.00 0.00 H new ATOM 0 HG23 THR A1539 -21.060 -5.281 -0.253 1.00 0.00 H new ATOM 238 N GLY A1540 -20.203 -5.372 -4.792 1.00 0.00 N ATOM 239 CA GLY A1540 -19.795 -4.958 -6.070 1.00 0.00 C ATOM 240 C GLY A1540 -19.278 -3.547 -6.014 1.00 0.00 C ATOM 241 O GLY A1540 -19.099 -2.904 -7.045 1.00 0.00 O ATOM 0 H GLY A1540 -19.488 -5.865 -4.257 1.00 0.00 H new ATOM 0 HA2 GLY A1540 -19.018 -5.624 -6.446 1.00 0.00 H new ATOM 0 HA3 GLY A1540 -20.632 -5.020 -6.766 1.00 0.00 H new ATOM 245 N HIS A1541 -19.065 -3.037 -4.796 1.00 0.00 N ATOM 246 CA HIS A1541 -18.481 -1.717 -4.643 1.00 0.00 C ATOM 247 C HIS A1541 -16.996 -1.736 -4.983 1.00 0.00 C ATOM 248 O HIS A1541 -16.193 -2.350 -4.282 1.00 0.00 O ATOM 249 CB HIS A1541 -18.709 -1.137 -3.233 1.00 0.00 C ATOM 250 CG HIS A1541 -18.045 0.204 -2.999 1.00 0.00 C ATOM 251 ND1 HIS A1541 -16.975 0.542 -2.246 1.00 0.00 N flip ATOM 252 CD2 HIS A1541 -18.465 1.367 -3.591 1.00 0.00 C flip ATOM 253 CE1 HIS A1541 -16.776 1.885 -2.398 1.00 0.00 C flip ATOM 254 NE2 HIS A1541 -17.688 2.357 -3.218 1.00 0.00 N flip ATOM 0 H HIS A1541 -19.286 -3.514 -3.922 1.00 0.00 H new ATOM 0 HA HIS A1541 -18.991 -1.061 -5.348 1.00 0.00 H new ATOM 0 HB2 HIS A1541 -19.781 -1.034 -3.064 1.00 0.00 H new ATOM 0 HB3 HIS A1541 -18.337 -1.848 -2.495 1.00 0.00 H new ATOM 0 HD1 HIS A1541 -16.418 -0.089 -1.670 1.00 0.00 H new ATOM 0 HD2 HIS A1541 -19.307 1.455 -4.262 1.00 0.00 H new ATOM 0 HE1 HIS A1541 -15.998 2.463 -1.923 1.00 0.00 H new ATOM 263 N LEU A1542 -16.670 -1.100 -6.066 1.00 0.00 N ATOM 264 CA LEU A1542 -15.327 -0.922 -6.517 1.00 0.00 C ATOM 265 C LEU A1542 -14.625 0.139 -5.660 1.00 0.00 C ATOM 266 O LEU A1542 -15.191 1.192 -5.341 1.00 0.00 O ATOM 267 CB LEU A1542 -15.365 -0.552 -8.026 1.00 0.00 C ATOM 268 CG LEU A1542 -14.044 -0.418 -8.816 1.00 0.00 C ATOM 269 CD1 LEU A1542 -13.301 0.875 -8.521 1.00 0.00 C ATOM 270 CD2 LEU A1542 -13.158 -1.620 -8.585 1.00 0.00 C ATOM 0 H LEU A1542 -17.361 -0.674 -6.683 1.00 0.00 H new ATOM 0 HA LEU A1542 -14.749 -1.839 -6.407 1.00 0.00 H new ATOM 0 HB2 LEU A1542 -15.971 -1.305 -8.530 1.00 0.00 H new ATOM 0 HB3 LEU A1542 -15.895 0.396 -8.115 1.00 0.00 H new ATOM 0 HG LEU A1542 -14.315 -0.379 -9.871 1.00 0.00 H new ATOM 0 HD11 LEU A1542 -12.382 0.908 -9.107 1.00 0.00 H new ATOM 0 HD12 LEU A1542 -13.931 1.725 -8.785 1.00 0.00 H new ATOM 0 HD13 LEU A1542 -13.057 0.920 -7.460 1.00 0.00 H new ATOM 0 HD21 LEU A1542 -12.233 -1.505 -9.151 1.00 0.00 H new ATOM 0 HD22 LEU A1542 -12.926 -1.702 -7.523 1.00 0.00 H new ATOM 0 HD23 LEU A1542 -13.675 -2.522 -8.914 1.00 0.00 H new ATOM 282 N PHE A1543 -13.432 -0.182 -5.286 1.00 0.00 N ATOM 283 CA PHE A1543 -12.552 0.647 -4.511 1.00 0.00 C ATOM 284 C PHE A1543 -11.445 1.083 -5.422 1.00 0.00 C ATOM 285 O PHE A1543 -11.037 0.307 -6.260 1.00 0.00 O ATOM 286 CB PHE A1543 -11.966 -0.131 -3.339 1.00 0.00 C ATOM 287 CG PHE A1543 -12.953 -0.606 -2.309 1.00 0.00 C ATOM 288 CD1 PHE A1543 -13.282 0.195 -1.241 1.00 0.00 C ATOM 289 CD2 PHE A1543 -13.526 -1.865 -2.396 1.00 0.00 C ATOM 290 CE1 PHE A1543 -14.160 -0.234 -0.277 1.00 0.00 C ATOM 291 CE2 PHE A1543 -14.412 -2.305 -1.435 1.00 0.00 C ATOM 292 CZ PHE A1543 -14.729 -1.488 -0.371 1.00 0.00 C ATOM 0 H PHE A1543 -13.015 -1.082 -5.524 1.00 0.00 H new ATOM 0 HA PHE A1543 -13.098 1.499 -4.106 1.00 0.00 H new ATOM 0 HB2 PHE A1543 -11.435 -0.998 -3.732 1.00 0.00 H new ATOM 0 HB3 PHE A1543 -11.227 0.498 -2.843 1.00 0.00 H new ATOM 0 HD1 PHE A1543 -12.842 1.178 -1.159 1.00 0.00 H new ATOM 0 HD2 PHE A1543 -13.276 -2.509 -3.226 1.00 0.00 H new ATOM 0 HE1 PHE A1543 -14.406 0.410 0.555 1.00 0.00 H new ATOM 0 HE2 PHE A1543 -14.856 -3.286 -1.516 1.00 0.00 H new ATOM 0 HZ PHE A1543 -15.420 -1.828 0.386 1.00 0.00 H new ATOM 302 N ASP A1544 -10.940 2.276 -5.256 1.00 0.00 N ATOM 303 CA ASP A1544 -9.979 2.811 -6.202 1.00 0.00 C ATOM 304 C ASP A1544 -8.994 3.707 -5.548 1.00 0.00 C ATOM 305 O ASP A1544 -9.330 4.799 -5.102 1.00 0.00 O ATOM 306 CB ASP A1544 -10.699 3.556 -7.305 1.00 0.00 C ATOM 307 CG ASP A1544 -9.796 4.319 -8.213 1.00 0.00 C ATOM 308 OD1 ASP A1544 -8.879 3.727 -8.758 1.00 0.00 O ATOM 309 OD2 ASP A1544 -10.028 5.527 -8.432 1.00 0.00 O1- ATOM 0 H ASP A1544 -11.172 2.898 -4.482 1.00 0.00 H new ATOM 0 HA ASP A1544 -9.430 1.969 -6.623 1.00 0.00 H new ATOM 0 HB2 ASP A1544 -11.273 2.843 -7.896 1.00 0.00 H new ATOM 0 HB3 ASP A1544 -11.414 4.246 -6.856 1.00 0.00 H new ATOM 314 N LEU A1545 -7.783 3.271 -5.515 1.00 0.00 N ATOM 315 CA LEU A1545 -6.735 4.017 -4.891 1.00 0.00 C ATOM 316 C LEU A1545 -6.006 4.851 -5.920 1.00 0.00 C ATOM 317 O LEU A1545 -5.015 5.493 -5.599 1.00 0.00 O ATOM 318 CB LEU A1545 -5.738 3.103 -4.219 1.00 0.00 C ATOM 319 CG LEU A1545 -6.242 2.161 -3.150 1.00 0.00 C ATOM 320 CD1 LEU A1545 -5.169 1.184 -2.823 1.00 0.00 C ATOM 321 CD2 LEU A1545 -6.649 2.885 -1.887 1.00 0.00 C ATOM 0 H LEU A1545 -7.485 2.384 -5.920 1.00 0.00 H new ATOM 0 HA LEU A1545 -7.193 4.660 -4.139 1.00 0.00 H new ATOM 0 HB2 LEU A1545 -5.261 2.503 -4.994 1.00 0.00 H new ATOM 0 HB3 LEU A1545 -4.961 3.726 -3.775 1.00 0.00 H new ATOM 0 HG LEU A1545 -7.127 1.659 -3.542 1.00 0.00 H new ATOM 0 HD11 LEU A1545 -5.523 0.499 -2.052 1.00 0.00 H new ATOM 0 HD12 LEU A1545 -4.906 0.619 -3.717 1.00 0.00 H new ATOM 0 HD13 LEU A1545 -4.290 1.717 -2.459 1.00 0.00 H new ATOM 0 HD21 LEU A1545 -7.003 2.163 -1.152 1.00 0.00 H new ATOM 0 HD22 LEU A1545 -5.791 3.423 -1.483 1.00 0.00 H new ATOM 0 HD23 LEU A1545 -7.446 3.592 -2.114 1.00 0.00 H new ATOM 333 N ASN A1546 -6.514 4.882 -7.169 1.00 0.00 N ATOM 334 CA ASN A1546 -5.866 5.704 -8.224 1.00 0.00 C ATOM 335 C ASN A1546 -5.936 7.181 -7.872 1.00 0.00 C ATOM 336 O ASN A1546 -5.178 8.004 -8.382 1.00 0.00 O ATOM 337 CB ASN A1546 -6.441 5.456 -9.635 1.00 0.00 C ATOM 338 CG ASN A1546 -5.991 4.143 -10.272 1.00 0.00 C ATOM 339 OD1 ASN A1546 -5.000 4.082 -10.990 1.00 0.00 O ATOM 340 ND2 ASN A1546 -6.719 3.106 -10.043 1.00 0.00 N ATOM 0 H ASN A1546 -7.342 4.368 -7.470 1.00 0.00 H new ATOM 0 HA ASN A1546 -4.823 5.389 -8.257 1.00 0.00 H new ATOM 0 HB2 ASN A1546 -7.529 5.465 -9.578 1.00 0.00 H new ATOM 0 HB3 ASN A1546 -6.149 6.281 -10.285 1.00 0.00 H new ATOM 0 HD21 ASN A1546 -6.475 2.209 -10.463 1.00 0.00 H new ATOM 0 HD22 ASN A1546 -7.539 3.182 -9.442 1.00 0.00 H new ATOM 347 N SER A1547 -6.826 7.491 -6.961 1.00 0.00 N ATOM 348 CA SER A1547 -6.993 8.819 -6.436 1.00 0.00 C ATOM 349 C SER A1547 -5.779 9.209 -5.550 1.00 0.00 C ATOM 350 O SER A1547 -5.497 10.386 -5.340 1.00 0.00 O ATOM 351 CB SER A1547 -8.279 8.842 -5.621 1.00 0.00 C ATOM 352 OG SER A1547 -9.346 8.243 -6.362 1.00 0.00 O ATOM 0 H SER A1547 -7.468 6.809 -6.556 1.00 0.00 H new ATOM 0 HA SER A1547 -7.052 9.541 -7.250 1.00 0.00 H new ATOM 0 HB2 SER A1547 -8.133 8.306 -4.683 1.00 0.00 H new ATOM 0 HB3 SER A1547 -8.537 9.870 -5.365 1.00 0.00 H new ATOM 0 HG SER A1547 -10.167 8.262 -5.827 1.00 0.00 H new ATOM 358 N LEU A1548 -5.051 8.207 -5.064 1.00 0.00 N ATOM 359 CA LEU A1548 -3.908 8.420 -4.215 1.00 0.00 C ATOM 360 C LEU A1548 -2.622 8.401 -5.019 1.00 0.00 C ATOM 361 O LEU A1548 -1.529 8.445 -4.445 1.00 0.00 O ATOM 362 CB LEU A1548 -3.846 7.329 -3.167 1.00 0.00 C ATOM 363 CG LEU A1548 -5.037 7.211 -2.248 1.00 0.00 C ATOM 364 CD1 LEU A1548 -4.830 6.064 -1.291 1.00 0.00 C ATOM 365 CD2 LEU A1548 -5.251 8.508 -1.510 1.00 0.00 C ATOM 0 H LEU A1548 -5.247 7.225 -5.255 1.00 0.00 H new ATOM 0 HA LEU A1548 -4.013 9.396 -3.741 1.00 0.00 H new ATOM 0 HB2 LEU A1548 -3.711 6.374 -3.676 1.00 0.00 H new ATOM 0 HB3 LEU A1548 -2.958 7.493 -2.556 1.00 0.00 H new ATOM 0 HG LEU A1548 -5.932 7.008 -2.836 1.00 0.00 H new ATOM 0 HD11 LEU A1548 -5.692 5.982 -0.629 1.00 0.00 H new ATOM 0 HD12 LEU A1548 -4.715 5.137 -1.853 1.00 0.00 H new ATOM 0 HD13 LEU A1548 -3.933 6.242 -0.698 1.00 0.00 H new ATOM 0 HD21 LEU A1548 -6.113 8.413 -0.849 1.00 0.00 H new ATOM 0 HD22 LEU A1548 -4.365 8.741 -0.919 1.00 0.00 H new ATOM 0 HD23 LEU A1548 -5.430 9.309 -2.227 1.00 0.00 H new ATOM 377 N LYS A1549 -2.746 8.340 -6.325 1.00 0.00 N ATOM 378 CA LYS A1549 -1.593 8.338 -7.195 1.00 0.00 C ATOM 379 C LYS A1549 -1.100 9.743 -7.344 1.00 0.00 C ATOM 380 O LYS A1549 -1.588 10.526 -8.165 1.00 0.00 O ATOM 381 CB LYS A1549 -1.877 7.672 -8.550 1.00 0.00 C ATOM 382 CG LYS A1549 -2.281 6.226 -8.416 1.00 0.00 C ATOM 383 CD LYS A1549 -2.726 5.628 -9.718 1.00 0.00 C ATOM 384 CE LYS A1549 -1.735 5.843 -10.816 1.00 0.00 C ATOM 385 NZ LYS A1549 -2.163 5.156 -12.057 1.00 0.00 N1+ ATOM 0 H LYS A1549 -3.641 8.291 -6.811 1.00 0.00 H new ATOM 0 HA LYS A1549 -0.810 7.731 -6.741 1.00 0.00 H new ATOM 0 HB2 LYS A1549 -2.669 8.220 -9.060 1.00 0.00 H new ATOM 0 HB3 LYS A1549 -0.988 7.740 -9.177 1.00 0.00 H new ATOM 0 HG2 LYS A1549 -1.440 5.652 -8.026 1.00 0.00 H new ATOM 0 HG3 LYS A1549 -3.088 6.144 -7.688 1.00 0.00 H new ATOM 0 HD2 LYS A1549 -2.890 4.559 -9.586 1.00 0.00 H new ATOM 0 HD3 LYS A1549 -3.683 6.064 -10.006 1.00 0.00 H new ATOM 0 HE2 LYS A1549 -1.623 6.910 -11.007 1.00 0.00 H new ATOM 0 HE3 LYS A1549 -0.758 5.470 -10.508 1.00 0.00 H new ATOM 0 HZ1 LYS A1549 -1.467 4.425 -12.307 1.00 0.00 H new ATOM 0 HZ2 LYS A1549 -3.092 4.713 -11.906 1.00 0.00 H new ATOM 0 HZ3 LYS A1549 -2.231 5.848 -12.831 1.00 0.00 H new ATOM 399 N ASN A1550 -0.199 10.062 -6.484 1.00 0.00 N ATOM 400 CA ASN A1550 0.353 11.343 -6.359 1.00 0.00 C ATOM 401 C ASN A1550 1.827 11.259 -6.493 1.00 0.00 C ATOM 402 O ASN A1550 2.490 10.413 -5.862 1.00 0.00 O ATOM 403 CB ASN A1550 -0.011 11.955 -5.006 1.00 0.00 C ATOM 404 CG ASN A1550 -1.422 12.506 -4.928 1.00 0.00 C ATOM 405 OD1 ASN A1550 -1.989 12.977 -5.914 1.00 0.00 O ATOM 406 ND2 ASN A1550 -1.998 12.446 -3.760 1.00 0.00 N ATOM 0 H ASN A1550 0.186 9.392 -5.818 1.00 0.00 H new ATOM 0 HA ASN A1550 -0.051 11.980 -7.146 1.00 0.00 H new ATOM 0 HB2 ASN A1550 0.114 11.197 -4.233 1.00 0.00 H new ATOM 0 HB3 ASN A1550 0.692 12.757 -4.782 1.00 0.00 H new ATOM 0 HD21 ASN A1550 -2.949 12.796 -3.642 1.00 0.00 H new ATOM 0 HD22 ASN A1550 -1.498 12.049 -2.965 1.00 0.00 H new ATOM 413 N ASP A1551 2.332 12.115 -7.300 1.00 0.00 N ATOM 414 CA ASP A1551 3.753 12.218 -7.582 1.00 0.00 C ATOM 415 C ASP A1551 4.478 12.787 -6.382 1.00 0.00 C ATOM 416 O ASP A1551 5.678 12.540 -6.197 1.00 0.00 O ATOM 417 CB ASP A1551 4.022 13.090 -8.820 1.00 0.00 C ATOM 418 CG ASP A1551 3.455 12.524 -10.108 1.00 0.00 C ATOM 419 OD1 ASP A1551 2.260 12.764 -10.411 1.00 0.00 O1- ATOM 420 OD2 ASP A1551 4.195 11.836 -10.855 1.00 0.00 O ATOM 0 H ASP A1551 1.768 12.795 -7.810 1.00 0.00 H new ATOM 0 HA ASP A1551 4.126 11.215 -7.792 1.00 0.00 H new ATOM 0 HB2 ASP A1551 3.599 14.080 -8.653 1.00 0.00 H new ATOM 0 HB3 ASP A1551 5.098 13.218 -8.934 1.00 0.00 H new ATOM 425 N SER A1552 3.733 13.528 -5.547 1.00 0.00 N ATOM 426 CA SER A1552 4.254 14.114 -4.324 1.00 0.00 C ATOM 427 C SER A1552 4.898 13.037 -3.475 1.00 0.00 C ATOM 428 O SER A1552 6.039 13.164 -3.029 1.00 0.00 O ATOM 429 CB SER A1552 3.119 14.805 -3.563 1.00 0.00 C ATOM 430 OG SER A1552 2.013 13.925 -3.336 1.00 0.00 O ATOM 0 H SER A1552 2.747 13.733 -5.712 1.00 0.00 H new ATOM 0 HA SER A1552 5.012 14.859 -4.566 1.00 0.00 H new ATOM 0 HB2 SER A1552 3.493 15.171 -2.607 1.00 0.00 H new ATOM 0 HB3 SER A1552 2.781 15.674 -4.127 1.00 0.00 H new ATOM 0 HG SER A1552 1.311 14.402 -2.847 1.00 0.00 H new ATOM 436 N GLY A1553 4.173 11.966 -3.301 1.00 0.00 N ATOM 437 CA GLY A1553 4.687 10.838 -2.604 1.00 0.00 C ATOM 438 C GLY A1553 4.361 10.838 -1.164 1.00 0.00 C ATOM 439 O GLY A1553 3.975 11.854 -0.602 1.00 0.00 O ATOM 0 H GLY A1553 3.217 11.859 -3.639 1.00 0.00 H new ATOM 0 HA2 GLY A1553 4.292 9.929 -3.058 1.00 0.00 H new ATOM 0 HA3 GLY A1553 5.770 10.809 -2.723 1.00 0.00 H new ATOM 443 N TYR A1554 4.514 9.717 -0.573 1.00 0.00 N ATOM 444 CA TYR A1554 4.163 9.511 0.805 1.00 0.00 C ATOM 445 C TYR A1554 5.386 9.124 1.586 1.00 0.00 C ATOM 446 O TYR A1554 6.433 8.851 0.999 1.00 0.00 O ATOM 447 CB TYR A1554 3.073 8.425 0.885 1.00 0.00 C ATOM 448 CG TYR A1554 1.857 8.814 0.071 1.00 0.00 C ATOM 449 CD1 TYR A1554 1.788 8.513 -1.286 1.00 0.00 C ATOM 450 CD2 TYR A1554 0.814 9.527 0.632 1.00 0.00 C ATOM 451 CE1 TYR A1554 0.721 8.904 -2.051 1.00 0.00 C ATOM 452 CE2 TYR A1554 -0.261 9.928 -0.135 1.00 0.00 C ATOM 453 CZ TYR A1554 -0.300 9.612 -1.473 1.00 0.00 C ATOM 454 OH TYR A1554 -1.360 10.023 -2.243 1.00 0.00 O ATOM 0 H TYR A1554 4.894 8.889 -1.031 1.00 0.00 H new ATOM 0 HA TYR A1554 3.769 10.430 1.239 1.00 0.00 H new ATOM 0 HB2 TYR A1554 3.471 7.478 0.520 1.00 0.00 H new ATOM 0 HB3 TYR A1554 2.785 8.270 1.925 1.00 0.00 H new ATOM 0 HD1 TYR A1554 2.593 7.959 -1.746 1.00 0.00 H new ATOM 0 HD2 TYR A1554 0.841 9.773 1.683 1.00 0.00 H new ATOM 0 HE1 TYR A1554 0.685 8.656 -3.102 1.00 0.00 H new ATOM 0 HE2 TYR A1554 -1.068 10.488 0.314 1.00 0.00 H new ATOM 0 HH TYR A1554 -1.528 9.363 -2.947 1.00 0.00 H new ATOM 464 N SER A1555 5.265 9.109 2.872 1.00 0.00 N ATOM 465 CA SER A1555 6.343 8.758 3.746 1.00 0.00 C ATOM 466 C SER A1555 5.828 8.084 4.991 1.00 0.00 C ATOM 467 O SER A1555 4.687 8.306 5.412 1.00 0.00 O ATOM 468 CB SER A1555 7.173 9.981 4.110 1.00 0.00 C ATOM 469 OG SER A1555 6.366 11.061 4.562 1.00 0.00 O ATOM 0 H SER A1555 4.399 9.344 3.357 1.00 0.00 H new ATOM 0 HA SER A1555 6.985 8.056 3.214 1.00 0.00 H new ATOM 0 HB2 SER A1555 7.889 9.714 4.887 1.00 0.00 H new ATOM 0 HB3 SER A1555 7.749 10.299 3.241 1.00 0.00 H new ATOM 0 HG SER A1555 6.938 11.825 4.787 1.00 0.00 H new ATOM 475 N VAL A1556 6.657 7.273 5.563 1.00 0.00 N ATOM 476 CA VAL A1556 6.346 6.523 6.732 1.00 0.00 C ATOM 477 C VAL A1556 7.568 6.483 7.602 1.00 0.00 C ATOM 478 O VAL A1556 8.465 5.709 7.362 1.00 0.00 O ATOM 479 CB VAL A1556 5.958 5.059 6.346 1.00 0.00 C ATOM 480 CG1 VAL A1556 5.852 4.185 7.563 1.00 0.00 C ATOM 481 CG2 VAL A1556 4.658 5.021 5.596 1.00 0.00 C ATOM 0 H VAL A1556 7.602 7.110 5.216 1.00 0.00 H new ATOM 0 HA VAL A1556 5.509 6.988 7.253 1.00 0.00 H new ATOM 0 HB VAL A1556 6.752 4.679 5.703 1.00 0.00 H new ATOM 0 HG11 VAL A1556 5.581 3.173 7.262 1.00 0.00 H new ATOM 0 HG12 VAL A1556 6.811 4.165 8.081 1.00 0.00 H new ATOM 0 HG13 VAL A1556 5.087 4.582 8.231 1.00 0.00 H new ATOM 0 HG21 VAL A1556 4.415 3.989 5.341 1.00 0.00 H new ATOM 0 HG22 VAL A1556 3.866 5.437 6.219 1.00 0.00 H new ATOM 0 HG23 VAL A1556 4.748 5.609 4.682 1.00 0.00 H new ATOM 491 N ALA A1557 7.652 7.403 8.510 1.00 0.00 N ATOM 492 CA ALA A1557 8.712 7.424 9.509 1.00 0.00 C ATOM 493 C ALA A1557 8.875 6.060 10.164 1.00 0.00 C ATOM 494 O ALA A1557 7.923 5.495 10.713 1.00 0.00 O ATOM 495 CB ALA A1557 8.455 8.481 10.553 1.00 0.00 C ATOM 0 H ALA A1557 6.989 8.174 8.593 1.00 0.00 H new ATOM 0 HA ALA A1557 9.641 7.670 8.996 1.00 0.00 H new ATOM 0 HB1 ALA A1557 9.262 8.473 11.285 1.00 0.00 H new ATOM 0 HB2 ALA A1557 8.407 9.460 10.076 1.00 0.00 H new ATOM 0 HB3 ALA A1557 7.509 8.275 11.054 1.00 0.00 H new ATOM 501 N TYR A1558 10.064 5.533 10.081 1.00 0.00 N ATOM 502 CA TYR A1558 10.349 4.234 10.623 1.00 0.00 C ATOM 503 C TYR A1558 10.747 4.419 12.079 1.00 0.00 C ATOM 504 O TYR A1558 11.106 5.526 12.498 1.00 0.00 O ATOM 505 CB TYR A1558 11.470 3.541 9.807 1.00 0.00 C ATOM 506 CG TYR A1558 11.668 2.061 10.108 1.00 0.00 C ATOM 507 CD1 TYR A1558 10.870 1.113 9.504 1.00 0.00 C ATOM 508 CD2 TYR A1558 12.647 1.619 10.987 1.00 0.00 C ATOM 509 CE1 TYR A1558 11.032 -0.230 9.759 1.00 0.00 C ATOM 510 CE2 TYR A1558 12.816 0.271 11.249 1.00 0.00 C ATOM 511 CZ TYR A1558 12.003 -0.646 10.631 1.00 0.00 C ATOM 512 OH TYR A1558 12.163 -1.994 10.885 1.00 0.00 O ATOM 0 H TYR A1558 10.861 5.990 9.637 1.00 0.00 H new ATOM 0 HA TYR A1558 9.473 3.589 10.563 1.00 0.00 H new ATOM 0 HB2 TYR A1558 11.248 3.653 8.746 1.00 0.00 H new ATOM 0 HB3 TYR A1558 12.409 4.062 9.993 1.00 0.00 H new ATOM 0 HD1 TYR A1558 10.101 1.431 8.816 1.00 0.00 H new ATOM 0 HD2 TYR A1558 13.287 2.339 11.474 1.00 0.00 H new ATOM 0 HE1 TYR A1558 10.395 -0.954 9.273 1.00 0.00 H new ATOM 0 HE2 TYR A1558 13.583 -0.057 11.935 1.00 0.00 H new ATOM 0 HH TYR A1558 12.895 -2.122 11.524 1.00 0.00 H new ATOM 522 N SER A1559 10.691 3.367 12.832 1.00 0.00 N ATOM 523 CA SER A1559 10.933 3.393 14.255 1.00 0.00 C ATOM 524 C SER A1559 12.426 3.535 14.636 1.00 0.00 C ATOM 525 O SER A1559 12.763 3.451 15.806 1.00 0.00 O ATOM 526 CB SER A1559 10.365 2.106 14.819 1.00 0.00 C ATOM 527 OG SER A1559 9.061 1.901 14.286 1.00 0.00 O ATOM 0 H SER A1559 10.471 2.438 12.473 1.00 0.00 H new ATOM 0 HA SER A1559 10.452 4.277 14.674 1.00 0.00 H new ATOM 0 HB2 SER A1559 11.012 1.266 14.565 1.00 0.00 H new ATOM 0 HB3 SER A1559 10.323 2.158 15.907 1.00 0.00 H new ATOM 0 HG SER A1559 8.688 1.069 14.645 1.00 0.00 H new ATOM 533 N GLU A1560 13.314 3.766 13.675 1.00 0.00 N ATOM 534 CA GLU A1560 14.722 3.859 14.018 1.00 0.00 C ATOM 535 C GLU A1560 15.296 5.256 13.838 1.00 0.00 C ATOM 536 O GLU A1560 15.420 5.993 14.814 1.00 0.00 O ATOM 537 CB GLU A1560 15.574 2.828 13.301 1.00 0.00 C ATOM 538 CG GLU A1560 15.202 1.401 13.594 1.00 0.00 C ATOM 539 CD GLU A1560 16.163 0.436 12.971 1.00 0.00 C ATOM 540 OE1 GLU A1560 16.637 0.693 11.840 1.00 0.00 O1- ATOM 541 OE2 GLU A1560 16.506 -0.573 13.610 1.00 0.00 O ATOM 0 H GLU A1560 13.093 3.888 12.687 1.00 0.00 H new ATOM 0 HA GLU A1560 14.762 3.633 15.084 1.00 0.00 H new ATOM 0 HB2 GLU A1560 15.499 2.997 12.227 1.00 0.00 H new ATOM 0 HB3 GLU A1560 16.617 2.982 13.576 1.00 0.00 H new ATOM 0 HG2 GLU A1560 15.179 1.246 14.673 1.00 0.00 H new ATOM 0 HG3 GLU A1560 14.197 1.204 13.222 1.00 0.00 H new ATOM 548 N LYS A1561 15.635 5.630 12.605 1.00 0.00 N ATOM 549 CA LYS A1561 16.281 6.933 12.362 1.00 0.00 C ATOM 550 C LYS A1561 15.977 7.487 10.964 1.00 0.00 C ATOM 551 O LYS A1561 16.655 8.403 10.477 1.00 0.00 O ATOM 552 CB LYS A1561 17.827 6.890 12.610 1.00 0.00 C ATOM 553 CG LYS A1561 18.638 5.916 11.745 1.00 0.00 C ATOM 554 CD LYS A1561 18.394 4.471 12.131 1.00 0.00 C ATOM 555 CE LYS A1561 19.155 3.515 11.226 1.00 0.00 C ATOM 556 NZ LYS A1561 18.951 2.088 11.570 1.00 0.00 N1+ ATOM 0 H LYS A1561 15.480 5.067 11.769 1.00 0.00 H new ATOM 0 HA LYS A1561 15.846 7.616 13.092 1.00 0.00 H new ATOM 0 HB2 LYS A1561 18.224 7.893 12.456 1.00 0.00 H new ATOM 0 HB3 LYS A1561 17.997 6.637 13.657 1.00 0.00 H new ATOM 0 HG2 LYS A1561 18.377 6.060 10.696 1.00 0.00 H new ATOM 0 HG3 LYS A1561 19.700 6.143 11.843 1.00 0.00 H new ATOM 0 HD2 LYS A1561 18.698 4.314 13.166 1.00 0.00 H new ATOM 0 HD3 LYS A1561 17.327 4.254 12.076 1.00 0.00 H new ATOM 0 HE2 LYS A1561 18.845 3.680 10.194 1.00 0.00 H new ATOM 0 HE3 LYS A1561 20.219 3.745 11.280 1.00 0.00 H new ATOM 0 HZ1 LYS A1561 19.339 1.490 10.813 1.00 0.00 H new ATOM 0 HZ2 LYS A1561 19.437 1.874 12.464 1.00 0.00 H new ATOM 0 HZ3 LYS A1561 17.934 1.898 11.674 1.00 0.00 H new ATOM 570 N GLY A1562 14.974 6.941 10.332 1.00 0.00 N ATOM 571 CA GLY A1562 14.587 7.373 9.034 1.00 0.00 C ATOM 572 C GLY A1562 13.167 6.991 8.787 1.00 0.00 C ATOM 573 O GLY A1562 12.504 6.524 9.693 1.00 0.00 O ATOM 0 H GLY A1562 14.406 6.183 10.711 1.00 0.00 H new ATOM 0 HA2 GLY A1562 14.705 8.453 8.948 1.00 0.00 H new ATOM 0 HA3 GLY A1562 15.233 6.921 8.281 1.00 0.00 H new ATOM 577 N LEU A1563 12.710 7.186 7.595 1.00 0.00 N ATOM 578 CA LEU A1563 11.375 6.851 7.184 1.00 0.00 C ATOM 579 C LEU A1563 11.406 5.916 5.972 1.00 0.00 C ATOM 580 O LEU A1563 12.482 5.472 5.532 1.00 0.00 O ATOM 581 CB LEU A1563 10.606 8.160 6.880 1.00 0.00 C ATOM 582 CG LEU A1563 11.022 8.980 5.664 1.00 0.00 C ATOM 583 CD1 LEU A1563 10.338 8.473 4.430 1.00 0.00 C ATOM 584 CD2 LEU A1563 10.717 10.432 5.888 1.00 0.00 C ATOM 0 H LEU A1563 13.271 7.597 6.849 1.00 0.00 H new ATOM 0 HA LEU A1563 10.859 6.318 7.983 1.00 0.00 H new ATOM 0 HB2 LEU A1563 9.552 7.907 6.765 1.00 0.00 H new ATOM 0 HB3 LEU A1563 10.685 8.803 7.757 1.00 0.00 H new ATOM 0 HG LEU A1563 12.097 8.874 5.521 1.00 0.00 H new ATOM 0 HD11 LEU A1563 10.647 9.070 3.572 1.00 0.00 H new ATOM 0 HD12 LEU A1563 10.612 7.431 4.264 1.00 0.00 H new ATOM 0 HD13 LEU A1563 9.258 8.549 4.555 1.00 0.00 H new ATOM 0 HD21 LEU A1563 11.019 11.007 5.012 1.00 0.00 H new ATOM 0 HD22 LEU A1563 9.647 10.558 6.053 1.00 0.00 H new ATOM 0 HD23 LEU A1563 11.263 10.788 6.761 1.00 0.00 H new ATOM 596 N ILE A1564 10.237 5.595 5.478 1.00 0.00 N ATOM 597 CA ILE A1564 10.042 4.794 4.293 1.00 0.00 C ATOM 598 C ILE A1564 9.064 5.542 3.379 1.00 0.00 C ATOM 599 O ILE A1564 7.978 5.856 3.788 1.00 0.00 O ATOM 600 CB ILE A1564 9.410 3.433 4.665 1.00 0.00 C ATOM 601 CG1 ILE A1564 10.130 2.799 5.858 1.00 0.00 C ATOM 602 CG2 ILE A1564 9.422 2.501 3.472 1.00 0.00 C ATOM 603 CD1 ILE A1564 9.577 1.462 6.277 1.00 0.00 C ATOM 0 H ILE A1564 9.361 5.895 5.905 1.00 0.00 H new ATOM 0 HA ILE A1564 11.001 4.623 3.803 1.00 0.00 H new ATOM 0 HB ILE A1564 8.374 3.607 4.956 1.00 0.00 H new ATOM 0 HG12 ILE A1564 11.185 2.681 5.610 1.00 0.00 H new ATOM 0 HG13 ILE A1564 10.076 3.483 6.705 1.00 0.00 H new ATOM 0 HG21 ILE A1564 8.974 1.547 3.751 1.00 0.00 H new ATOM 0 HG22 ILE A1564 8.851 2.946 2.657 1.00 0.00 H new ATOM 0 HG23 ILE A1564 10.450 2.338 3.148 1.00 0.00 H new ATOM 0 HD11 ILE A1564 10.144 1.084 7.128 1.00 0.00 H new ATOM 0 HD12 ILE A1564 8.530 1.574 6.559 1.00 0.00 H new ATOM 0 HD13 ILE A1564 9.656 0.759 5.447 1.00 0.00 H new ATOM 615 N TYR A1565 9.480 5.865 2.196 1.00 0.00 N ATOM 616 CA TYR A1565 8.649 6.605 1.265 1.00 0.00 C ATOM 617 C TYR A1565 7.704 5.654 0.553 1.00 0.00 C ATOM 618 O TYR A1565 8.030 4.478 0.344 1.00 0.00 O ATOM 619 CB TYR A1565 9.481 7.367 0.227 1.00 0.00 C ATOM 620 CG TYR A1565 10.389 8.439 0.776 1.00 0.00 C ATOM 621 CD1 TYR A1565 9.873 9.642 1.241 1.00 0.00 C ATOM 622 CD2 TYR A1565 11.757 8.256 0.822 1.00 0.00 C ATOM 623 CE1 TYR A1565 10.702 10.626 1.738 1.00 0.00 C ATOM 624 CE2 TYR A1565 12.590 9.237 1.317 1.00 0.00 C ATOM 625 CZ TYR A1565 12.060 10.416 1.773 1.00 0.00 C ATOM 626 OH TYR A1565 12.893 11.386 2.277 1.00 0.00 O ATOM 0 H TYR A1565 10.405 5.629 1.836 1.00 0.00 H new ATOM 0 HA TYR A1565 8.085 7.337 1.843 1.00 0.00 H new ATOM 0 HB2 TYR A1565 10.089 6.648 -0.323 1.00 0.00 H new ATOM 0 HB3 TYR A1565 8.801 7.825 -0.491 1.00 0.00 H new ATOM 0 HD1 TYR A1565 8.806 9.809 1.213 1.00 0.00 H new ATOM 0 HD2 TYR A1565 12.181 7.329 0.464 1.00 0.00 H new ATOM 0 HE1 TYR A1565 10.287 11.556 2.097 1.00 0.00 H new ATOM 0 HE2 TYR A1565 13.658 9.077 1.345 1.00 0.00 H new ATOM 0 HH TYR A1565 13.822 11.077 2.229 1.00 0.00 H new ATOM 636 N ILE A1566 6.544 6.152 0.201 1.00 0.00 N ATOM 637 CA ILE A1566 5.542 5.350 -0.457 1.00 0.00 C ATOM 638 C ILE A1566 4.967 6.050 -1.702 1.00 0.00 C ATOM 639 O ILE A1566 4.837 7.279 -1.742 1.00 0.00 O ATOM 640 CB ILE A1566 4.371 5.012 0.526 1.00 0.00 C ATOM 641 CG1 ILE A1566 4.846 4.117 1.675 1.00 0.00 C ATOM 642 CG2 ILE A1566 3.182 4.380 -0.188 1.00 0.00 C ATOM 643 CD1 ILE A1566 3.740 3.745 2.633 1.00 0.00 C ATOM 0 H ILE A1566 6.269 7.121 0.362 1.00 0.00 H new ATOM 0 HA ILE A1566 6.035 4.431 -0.775 1.00 0.00 H new ATOM 0 HB ILE A1566 4.035 5.960 0.945 1.00 0.00 H new ATOM 0 HG12 ILE A1566 5.282 3.207 1.262 1.00 0.00 H new ATOM 0 HG13 ILE A1566 5.637 4.629 2.223 1.00 0.00 H new ATOM 0 HG21 ILE A1566 2.396 4.164 0.536 1.00 0.00 H new ATOM 0 HG22 ILE A1566 2.802 5.069 -0.942 1.00 0.00 H new ATOM 0 HG23 ILE A1566 3.497 3.454 -0.669 1.00 0.00 H new ATOM 0 HD11 ILE A1566 4.141 3.111 3.423 1.00 0.00 H new ATOM 0 HD12 ILE A1566 3.319 4.650 3.072 1.00 0.00 H new ATOM 0 HD13 ILE A1566 2.960 3.206 2.096 1.00 0.00 H new ATOM 655 N GLY A1567 4.706 5.261 -2.706 1.00 0.00 N ATOM 656 CA GLY A1567 3.970 5.653 -3.861 1.00 0.00 C ATOM 657 C GLY A1567 2.830 4.668 -4.025 1.00 0.00 C ATOM 658 O GLY A1567 3.019 3.467 -3.825 1.00 0.00 O ATOM 0 H GLY A1567 5.015 4.290 -2.737 1.00 0.00 H new ATOM 0 HA2 GLY A1567 3.588 6.667 -3.747 1.00 0.00 H new ATOM 0 HA3 GLY A1567 4.610 5.651 -4.743 1.00 0.00 H new ATOM 662 N ILE A1568 1.664 5.140 -4.340 1.00 0.00 N ATOM 663 CA ILE A1568 0.491 4.263 -4.426 1.00 0.00 C ATOM 664 C ILE A1568 0.086 4.051 -5.864 1.00 0.00 C ATOM 665 O ILE A1568 -0.501 4.936 -6.455 1.00 0.00 O ATOM 666 CB ILE A1568 -0.715 4.850 -3.619 1.00 0.00 C ATOM 667 CG1 ILE A1568 -0.379 4.911 -2.130 1.00 0.00 C ATOM 668 CG2 ILE A1568 -1.997 4.025 -3.833 1.00 0.00 C ATOM 669 CD1 ILE A1568 -0.110 3.548 -1.505 1.00 0.00 C ATOM 0 H ILE A1568 1.478 6.122 -4.545 1.00 0.00 H new ATOM 0 HA ILE A1568 0.767 3.303 -3.989 1.00 0.00 H new ATOM 0 HB ILE A1568 -0.898 5.859 -3.990 1.00 0.00 H new ATOM 0 HG12 ILE A1568 0.497 5.544 -1.990 1.00 0.00 H new ATOM 0 HG13 ILE A1568 -1.204 5.387 -1.600 1.00 0.00 H new ATOM 0 HG21 ILE A1568 -2.812 4.463 -3.257 1.00 0.00 H new ATOM 0 HG22 ILE A1568 -2.259 4.027 -4.891 1.00 0.00 H new ATOM 0 HG23 ILE A1568 -1.829 3.000 -3.503 1.00 0.00 H new ATOM 0 HD11 ILE A1568 0.121 3.672 -0.447 1.00 0.00 H new ATOM 0 HD12 ILE A1568 -0.993 2.918 -1.612 1.00 0.00 H new ATOM 0 HD13 ILE A1568 0.735 3.077 -2.008 1.00 0.00 H new ATOM 681 N CYS A1569 0.519 2.903 -6.460 1.00 0.00 N ATOM 682 CA CYS A1569 0.152 2.499 -7.840 1.00 0.00 C ATOM 683 C CYS A1569 0.632 3.522 -8.871 1.00 0.00 C ATOM 684 O CYS A1569 0.277 3.449 -10.054 1.00 0.00 O ATOM 685 CB CYS A1569 -1.362 2.396 -7.960 1.00 0.00 C ATOM 686 SG CYS A1569 -2.172 1.382 -6.699 1.00 0.00 S ATOM 0 H CYS A1569 1.132 2.235 -5.993 1.00 0.00 H new ATOM 0 HA CYS A1569 0.629 1.538 -8.035 1.00 0.00 H new ATOM 0 HB2 CYS A1569 -1.782 3.401 -7.919 1.00 0.00 H new ATOM 0 HB3 CYS A1569 -1.605 1.988 -8.941 1.00 0.00 H new ATOM 691 N GLY A1570 1.444 4.446 -8.435 1.00 0.00 N ATOM 692 CA GLY A1570 1.850 5.511 -9.264 1.00 0.00 C ATOM 693 C GLY A1570 3.156 6.061 -8.825 1.00 0.00 C ATOM 694 O GLY A1570 3.546 5.904 -7.658 1.00 0.00 O ATOM 0 H GLY A1570 1.834 4.468 -7.493 1.00 0.00 H new ATOM 0 HA2 GLY A1570 1.925 5.165 -10.295 1.00 0.00 H new ATOM 0 HA3 GLY A1570 1.096 6.298 -9.246 1.00 0.00 H new ATOM 698 N GLY A1571 3.825 6.699 -9.745 1.00 0.00 N ATOM 699 CA GLY A1571 5.124 7.214 -9.516 1.00 0.00 C ATOM 700 C GLY A1571 5.131 8.393 -8.596 1.00 0.00 C ATOM 701 O GLY A1571 4.191 9.197 -8.574 1.00 0.00 O ATOM 0 H GLY A1571 3.468 6.872 -10.685 1.00 0.00 H new ATOM 0 HA2 GLY A1571 5.752 6.428 -9.096 1.00 0.00 H new ATOM 0 HA3 GLY A1571 5.568 7.501 -10.469 1.00 0.00 H new ATOM 705 N THR A1572 6.158 8.458 -7.828 1.00 0.00 N ATOM 706 CA THR A1572 6.411 9.517 -6.933 1.00 0.00 C ATOM 707 C THR A1572 7.823 10.008 -7.140 1.00 0.00 C ATOM 708 O THR A1572 8.605 9.376 -7.846 1.00 0.00 O ATOM 709 CB THR A1572 6.132 9.152 -5.433 1.00 0.00 C ATOM 710 OG1 THR A1572 6.735 10.093 -4.534 1.00 0.00 O ATOM 711 CG2 THR A1572 6.547 7.738 -5.101 1.00 0.00 C ATOM 0 H THR A1572 6.878 7.736 -7.809 1.00 0.00 H new ATOM 0 HA THR A1572 5.707 10.319 -7.157 1.00 0.00 H new ATOM 0 HB THR A1572 5.052 9.211 -5.297 1.00 0.00 H new ATOM 0 HG1 THR A1572 6.374 10.988 -4.706 1.00 0.00 H new ATOM 0 HG21 THR A1572 6.334 7.533 -4.052 1.00 0.00 H new ATOM 0 HG22 THR A1572 5.992 7.039 -5.727 1.00 0.00 H new ATOM 0 HG23 THR A1572 7.615 7.620 -5.284 1.00 0.00 H new ATOM 719 N LYS A1573 8.119 11.142 -6.618 1.00 0.00 N ATOM 720 CA LYS A1573 9.443 11.653 -6.638 1.00 0.00 C ATOM 721 C LYS A1573 10.200 11.179 -5.392 1.00 0.00 C ATOM 722 O LYS A1573 11.424 11.289 -5.303 1.00 0.00 O ATOM 723 CB LYS A1573 9.390 13.167 -6.738 1.00 0.00 C ATOM 724 CG LYS A1573 8.667 13.859 -5.599 1.00 0.00 C ATOM 725 CD LYS A1573 8.106 15.179 -6.065 1.00 0.00 C ATOM 726 CE LYS A1573 7.482 15.982 -4.934 1.00 0.00 C ATOM 727 NZ LYS A1573 8.487 16.463 -3.958 1.00 0.00 N1+ ATOM 0 H LYS A1573 7.441 11.750 -6.159 1.00 0.00 H new ATOM 0 HA LYS A1573 9.984 11.278 -7.507 1.00 0.00 H new ATOM 0 HB2 LYS A1573 10.410 13.549 -6.787 1.00 0.00 H new ATOM 0 HB3 LYS A1573 8.903 13.437 -7.675 1.00 0.00 H new ATOM 0 HG2 LYS A1573 7.862 13.223 -5.230 1.00 0.00 H new ATOM 0 HG3 LYS A1573 9.353 14.020 -4.767 1.00 0.00 H new ATOM 0 HD2 LYS A1573 8.901 15.765 -6.526 1.00 0.00 H new ATOM 0 HD3 LYS A1573 7.356 14.999 -6.835 1.00 0.00 H new ATOM 0 HE2 LYS A1573 6.947 16.836 -5.351 1.00 0.00 H new ATOM 0 HE3 LYS A1573 6.746 15.366 -4.418 1.00 0.00 H new ATOM 0 HZ1 LYS A1573 8.034 17.114 -3.286 1.00 0.00 H new ATOM 0 HZ2 LYS A1573 8.884 15.653 -3.441 1.00 0.00 H new ATOM 0 HZ3 LYS A1573 9.249 16.960 -4.461 1.00 0.00 H new ATOM 741 N ASN A1574 9.459 10.627 -4.437 1.00 0.00 N ATOM 742 CA ASN A1574 10.044 10.127 -3.203 1.00 0.00 C ATOM 743 C ASN A1574 10.581 8.721 -3.387 1.00 0.00 C ATOM 744 O ASN A1574 11.513 8.312 -2.704 1.00 0.00 O ATOM 745 CB ASN A1574 9.023 10.178 -2.043 1.00 0.00 C ATOM 746 CG ASN A1574 8.788 11.578 -1.514 1.00 0.00 C ATOM 747 OD1 ASN A1574 9.627 12.463 -1.674 1.00 0.00 O ATOM 748 ND2 ASN A1574 7.707 11.770 -0.798 1.00 0.00 N ATOM 0 H ASN A1574 8.447 10.515 -4.497 1.00 0.00 H new ATOM 0 HA ASN A1574 10.880 10.777 -2.944 1.00 0.00 H new ATOM 0 HB2 ASN A1574 8.075 9.762 -2.384 1.00 0.00 H new ATOM 0 HB3 ASN A1574 9.375 9.544 -1.230 1.00 0.00 H new ATOM 0 HD21 ASN A1574 7.543 12.674 -0.355 1.00 0.00 H new ATOM 0 HD22 ASN A1574 7.030 11.016 -0.684 1.00 0.00 H new ATOM 755 N CYS A1575 10.054 8.031 -4.367 1.00 0.00 N ATOM 756 CA CYS A1575 10.517 6.701 -4.722 1.00 0.00 C ATOM 757 C CYS A1575 10.648 6.616 -6.211 1.00 0.00 C ATOM 758 O CYS A1575 9.881 7.253 -6.918 1.00 0.00 O ATOM 759 CB CYS A1575 9.590 5.584 -4.202 1.00 0.00 C ATOM 760 SG CYS A1575 9.689 5.289 -2.412 1.00 0.00 S ATOM 0 H CYS A1575 9.288 8.372 -4.947 1.00 0.00 H new ATOM 0 HA CYS A1575 11.483 6.545 -4.243 1.00 0.00 H new ATOM 0 HB2 CYS A1575 8.561 5.835 -4.459 1.00 0.00 H new ATOM 0 HB3 CYS A1575 9.832 4.658 -4.723 1.00 0.00 H new ATOM 765 N PRO A1576 11.656 5.887 -6.706 1.00 0.00 N ATOM 766 CA PRO A1576 11.889 5.709 -8.139 1.00 0.00 C ATOM 767 C PRO A1576 10.653 5.254 -8.919 1.00 0.00 C ATOM 768 O PRO A1576 9.752 4.592 -8.388 1.00 0.00 O ATOM 769 CB PRO A1576 12.925 4.592 -8.191 1.00 0.00 C ATOM 770 CG PRO A1576 13.661 4.676 -6.909 1.00 0.00 C ATOM 771 CD PRO A1576 12.690 5.201 -5.893 1.00 0.00 C ATOM 0 HA PRO A1576 12.188 6.654 -8.593 1.00 0.00 H new ATOM 0 HB2 PRO A1576 12.448 3.619 -8.307 1.00 0.00 H new ATOM 0 HB3 PRO A1576 13.598 4.720 -9.039 1.00 0.00 H new ATOM 0 HG2 PRO A1576 14.039 3.697 -6.614 1.00 0.00 H new ATOM 0 HG3 PRO A1576 14.523 5.337 -6.999 1.00 0.00 H new ATOM 0 HD2 PRO A1576 12.260 4.395 -5.298 1.00 0.00 H new ATOM 0 HD3 PRO A1576 13.172 5.888 -5.198 1.00 0.00 H new ATOM 779 N SER A1577 10.624 5.603 -10.165 1.00 0.00 N ATOM 780 CA SER A1577 9.621 5.153 -11.066 1.00 0.00 C ATOM 781 C SER A1577 9.818 3.645 -11.254 1.00 0.00 C ATOM 782 O SER A1577 10.860 3.205 -11.753 1.00 0.00 O ATOM 783 CB SER A1577 9.809 5.883 -12.375 1.00 0.00 C ATOM 784 OG SER A1577 9.737 7.297 -12.189 1.00 0.00 O ATOM 0 H SER A1577 11.314 6.222 -10.591 1.00 0.00 H new ATOM 0 HA SER A1577 8.615 5.346 -10.693 1.00 0.00 H new ATOM 0 HB2 SER A1577 10.774 5.618 -12.807 1.00 0.00 H new ATOM 0 HB3 SER A1577 9.044 5.567 -13.085 1.00 0.00 H new ATOM 0 HG SER A1577 9.863 7.747 -13.050 1.00 0.00 H new ATOM 790 N GLY A1578 8.863 2.869 -10.803 1.00 0.00 N ATOM 791 CA GLY A1578 9.005 1.430 -10.822 1.00 0.00 C ATOM 792 C GLY A1578 9.132 0.904 -9.408 1.00 0.00 C ATOM 793 O GLY A1578 9.071 -0.297 -9.155 1.00 0.00 O ATOM 0 H GLY A1578 7.980 3.206 -10.419 1.00 0.00 H new ATOM 0 HA2 GLY A1578 8.142 0.978 -11.311 1.00 0.00 H new ATOM 0 HA3 GLY A1578 9.884 1.151 -11.403 1.00 0.00 H new ATOM 797 N VAL A1579 9.267 1.817 -8.482 1.00 0.00 N ATOM 798 CA VAL A1579 9.369 1.505 -7.093 1.00 0.00 C ATOM 799 C VAL A1579 8.128 2.027 -6.395 1.00 0.00 C ATOM 800 O VAL A1579 7.797 3.207 -6.504 1.00 0.00 O ATOM 801 CB VAL A1579 10.629 2.150 -6.487 1.00 0.00 C ATOM 802 CG1 VAL A1579 10.594 2.031 -4.994 1.00 0.00 C ATOM 803 CG2 VAL A1579 11.878 1.469 -7.017 1.00 0.00 C ATOM 0 H VAL A1579 9.309 2.816 -8.683 1.00 0.00 H new ATOM 0 HA VAL A1579 9.448 0.426 -6.962 1.00 0.00 H new ATOM 0 HB VAL A1579 10.650 3.203 -6.769 1.00 0.00 H new ATOM 0 HG11 VAL A1579 11.488 2.489 -4.571 1.00 0.00 H new ATOM 0 HG12 VAL A1579 9.710 2.539 -4.609 1.00 0.00 H new ATOM 0 HG13 VAL A1579 10.559 0.978 -4.714 1.00 0.00 H new ATOM 0 HG21 VAL A1579 12.760 1.936 -6.580 1.00 0.00 H new ATOM 0 HG22 VAL A1579 11.857 0.412 -6.751 1.00 0.00 H new ATOM 0 HG23 VAL A1579 11.915 1.569 -8.102 1.00 0.00 H new ATOM 813 N GLY A1580 7.423 1.140 -5.746 1.00 0.00 N ATOM 814 CA GLY A1580 6.218 1.519 -5.080 1.00 0.00 C ATOM 815 C GLY A1580 6.510 2.025 -3.700 1.00 0.00 C ATOM 816 O GLY A1580 5.952 2.997 -3.262 1.00 0.00 O ATOM 0 H GLY A1580 7.666 0.153 -5.667 1.00 0.00 H new ATOM 0 HA2 GLY A1580 5.707 2.291 -5.655 1.00 0.00 H new ATOM 0 HA3 GLY A1580 5.544 0.664 -5.024 1.00 0.00 H new ATOM 820 N VAL A1581 7.398 1.359 -3.028 1.00 0.00 N ATOM 821 CA VAL A1581 7.785 1.722 -1.673 1.00 0.00 C ATOM 822 C VAL A1581 9.275 1.626 -1.536 1.00 0.00 C ATOM 823 O VAL A1581 9.875 0.710 -2.056 1.00 0.00 O ATOM 824 CB VAL A1581 7.078 0.803 -0.621 1.00 0.00 C ATOM 825 CG1 VAL A1581 7.704 0.930 0.749 1.00 0.00 C ATOM 826 CG2 VAL A1581 5.618 1.157 -0.529 1.00 0.00 C ATOM 0 H VAL A1581 7.885 0.541 -3.394 1.00 0.00 H new ATOM 0 HA VAL A1581 7.470 2.748 -1.482 1.00 0.00 H new ATOM 0 HB VAL A1581 7.197 -0.227 -0.957 1.00 0.00 H new ATOM 0 HG11 VAL A1581 7.184 0.276 1.449 1.00 0.00 H new ATOM 0 HG12 VAL A1581 8.754 0.644 0.697 1.00 0.00 H new ATOM 0 HG13 VAL A1581 7.626 1.962 1.090 1.00 0.00 H new ATOM 0 HG21 VAL A1581 5.133 0.513 0.205 1.00 0.00 H new ATOM 0 HG22 VAL A1581 5.515 2.198 -0.223 1.00 0.00 H new ATOM 0 HG23 VAL A1581 5.147 1.016 -1.502 1.00 0.00 H new ATOM 836 N CYS A1582 9.872 2.570 -0.872 1.00 0.00 N ATOM 837 CA CYS A1582 11.302 2.555 -0.697 1.00 0.00 C ATOM 838 C CYS A1582 11.699 3.208 0.621 1.00 0.00 C ATOM 839 O CYS A1582 11.157 4.229 0.993 1.00 0.00 O ATOM 840 CB CYS A1582 11.998 3.258 -1.887 1.00 0.00 C ATOM 841 SG CYS A1582 11.689 5.071 -2.044 1.00 0.00 S ATOM 0 H CYS A1582 9.395 3.362 -0.441 1.00 0.00 H new ATOM 0 HA CYS A1582 11.630 1.516 -0.668 1.00 0.00 H new ATOM 0 HB2 CYS A1582 13.073 3.098 -1.800 1.00 0.00 H new ATOM 0 HB3 CYS A1582 11.677 2.773 -2.809 1.00 0.00 H new ATOM 846 N PHE A1583 12.631 2.594 1.346 1.00 0.00 N ATOM 847 CA PHE A1583 13.153 3.175 2.574 1.00 0.00 C ATOM 848 C PHE A1583 13.805 4.490 2.238 1.00 0.00 C ATOM 849 O PHE A1583 14.433 4.615 1.220 1.00 0.00 O ATOM 850 CB PHE A1583 14.194 2.267 3.253 1.00 0.00 C ATOM 851 CG PHE A1583 13.666 1.015 3.906 1.00 0.00 C ATOM 852 CD1 PHE A1583 13.485 -0.150 3.184 1.00 0.00 C ATOM 853 CD2 PHE A1583 13.392 1.001 5.262 1.00 0.00 C ATOM 854 CE1 PHE A1583 13.040 -1.301 3.798 1.00 0.00 C ATOM 855 CE2 PHE A1583 12.941 -0.147 5.882 1.00 0.00 C ATOM 856 CZ PHE A1583 12.767 -1.300 5.147 1.00 0.00 C ATOM 0 H PHE A1583 13.039 1.692 1.101 1.00 0.00 H new ATOM 0 HA PHE A1583 12.322 3.303 3.267 1.00 0.00 H new ATOM 0 HB2 PHE A1583 14.934 1.977 2.507 1.00 0.00 H new ATOM 0 HB3 PHE A1583 14.717 2.853 4.009 1.00 0.00 H new ATOM 0 HD1 PHE A1583 13.695 -0.158 2.125 1.00 0.00 H new ATOM 0 HD2 PHE A1583 13.533 1.900 5.843 1.00 0.00 H new ATOM 0 HE1 PHE A1583 12.906 -2.204 3.221 1.00 0.00 H new ATOM 0 HE2 PHE A1583 12.725 -0.142 6.940 1.00 0.00 H new ATOM 0 HZ PHE A1583 12.417 -2.201 5.629 1.00 0.00 H new ATOM 866 N GLY A1584 13.682 5.427 3.093 1.00 0.00 N ATOM 867 CA GLY A1584 14.189 6.740 2.824 1.00 0.00 C ATOM 868 C GLY A1584 15.572 6.940 3.340 1.00 0.00 C ATOM 869 O GLY A1584 16.277 7.825 2.884 1.00 0.00 O ATOM 0 H GLY A1584 13.230 5.321 4.001 1.00 0.00 H new ATOM 0 HA2 GLY A1584 14.178 6.916 1.748 1.00 0.00 H new ATOM 0 HA3 GLY A1584 13.527 7.480 3.274 1.00 0.00 H new ATOM 873 N LEU A1585 15.962 6.094 4.270 1.00 0.00 N ATOM 874 CA LEU A1585 17.234 6.172 4.917 1.00 0.00 C ATOM 875 C LEU A1585 18.368 6.044 3.903 1.00 0.00 C ATOM 876 O LEU A1585 19.181 6.952 3.750 1.00 0.00 O ATOM 877 CB LEU A1585 17.312 5.061 5.937 1.00 0.00 C ATOM 878 CG LEU A1585 18.319 5.244 7.044 1.00 0.00 C ATOM 879 CD1 LEU A1585 17.915 6.430 7.869 1.00 0.00 C ATOM 880 CD2 LEU A1585 18.382 4.011 7.905 1.00 0.00 C ATOM 0 H LEU A1585 15.384 5.320 4.597 1.00 0.00 H new ATOM 0 HA LEU A1585 17.340 7.140 5.406 1.00 0.00 H new ATOM 0 HB2 LEU A1585 16.327 4.939 6.387 1.00 0.00 H new ATOM 0 HB3 LEU A1585 17.541 4.132 5.415 1.00 0.00 H new ATOM 0 HG LEU A1585 19.308 5.410 6.616 1.00 0.00 H new ATOM 0 HD11 LEU A1585 18.635 6.575 8.675 1.00 0.00 H new ATOM 0 HD12 LEU A1585 17.891 7.320 7.240 1.00 0.00 H new ATOM 0 HD13 LEU A1585 16.926 6.258 8.293 1.00 0.00 H new ATOM 0 HD21 LEU A1585 19.113 4.159 8.699 1.00 0.00 H new ATOM 0 HD22 LEU A1585 17.402 3.823 8.344 1.00 0.00 H new ATOM 0 HD23 LEU A1585 18.676 3.156 7.296 1.00 0.00 H new ATOM 892 N THR A1586 18.421 4.918 3.224 1.00 0.00 N ATOM 893 CA THR A1586 19.436 4.711 2.207 1.00 0.00 C ATOM 894 C THR A1586 18.796 4.378 0.843 1.00 0.00 C ATOM 895 O THR A1586 19.471 3.930 -0.098 1.00 0.00 O ATOM 896 CB THR A1586 20.444 3.605 2.629 1.00 0.00 C ATOM 897 OG1 THR A1586 19.762 2.362 2.756 1.00 0.00 O ATOM 898 CG2 THR A1586 21.044 3.926 3.976 1.00 0.00 C ATOM 0 H THR A1586 17.780 4.136 3.354 1.00 0.00 H new ATOM 0 HA THR A1586 19.990 5.644 2.102 1.00 0.00 H new ATOM 0 HB THR A1586 21.224 3.551 1.870 1.00 0.00 H new ATOM 0 HG1 THR A1586 20.398 1.665 3.020 1.00 0.00 H new ATOM 0 HG21 THR A1586 21.747 3.142 4.257 1.00 0.00 H new ATOM 0 HG22 THR A1586 21.567 4.881 3.923 1.00 0.00 H new ATOM 0 HG23 THR A1586 20.252 3.987 4.722 1.00 0.00 H new ATOM 906 N LYS A1587 17.499 4.682 0.743 1.00 0.00 N ATOM 907 CA LYS A1587 16.675 4.460 -0.458 1.00 0.00 C ATOM 908 C LYS A1587 16.657 3.002 -0.908 1.00 0.00 C ATOM 909 O LYS A1587 17.217 2.628 -1.943 1.00 0.00 O ATOM 910 CB LYS A1587 16.990 5.443 -1.589 1.00 0.00 C ATOM 911 CG LYS A1587 16.876 6.908 -1.163 1.00 0.00 C ATOM 912 CD LYS A1587 15.479 7.266 -0.651 1.00 0.00 C ATOM 913 CE LYS A1587 14.404 7.164 -1.728 1.00 0.00 C ATOM 914 NZ LYS A1587 14.608 8.137 -2.820 1.00 0.00 N1+ ATOM 0 H LYS A1587 16.976 5.100 1.512 1.00 0.00 H new ATOM 0 HA LYS A1587 15.650 4.682 -0.161 1.00 0.00 H new ATOM 0 HB2 LYS A1587 18.000 5.255 -1.954 1.00 0.00 H new ATOM 0 HB3 LYS A1587 16.310 5.259 -2.421 1.00 0.00 H new ATOM 0 HG2 LYS A1587 17.608 7.113 -0.382 1.00 0.00 H new ATOM 0 HG3 LYS A1587 17.124 7.549 -2.009 1.00 0.00 H new ATOM 0 HD2 LYS A1587 15.221 6.604 0.176 1.00 0.00 H new ATOM 0 HD3 LYS A1587 15.493 8.281 -0.254 1.00 0.00 H new ATOM 0 HE2 LYS A1587 14.401 6.155 -2.140 1.00 0.00 H new ATOM 0 HE3 LYS A1587 13.425 7.328 -1.277 1.00 0.00 H new ATOM 0 HZ1 LYS A1587 13.687 8.504 -3.134 1.00 0.00 H new ATOM 0 HZ2 LYS A1587 15.196 8.924 -2.479 1.00 0.00 H new ATOM 0 HZ3 LYS A1587 15.084 7.669 -3.617 1.00 0.00 H new ATOM 928 N ILE A1588 16.058 2.183 -0.074 1.00 0.00 N ATOM 929 CA ILE A1588 15.954 0.741 -0.294 1.00 0.00 C ATOM 930 C ILE A1588 14.553 0.412 -0.734 1.00 0.00 C ATOM 931 O ILE A1588 13.638 0.508 0.075 1.00 0.00 O ATOM 932 CB ILE A1588 16.169 0.038 1.038 1.00 0.00 C ATOM 933 CG1 ILE A1588 17.397 0.593 1.709 1.00 0.00 C ATOM 934 CG2 ILE A1588 16.340 -1.450 0.801 1.00 0.00 C ATOM 935 CD1 ILE A1588 17.525 0.214 3.146 1.00 0.00 C ATOM 0 H ILE A1588 15.620 2.495 0.792 1.00 0.00 H new ATOM 0 HA ILE A1588 16.685 0.430 -1.040 1.00 0.00 H new ATOM 0 HB ILE A1588 15.305 0.203 1.681 1.00 0.00 H new ATOM 0 HG12 ILE A1588 18.280 0.247 1.172 1.00 0.00 H new ATOM 0 HG13 ILE A1588 17.382 1.680 1.630 1.00 0.00 H new ATOM 0 HG21 ILE A1588 16.494 -1.955 1.755 1.00 0.00 H new ATOM 0 HG22 ILE A1588 15.446 -1.847 0.321 1.00 0.00 H new ATOM 0 HG23 ILE A1588 17.203 -1.619 0.157 1.00 0.00 H new ATOM 0 HD11 ILE A1588 18.434 0.652 3.558 1.00 0.00 H new ATOM 0 HD12 ILE A1588 16.661 0.584 3.698 1.00 0.00 H new ATOM 0 HD13 ILE A1588 17.573 -0.871 3.233 1.00 0.00 H new ATOM 947 N ASN A1589 14.366 0.134 -1.999 1.00 0.00 N ATOM 948 CA ASN A1589 13.062 -0.285 -2.522 1.00 0.00 C ATOM 949 C ASN A1589 12.466 -1.430 -1.683 1.00 0.00 C ATOM 950 O ASN A1589 12.918 -2.554 -1.710 1.00 0.00 O ATOM 951 CB ASN A1589 13.166 -0.650 -4.023 1.00 0.00 C ATOM 952 CG ASN A1589 11.915 -1.294 -4.602 1.00 0.00 C ATOM 953 OD1 ASN A1589 10.825 -1.095 -4.131 1.00 0.00 O ATOM 954 ND2 ASN A1589 12.074 -2.019 -5.669 1.00 0.00 N ATOM 0 H ASN A1589 15.101 0.187 -2.704 1.00 0.00 H new ATOM 0 HA ASN A1589 12.372 0.555 -2.440 1.00 0.00 H new ATOM 0 HB2 ASN A1589 13.390 0.254 -4.589 1.00 0.00 H new ATOM 0 HB3 ASN A1589 14.007 -1.329 -4.162 1.00 0.00 H new ATOM 0 HD21 ASN A1589 11.264 -2.435 -6.128 1.00 0.00 H new ATOM 0 HD22 ASN A1589 13.009 -2.172 -6.047 1.00 0.00 H new ATOM 961 N ALA A1590 11.457 -1.102 -0.939 1.00 0.00 N ATOM 962 CA ALA A1590 10.821 -2.014 -0.031 1.00 0.00 C ATOM 963 C ALA A1590 9.613 -2.654 -0.664 1.00 0.00 C ATOM 964 O ALA A1590 8.832 -3.285 0.006 1.00 0.00 O ATOM 965 CB ALA A1590 10.411 -1.297 1.234 1.00 0.00 C ATOM 0 H ALA A1590 11.040 -0.171 -0.944 1.00 0.00 H new ATOM 0 HA ALA A1590 11.540 -2.796 0.215 1.00 0.00 H new ATOM 0 HB1 ALA A1590 9.930 -2.002 1.912 1.00 0.00 H new ATOM 0 HB2 ALA A1590 11.293 -0.875 1.715 1.00 0.00 H new ATOM 0 HB3 ALA A1590 9.713 -0.496 0.989 1.00 0.00 H new ATOM 971 N GLY A1591 9.467 -2.480 -1.939 1.00 0.00 N ATOM 972 CA GLY A1591 8.361 -3.068 -2.641 1.00 0.00 C ATOM 973 C GLY A1591 8.153 -2.402 -3.965 1.00 0.00 C ATOM 974 O GLY A1591 7.906 -1.194 -4.027 1.00 0.00 O ATOM 0 H GLY A1591 10.101 -1.933 -2.522 1.00 0.00 H new ATOM 0 HA2 GLY A1591 8.544 -4.132 -2.790 1.00 0.00 H new ATOM 0 HA3 GLY A1591 7.456 -2.981 -2.040 1.00 0.00 H new ATOM 978 N SER A1592 8.246 -3.152 -5.018 1.00 0.00 N ATOM 979 CA SER A1592 8.158 -2.583 -6.324 1.00 0.00 C ATOM 980 C SER A1592 6.733 -2.272 -6.733 1.00 0.00 C ATOM 981 O SER A1592 5.791 -2.937 -6.313 1.00 0.00 O ATOM 982 CB SER A1592 8.841 -3.467 -7.338 1.00 0.00 C ATOM 983 OG SER A1592 10.221 -3.610 -7.017 1.00 0.00 O ATOM 0 H SER A1592 8.383 -4.163 -4.998 1.00 0.00 H new ATOM 0 HA SER A1592 8.681 -1.627 -6.291 1.00 0.00 H new ATOM 0 HB2 SER A1592 8.362 -4.446 -7.359 1.00 0.00 H new ATOM 0 HB3 SER A1592 8.735 -3.039 -8.335 1.00 0.00 H new ATOM 0 HG SER A1592 10.454 -4.562 -6.990 1.00 0.00 H new ATOM 989 N TRP A1593 6.643 -1.244 -7.551 1.00 0.00 N ATOM 990 CA TRP A1593 5.422 -0.673 -8.145 1.00 0.00 C ATOM 991 C TRP A1593 4.418 -1.742 -8.562 1.00 0.00 C ATOM 992 O TRP A1593 4.742 -2.611 -9.369 1.00 0.00 O ATOM 993 CB TRP A1593 5.881 -0.033 -9.429 1.00 0.00 C ATOM 994 CG TRP A1593 5.472 1.359 -9.675 1.00 0.00 C ATOM 995 CD1 TRP A1593 5.938 2.461 -9.044 1.00 0.00 C ATOM 996 CD2 TRP A1593 4.572 1.806 -10.675 1.00 0.00 C ATOM 997 NE1 TRP A1593 5.400 3.576 -9.588 1.00 0.00 N ATOM 998 CE2 TRP A1593 4.535 3.200 -10.599 1.00 0.00 C ATOM 999 CE3 TRP A1593 3.786 1.158 -11.630 1.00 0.00 C ATOM 1000 CZ2 TRP A1593 3.746 3.965 -11.450 1.00 0.00 C ATOM 1001 CZ3 TRP A1593 3.002 1.917 -12.465 1.00 0.00 C ATOM 1002 CH2 TRP A1593 2.989 3.309 -12.371 1.00 0.00 C ATOM 0 H TRP A1593 7.477 -0.738 -7.849 1.00 0.00 H new ATOM 0 HA TRP A1593 4.947 -0.009 -7.423 1.00 0.00 H new ATOM 0 HB2 TRP A1593 6.970 -0.074 -9.455 1.00 0.00 H new ATOM 0 HB3 TRP A1593 5.519 -0.642 -10.257 1.00 0.00 H new ATOM 0 HD1 TRP A1593 6.640 2.452 -8.223 1.00 0.00 H new ATOM 0 HE1 TRP A1593 5.599 4.534 -9.301 1.00 0.00 H new ATOM 0 HE3 TRP A1593 3.794 0.081 -11.711 1.00 0.00 H new ATOM 0 HZ2 TRP A1593 3.734 5.043 -11.383 1.00 0.00 H new ATOM 0 HZ3 TRP A1593 2.386 1.428 -13.206 1.00 0.00 H new ATOM 0 HH2 TRP A1593 2.365 3.878 -13.044 1.00 0.00 H new ATOM 1013 N ASN A1594 3.209 -1.657 -8.044 1.00 0.00 N ATOM 1014 CA ASN A1594 2.146 -2.580 -8.416 1.00 0.00 C ATOM 1015 C ASN A1594 0.833 -1.862 -8.424 1.00 0.00 C ATOM 1016 O ASN A1594 0.707 -0.780 -7.863 1.00 0.00 O ATOM 1017 CB ASN A1594 2.010 -3.822 -7.485 1.00 0.00 C ATOM 1018 CG ASN A1594 3.005 -4.924 -7.692 1.00 0.00 C ATOM 1019 OD1 ASN A1594 3.548 -5.113 -8.773 1.00 0.00 O ATOM 1020 ND2 ASN A1594 3.174 -5.726 -6.682 1.00 0.00 N ATOM 0 H ASN A1594 2.933 -0.954 -7.359 1.00 0.00 H new ATOM 0 HA ASN A1594 2.420 -2.949 -9.404 1.00 0.00 H new ATOM 0 HB2 ASN A1594 2.085 -3.484 -6.452 1.00 0.00 H new ATOM 0 HB3 ASN A1594 1.010 -4.237 -7.613 1.00 0.00 H new ATOM 0 HD21 ASN A1594 3.775 -6.544 -6.776 1.00 0.00 H new ATOM 0 HD22 ASN A1594 2.705 -5.536 -5.796 1.00 0.00 H new ATOM 1027 N SER A1595 -0.122 -2.481 -9.039 1.00 0.00 N ATOM 1028 CA SER A1595 -1.488 -2.014 -9.109 1.00 0.00 C ATOM 1029 C SER A1595 -2.390 -3.120 -8.530 1.00 0.00 C ATOM 1030 O SER A1595 -3.628 -3.117 -8.700 1.00 0.00 O ATOM 1031 CB SER A1595 -1.861 -1.745 -10.570 1.00 0.00 C ATOM 1032 OG SER A1595 -1.053 -0.705 -11.126 1.00 0.00 O ATOM 0 H SER A1595 0.024 -3.363 -9.530 1.00 0.00 H new ATOM 0 HA SER A1595 -1.612 -1.090 -8.544 1.00 0.00 H new ATOM 0 HB2 SER A1595 -1.737 -2.657 -11.154 1.00 0.00 H new ATOM 0 HB3 SER A1595 -2.913 -1.466 -10.634 1.00 0.00 H new ATOM 0 HG SER A1595 -1.310 -0.554 -12.060 1.00 0.00 H new ATOM 1038 N GLN A1596 -1.727 -4.055 -7.855 1.00 0.00 N ATOM 1039 CA GLN A1596 -2.321 -5.223 -7.223 1.00 0.00 C ATOM 1040 C GLN A1596 -3.042 -4.840 -5.965 1.00 0.00 C ATOM 1041 O GLN A1596 -2.436 -4.782 -4.887 1.00 0.00 O ATOM 1042 CB GLN A1596 -1.236 -6.261 -6.886 1.00 0.00 C ATOM 1043 CG GLN A1596 -0.730 -7.060 -8.058 1.00 0.00 C ATOM 1044 CD GLN A1596 -1.761 -8.049 -8.496 1.00 0.00 C ATOM 1045 OE1 GLN A1596 -2.594 -7.651 -9.386 1.00 0.00 O flip ATOM 1046 NE2 GLN A1596 -1.790 -9.182 -8.025 1.00 0.00 N flip ATOM 0 H GLN A1596 -0.716 -4.015 -7.730 1.00 0.00 H new ATOM 0 HA GLN A1596 -3.034 -5.655 -7.925 1.00 0.00 H new ATOM 0 HB2 GLN A1596 -0.393 -5.746 -6.426 1.00 0.00 H new ATOM 0 HB3 GLN A1596 -1.633 -6.950 -6.141 1.00 0.00 H new ATOM 0 HG2 GLN A1596 -0.484 -6.392 -8.883 1.00 0.00 H new ATOM 0 HG3 GLN A1596 0.188 -7.579 -7.783 1.00 0.00 H new ATOM 0 HE21 GLN A1596 -1.108 -9.458 -7.318 1.00 0.00 H new ATOM 0 HE22 GLN A1596 -2.496 -9.847 -8.340 1.00 0.00 H new ATOM 1055 N LEU A1597 -4.298 -4.562 -6.096 1.00 0.00 N ATOM 1056 CA LEU A1597 -5.092 -4.168 -4.993 1.00 0.00 C ATOM 1057 C LEU A1597 -6.011 -5.274 -4.613 1.00 0.00 C ATOM 1058 O LEU A1597 -6.603 -5.936 -5.462 1.00 0.00 O ATOM 1059 CB LEU A1597 -5.888 -2.919 -5.293 1.00 0.00 C ATOM 1060 CG LEU A1597 -6.760 -2.423 -4.140 1.00 0.00 C ATOM 1061 CD1 LEU A1597 -5.931 -2.090 -2.910 1.00 0.00 C ATOM 1062 CD2 LEU A1597 -7.534 -1.243 -4.568 1.00 0.00 C ATOM 0 H LEU A1597 -4.801 -4.604 -6.983 1.00 0.00 H new ATOM 0 HA LEU A1597 -4.422 -3.943 -4.163 1.00 0.00 H new ATOM 0 HB2 LEU A1597 -5.198 -2.124 -5.576 1.00 0.00 H new ATOM 0 HB3 LEU A1597 -6.526 -3.110 -6.156 1.00 0.00 H new ATOM 0 HG LEU A1597 -7.444 -3.227 -3.867 1.00 0.00 H new ATOM 0 HD11 LEU A1597 -6.587 -1.741 -2.113 1.00 0.00 H new ATOM 0 HD12 LEU A1597 -5.399 -2.981 -2.578 1.00 0.00 H new ATOM 0 HD13 LEU A1597 -5.212 -1.309 -3.156 1.00 0.00 H new ATOM 0 HD21 LEU A1597 -8.153 -0.895 -3.741 1.00 0.00 H new ATOM 0 HD22 LEU A1597 -6.850 -0.449 -4.869 1.00 0.00 H new ATOM 0 HD23 LEU A1597 -8.171 -1.512 -5.411 1.00 0.00 H new ATOM 1074 N MET A1598 -6.109 -5.484 -3.368 1.00 0.00 N ATOM 1075 CA MET A1598 -6.934 -6.499 -2.837 1.00 0.00 C ATOM 1076 C MET A1598 -7.853 -5.942 -1.827 1.00 0.00 C ATOM 1077 O MET A1598 -7.714 -4.810 -1.433 1.00 0.00 O ATOM 1078 CB MET A1598 -6.093 -7.602 -2.249 1.00 0.00 C ATOM 1079 CG MET A1598 -5.436 -8.457 -3.297 1.00 0.00 C ATOM 1080 SD MET A1598 -4.047 -9.365 -2.628 1.00 0.00 S ATOM 1081 CE MET A1598 -3.012 -7.968 -2.202 1.00 0.00 C ATOM 0 H MET A1598 -5.607 -4.944 -2.663 1.00 0.00 H new ATOM 0 HA MET A1598 -7.534 -6.920 -3.644 1.00 0.00 H new ATOM 0 HB2 MET A1598 -5.326 -7.166 -1.609 1.00 0.00 H new ATOM 0 HB3 MET A1598 -6.718 -8.230 -1.614 1.00 0.00 H new ATOM 0 HG2 MET A1598 -6.165 -9.156 -3.707 1.00 0.00 H new ATOM 0 HG3 MET A1598 -5.098 -7.829 -4.121 1.00 0.00 H new ATOM 0 HE1 MET A1598 -1.970 -8.210 -2.412 1.00 0.00 H new ATOM 0 HE2 MET A1598 -3.310 -7.101 -2.792 1.00 0.00 H new ATOM 0 HE3 MET A1598 -3.125 -7.741 -1.142 1.00 0.00 H new ATOM 1091 N TYR A1599 -8.792 -6.723 -1.440 1.00 0.00 N ATOM 1092 CA TYR A1599 -9.748 -6.369 -0.461 1.00 0.00 C ATOM 1093 C TYR A1599 -9.927 -7.576 0.391 1.00 0.00 C ATOM 1094 O TYR A1599 -10.576 -8.548 0.000 1.00 0.00 O ATOM 1095 CB TYR A1599 -11.068 -5.948 -1.112 1.00 0.00 C ATOM 1096 CG TYR A1599 -12.091 -5.472 -0.133 1.00 0.00 C ATOM 1097 CD1 TYR A1599 -11.811 -4.413 0.702 1.00 0.00 C ATOM 1098 CD2 TYR A1599 -13.326 -6.075 -0.044 1.00 0.00 C ATOM 1099 CE1 TYR A1599 -12.730 -3.961 1.609 1.00 0.00 C ATOM 1100 CE2 TYR A1599 -14.266 -5.630 0.863 1.00 0.00 C ATOM 1101 CZ TYR A1599 -13.960 -4.570 1.691 1.00 0.00 C ATOM 1102 OH TYR A1599 -14.888 -4.121 2.607 1.00 0.00 O ATOM 0 H TYR A1599 -8.920 -7.664 -1.812 1.00 0.00 H new ATOM 0 HA TYR A1599 -9.416 -5.516 0.131 1.00 0.00 H new ATOM 0 HB2 TYR A1599 -10.871 -5.155 -1.834 1.00 0.00 H new ATOM 0 HB3 TYR A1599 -11.475 -6.792 -1.669 1.00 0.00 H new ATOM 0 HD1 TYR A1599 -10.847 -3.930 0.639 1.00 0.00 H new ATOM 0 HD2 TYR A1599 -13.562 -6.906 -0.692 1.00 0.00 H new ATOM 0 HE1 TYR A1599 -12.491 -3.131 2.257 1.00 0.00 H new ATOM 0 HE2 TYR A1599 -15.233 -6.107 0.924 1.00 0.00 H new ATOM 0 HH TYR A1599 -15.705 -4.658 2.535 1.00 0.00 H new ATOM 1112 N VAL A1600 -9.279 -7.548 1.486 1.00 0.00 N ATOM 1113 CA VAL A1600 -9.234 -8.640 2.393 1.00 0.00 C ATOM 1114 C VAL A1600 -9.564 -8.168 3.800 1.00 0.00 C ATOM 1115 O VAL A1600 -8.893 -7.297 4.355 1.00 0.00 O ATOM 1116 CB VAL A1600 -7.846 -9.339 2.313 1.00 0.00 C ATOM 1117 CG1 VAL A1600 -6.703 -8.323 2.292 1.00 0.00 C ATOM 1118 CG2 VAL A1600 -7.680 -10.339 3.449 1.00 0.00 C ATOM 0 H VAL A1600 -8.742 -6.738 1.795 1.00 0.00 H new ATOM 0 HA VAL A1600 -9.987 -9.378 2.117 1.00 0.00 H new ATOM 0 HB VAL A1600 -7.803 -9.887 1.372 1.00 0.00 H new ATOM 0 HG11 VAL A1600 -5.750 -8.849 2.236 1.00 0.00 H new ATOM 0 HG12 VAL A1600 -6.810 -7.672 1.424 1.00 0.00 H new ATOM 0 HG13 VAL A1600 -6.733 -7.723 3.201 1.00 0.00 H new ATOM 0 HG21 VAL A1600 -6.703 -10.816 3.374 1.00 0.00 H new ATOM 0 HG22 VAL A1600 -7.758 -9.820 4.405 1.00 0.00 H new ATOM 0 HG23 VAL A1600 -8.460 -11.097 3.383 1.00 0.00 H new ATOM 1128 N ASP A1601 -10.655 -8.701 4.308 1.00 0.00 N ATOM 1129 CA ASP A1601 -11.205 -8.417 5.630 1.00 0.00 C ATOM 1130 C ASP A1601 -11.448 -6.926 5.838 1.00 0.00 C ATOM 1131 O ASP A1601 -10.867 -6.282 6.722 1.00 0.00 O ATOM 1132 CB ASP A1601 -10.370 -9.036 6.726 1.00 0.00 C ATOM 1133 CG ASP A1601 -10.966 -8.906 8.117 1.00 0.00 C ATOM 1134 OD1 ASP A1601 -11.998 -9.556 8.400 1.00 0.00 O1- ATOM 1135 OD2 ASP A1601 -10.414 -8.154 8.960 1.00 0.00 O ATOM 0 H ASP A1601 -11.215 -9.378 3.790 1.00 0.00 H new ATOM 0 HA ASP A1601 -12.185 -8.892 5.686 1.00 0.00 H new ATOM 0 HB2 ASP A1601 -10.225 -10.093 6.503 1.00 0.00 H new ATOM 0 HB3 ASP A1601 -9.384 -8.571 6.721 1.00 0.00 H new ATOM 1140 N GLN A1602 -12.247 -6.369 4.919 1.00 0.00 N ATOM 1141 CA GLN A1602 -12.654 -4.949 4.888 1.00 0.00 C ATOM 1142 C GLN A1602 -11.482 -3.999 4.707 1.00 0.00 C ATOM 1143 O GLN A1602 -11.610 -2.787 4.867 1.00 0.00 O ATOM 1144 CB GLN A1602 -13.480 -4.584 6.100 1.00 0.00 C ATOM 1145 CG GLN A1602 -14.832 -5.281 6.130 1.00 0.00 C ATOM 1146 CD GLN A1602 -15.676 -4.929 7.336 1.00 0.00 C ATOM 1147 OE1 GLN A1602 -15.051 -4.681 8.461 1.00 0.00 O flip ATOM 1148 NE2 GLN A1602 -16.912 -4.904 7.257 1.00 0.00 N flip ATOM 0 H GLN A1602 -12.644 -6.908 4.149 1.00 0.00 H new ATOM 0 HA GLN A1602 -13.282 -4.831 4.005 1.00 0.00 H new ATOM 0 HB2 GLN A1602 -12.925 -4.841 7.002 1.00 0.00 H new ATOM 0 HB3 GLN A1602 -13.633 -3.505 6.117 1.00 0.00 H new ATOM 0 HG2 GLN A1602 -15.383 -5.023 5.225 1.00 0.00 H new ATOM 0 HG3 GLN A1602 -14.675 -6.359 6.111 1.00 0.00 H new ATOM 0 HE21 GLN A1602 -17.370 -5.101 6.367 1.00 0.00 H new ATOM 0 HE22 GLN A1602 -17.471 -4.686 8.082 1.00 0.00 H new ATOM 1157 N VAL A1603 -10.370 -4.545 4.338 1.00 0.00 N ATOM 1158 CA VAL A1603 -9.173 -3.782 4.135 1.00 0.00 C ATOM 1159 C VAL A1603 -8.623 -3.986 2.723 1.00 0.00 C ATOM 1160 O VAL A1603 -8.417 -5.115 2.274 1.00 0.00 O ATOM 1161 CB VAL A1603 -8.104 -4.154 5.211 1.00 0.00 C ATOM 1162 CG1 VAL A1603 -6.757 -3.569 4.874 1.00 0.00 C ATOM 1163 CG2 VAL A1603 -8.523 -3.615 6.559 1.00 0.00 C ATOM 0 H VAL A1603 -10.261 -5.544 4.166 1.00 0.00 H new ATOM 0 HA VAL A1603 -9.418 -2.725 4.244 1.00 0.00 H new ATOM 0 HB VAL A1603 -8.029 -5.241 5.234 1.00 0.00 H new ATOM 0 HG11 VAL A1603 -6.037 -3.847 5.643 1.00 0.00 H new ATOM 0 HG12 VAL A1603 -6.424 -3.953 3.910 1.00 0.00 H new ATOM 0 HG13 VAL A1603 -6.834 -2.483 4.825 1.00 0.00 H new ATOM 0 HG21 VAL A1603 -7.773 -3.878 7.305 1.00 0.00 H new ATOM 0 HG22 VAL A1603 -8.616 -2.530 6.504 1.00 0.00 H new ATOM 0 HG23 VAL A1603 -9.483 -4.047 6.841 1.00 0.00 H new ATOM 1173 N LEU A1604 -8.416 -2.890 2.034 1.00 0.00 N ATOM 1174 CA LEU A1604 -7.822 -2.880 0.710 1.00 0.00 C ATOM 1175 C LEU A1604 -6.353 -3.121 0.945 1.00 0.00 C ATOM 1176 O LEU A1604 -5.799 -2.574 1.871 1.00 0.00 O ATOM 1177 CB LEU A1604 -8.004 -1.484 0.064 1.00 0.00 C ATOM 1178 CG LEU A1604 -9.375 -1.115 -0.510 1.00 0.00 C ATOM 1179 CD1 LEU A1604 -10.479 -1.311 0.474 1.00 0.00 C ATOM 1180 CD2 LEU A1604 -9.354 0.312 -0.968 1.00 0.00 C ATOM 0 H LEU A1604 -8.658 -1.961 2.380 1.00 0.00 H new ATOM 0 HA LEU A1604 -8.274 -3.622 0.052 1.00 0.00 H new ATOM 0 HB2 LEU A1604 -7.747 -0.736 0.814 1.00 0.00 H new ATOM 0 HB3 LEU A1604 -7.273 -1.393 -0.740 1.00 0.00 H new ATOM 0 HG LEU A1604 -9.570 -1.783 -1.349 1.00 0.00 H new ATOM 0 HD11 LEU A1604 -11.428 -1.035 0.015 1.00 0.00 H new ATOM 0 HD12 LEU A1604 -10.514 -2.357 0.778 1.00 0.00 H new ATOM 0 HD13 LEU A1604 -10.302 -0.685 1.348 1.00 0.00 H new ATOM 0 HD21 LEU A1604 -10.329 0.577 -1.377 1.00 0.00 H new ATOM 0 HD22 LEU A1604 -9.126 0.962 -0.123 1.00 0.00 H new ATOM 0 HD23 LEU A1604 -8.592 0.436 -1.737 1.00 0.00 H new ATOM 1192 N GLN A1605 -5.734 -3.951 0.204 1.00 0.00 N ATOM 1193 CA GLN A1605 -4.378 -4.252 0.506 1.00 0.00 C ATOM 1194 C GLN A1605 -3.528 -4.284 -0.731 1.00 0.00 C ATOM 1195 O GLN A1605 -3.871 -4.939 -1.703 1.00 0.00 O ATOM 1196 CB GLN A1605 -4.367 -5.563 1.277 1.00 0.00 C ATOM 1197 CG GLN A1605 -3.041 -6.024 1.798 1.00 0.00 C ATOM 1198 CD GLN A1605 -3.223 -6.999 2.944 1.00 0.00 C ATOM 1199 OE1 GLN A1605 -4.235 -6.765 3.745 1.00 0.00 O flip ATOM 1200 NE2 GLN A1605 -2.435 -7.908 3.143 1.00 0.00 N flip ATOM 0 H GLN A1605 -6.127 -4.432 -0.605 1.00 0.00 H new ATOM 0 HA GLN A1605 -3.935 -3.470 1.123 1.00 0.00 H new ATOM 0 HB2 GLN A1605 -5.050 -5.467 2.121 1.00 0.00 H new ATOM 0 HB3 GLN A1605 -4.768 -6.342 0.629 1.00 0.00 H new ATOM 0 HG2 GLN A1605 -2.475 -6.499 0.996 1.00 0.00 H new ATOM 0 HG3 GLN A1605 -2.459 -5.166 2.134 1.00 0.00 H new ATOM 0 HE21 GLN A1605 -1.659 -8.061 2.499 1.00 0.00 H new ATOM 0 HE22 GLN A1605 -2.552 -8.516 3.954 1.00 0.00 H new ATOM 1209 N LEU A1606 -2.456 -3.530 -0.706 1.00 0.00 N ATOM 1210 CA LEU A1606 -1.502 -3.509 -1.796 1.00 0.00 C ATOM 1211 C LEU A1606 -0.263 -4.233 -1.356 1.00 0.00 C ATOM 1212 O LEU A1606 0.301 -3.916 -0.309 1.00 0.00 O ATOM 1213 CB LEU A1606 -1.100 -2.070 -2.196 1.00 0.00 C ATOM 1214 CG LEU A1606 -2.136 -1.185 -2.896 1.00 0.00 C ATOM 1215 CD1 LEU A1606 -1.584 0.219 -3.045 1.00 0.00 C ATOM 1216 CD2 LEU A1606 -2.461 -1.726 -4.268 1.00 0.00 C ATOM 0 H LEU A1606 -2.217 -2.912 0.070 1.00 0.00 H new ATOM 0 HA LEU A1606 -1.970 -3.984 -2.658 1.00 0.00 H new ATOM 0 HB2 LEU A1606 -0.780 -1.553 -1.291 1.00 0.00 H new ATOM 0 HB3 LEU A1606 -0.229 -2.139 -2.848 1.00 0.00 H new ATOM 0 HG LEU A1606 -3.043 -1.174 -2.292 1.00 0.00 H new ATOM 0 HD11 LEU A1606 -2.321 0.849 -3.543 1.00 0.00 H new ATOM 0 HD12 LEU A1606 -1.363 0.629 -2.060 1.00 0.00 H new ATOM 0 HD13 LEU A1606 -0.671 0.190 -3.639 1.00 0.00 H new ATOM 0 HD21 LEU A1606 -3.199 -1.083 -4.748 1.00 0.00 H new ATOM 0 HD22 LEU A1606 -1.555 -1.752 -4.873 1.00 0.00 H new ATOM 0 HD23 LEU A1606 -2.865 -2.734 -4.175 1.00 0.00 H new ATOM 1228 N VAL A1607 0.132 -5.208 -2.121 1.00 0.00 N ATOM 1229 CA VAL A1607 1.354 -5.933 -1.869 1.00 0.00 C ATOM 1230 C VAL A1607 2.328 -5.641 -2.987 1.00 0.00 C ATOM 1231 O VAL A1607 2.220 -6.191 -4.094 1.00 0.00 O ATOM 1232 CB VAL A1607 1.131 -7.467 -1.763 1.00 0.00 C ATOM 1233 CG1 VAL A1607 2.482 -8.199 -1.570 1.00 0.00 C ATOM 1234 CG2 VAL A1607 0.205 -7.789 -0.597 1.00 0.00 C ATOM 0 H VAL A1607 -0.382 -5.528 -2.942 1.00 0.00 H new ATOM 0 HA VAL A1607 1.747 -5.602 -0.908 1.00 0.00 H new ATOM 0 HB VAL A1607 0.671 -7.809 -2.690 1.00 0.00 H new ATOM 0 HG11 VAL A1607 2.307 -9.272 -1.498 1.00 0.00 H new ATOM 0 HG12 VAL A1607 3.132 -7.994 -2.421 1.00 0.00 H new ATOM 0 HG13 VAL A1607 2.959 -7.847 -0.656 1.00 0.00 H new ATOM 0 HG21 VAL A1607 0.058 -8.867 -0.536 1.00 0.00 H new ATOM 0 HG22 VAL A1607 0.650 -7.430 0.331 1.00 0.00 H new ATOM 0 HG23 VAL A1607 -0.757 -7.300 -0.751 1.00 0.00 H new ATOM 1244 N TYR A1608 3.176 -4.707 -2.736 1.00 0.00 N ATOM 1245 CA TYR A1608 4.248 -4.354 -3.626 1.00 0.00 C ATOM 1246 C TYR A1608 5.346 -5.360 -3.424 1.00 0.00 C ATOM 1247 O TYR A1608 6.055 -5.291 -2.447 1.00 0.00 O ATOM 1248 CB TYR A1608 4.788 -2.965 -3.297 1.00 0.00 C ATOM 1249 CG TYR A1608 3.845 -1.832 -3.546 1.00 0.00 C ATOM 1250 CD1 TYR A1608 3.588 -1.413 -4.829 1.00 0.00 C ATOM 1251 CD2 TYR A1608 3.244 -1.156 -2.504 1.00 0.00 C ATOM 1252 CE1 TYR A1608 2.762 -0.357 -5.081 1.00 0.00 C ATOM 1253 CE2 TYR A1608 2.405 -0.097 -2.750 1.00 0.00 C ATOM 1254 CZ TYR A1608 2.174 0.294 -4.045 1.00 0.00 C ATOM 1255 OH TYR A1608 1.376 1.352 -4.301 1.00 0.00 O ATOM 0 H TYR A1608 3.151 -4.146 -1.884 1.00 0.00 H new ATOM 0 HA TYR A1608 3.888 -4.349 -4.655 1.00 0.00 H new ATOM 0 HB2 TYR A1608 5.080 -2.947 -2.247 1.00 0.00 H new ATOM 0 HB3 TYR A1608 5.692 -2.798 -3.883 1.00 0.00 H new ATOM 0 HD1 TYR A1608 4.050 -1.931 -5.656 1.00 0.00 H new ATOM 0 HD2 TYR A1608 3.435 -1.462 -1.486 1.00 0.00 H new ATOM 0 HE1 TYR A1608 2.577 -0.041 -6.097 1.00 0.00 H new ATOM 0 HE2 TYR A1608 1.931 0.424 -1.931 1.00 0.00 H new ATOM 0 HH TYR A1608 1.911 2.173 -4.298 1.00 0.00 H new ATOM 1265 N ASP A1609 5.449 -6.307 -4.296 1.00 0.00 N ATOM 1266 CA ASP A1609 6.393 -7.382 -4.135 1.00 0.00 C ATOM 1267 C ASP A1609 7.615 -7.196 -4.985 1.00 0.00 C ATOM 1268 O ASP A1609 7.675 -6.288 -5.832 1.00 0.00 O ATOM 1269 CB ASP A1609 5.748 -8.721 -4.464 1.00 0.00 C ATOM 1270 CG ASP A1609 5.348 -8.857 -5.918 1.00 0.00 C ATOM 1271 OD1 ASP A1609 4.375 -8.196 -6.354 1.00 0.00 O ATOM 1272 OD2 ASP A1609 5.972 -9.653 -6.644 1.00 0.00 O1- ATOM 0 H ASP A1609 4.885 -6.365 -5.144 1.00 0.00 H new ATOM 0 HA ASP A1609 6.702 -7.372 -3.090 1.00 0.00 H new ATOM 0 HB2 ASP A1609 6.442 -9.522 -4.210 1.00 0.00 H new ATOM 0 HB3 ASP A1609 4.865 -8.854 -3.838 1.00 0.00 H new ATOM 1277 N ASP A1610 8.566 -8.091 -4.754 1.00 0.00 N ATOM 1278 CA ASP A1610 9.876 -8.127 -5.408 1.00 0.00 C ATOM 1279 C ASP A1610 10.525 -6.755 -5.445 1.00 0.00 C ATOM 1280 O ASP A1610 10.667 -6.146 -6.498 1.00 0.00 O ATOM 1281 CB ASP A1610 9.815 -8.767 -6.809 1.00 0.00 C ATOM 1282 CG ASP A1610 11.186 -8.958 -7.459 1.00 0.00 C ATOM 1283 OD1 ASP A1610 11.859 -9.978 -7.161 1.00 0.00 O ATOM 1284 OD2 ASP A1610 11.593 -8.129 -8.307 1.00 0.00 O1- ATOM 0 H ASP A1610 8.445 -8.845 -4.078 1.00 0.00 H new ATOM 0 HA ASP A1610 10.511 -8.770 -4.798 1.00 0.00 H new ATOM 0 HB2 ASP A1610 9.320 -9.735 -6.735 1.00 0.00 H new ATOM 0 HB3 ASP A1610 9.199 -8.143 -7.457 1.00 0.00 H new ATOM 1289 N GLY A1611 10.771 -6.218 -4.286 1.00 0.00 N ATOM 1290 CA GLY A1611 11.446 -4.954 -4.186 1.00 0.00 C ATOM 1291 C GLY A1611 12.940 -5.121 -4.299 1.00 0.00 C ATOM 1292 O GLY A1611 13.439 -5.833 -5.193 1.00 0.00 O ATOM 0 H GLY A1611 10.514 -6.637 -3.392 1.00 0.00 H new ATOM 0 HA2 GLY A1611 11.092 -4.287 -4.972 1.00 0.00 H new ATOM 0 HA3 GLY A1611 11.201 -4.483 -3.234 1.00 0.00 H new ATOM 1296 N ALA A1612 13.648 -4.476 -3.432 1.00 0.00 N ATOM 1297 CA ALA A1612 15.088 -4.593 -3.375 1.00 0.00 C ATOM 1298 C ALA A1612 15.452 -5.837 -2.563 1.00 0.00 C ATOM 1299 O ALA A1612 14.595 -6.363 -1.828 1.00 0.00 O ATOM 1300 CB ALA A1612 15.685 -3.348 -2.740 1.00 0.00 C ATOM 0 H ALA A1612 13.252 -3.846 -2.734 1.00 0.00 H new ATOM 0 HA ALA A1612 15.493 -4.689 -4.383 1.00 0.00 H new ATOM 0 HB1 ALA A1612 16.770 -3.444 -2.701 1.00 0.00 H new ATOM 0 HB2 ALA A1612 15.419 -2.474 -3.334 1.00 0.00 H new ATOM 0 HB3 ALA A1612 15.294 -3.232 -1.729 1.00 0.00 H new ATOM 1306 N PRO A1613 16.701 -6.336 -2.656 1.00 0.00 N ATOM 1307 CA PRO A1613 17.098 -7.516 -1.932 1.00 0.00 C ATOM 1308 C PRO A1613 17.196 -7.227 -0.442 1.00 0.00 C ATOM 1309 O PRO A1613 17.770 -6.211 -0.020 1.00 0.00 O ATOM 1310 CB PRO A1613 18.455 -7.899 -2.526 1.00 0.00 C ATOM 1311 CG PRO A1613 18.985 -6.665 -3.170 1.00 0.00 C ATOM 1312 CD PRO A1613 17.815 -5.759 -3.438 1.00 0.00 C ATOM 0 HA PRO A1613 16.376 -8.327 -2.027 1.00 0.00 H new ATOM 0 HB2 PRO A1613 19.133 -8.257 -1.751 1.00 0.00 H new ATOM 0 HB3 PRO A1613 18.349 -8.704 -3.253 1.00 0.00 H new ATOM 0 HG2 PRO A1613 19.710 -6.174 -2.520 1.00 0.00 H new ATOM 0 HG3 PRO A1613 19.502 -6.908 -4.098 1.00 0.00 H new ATOM 0 HD2 PRO A1613 18.028 -4.736 -3.127 1.00 0.00 H new ATOM 0 HD3 PRO A1613 17.576 -5.726 -4.501 1.00 0.00 H new ATOM 1320 N CYS A1614 16.608 -8.083 0.329 1.00 0.00 N ATOM 1321 CA CYS A1614 16.552 -7.952 1.744 1.00 0.00 C ATOM 1322 C CYS A1614 17.686 -8.724 2.386 1.00 0.00 C ATOM 1323 O CYS A1614 17.805 -9.936 2.216 1.00 0.00 O ATOM 1324 CB CYS A1614 15.206 -8.454 2.251 1.00 0.00 C ATOM 1325 SG CYS A1614 15.016 -8.472 4.057 1.00 0.00 S ATOM 0 H CYS A1614 16.139 -8.918 -0.022 1.00 0.00 H new ATOM 0 HA CYS A1614 16.660 -6.901 2.013 1.00 0.00 H new ATOM 0 HB2 CYS A1614 14.420 -7.830 1.826 1.00 0.00 H new ATOM 0 HB3 CYS A1614 15.049 -9.465 1.875 1.00 0.00 H new ATOM 1330 N PRO A1615 18.593 -8.012 3.029 1.00 0.00 N ATOM 1331 CA PRO A1615 19.685 -8.598 3.775 1.00 0.00 C ATOM 1332 C PRO A1615 19.426 -8.566 5.285 1.00 0.00 C ATOM 1333 O PRO A1615 20.274 -8.973 6.078 1.00 0.00 O ATOM 1334 CB PRO A1615 20.828 -7.648 3.450 1.00 0.00 C ATOM 1335 CG PRO A1615 20.183 -6.318 3.127 1.00 0.00 C ATOM 1336 CD PRO A1615 18.701 -6.550 2.989 1.00 0.00 C ATOM 0 HA PRO A1615 19.857 -9.644 3.520 1.00 0.00 H new ATOM 0 HB2 PRO A1615 21.511 -7.556 4.294 1.00 0.00 H new ATOM 0 HB3 PRO A1615 21.412 -8.014 2.606 1.00 0.00 H new ATOM 0 HG2 PRO A1615 20.385 -5.593 3.916 1.00 0.00 H new ATOM 0 HG3 PRO A1615 20.594 -5.908 2.204 1.00 0.00 H new ATOM 0 HD2 PRO A1615 18.142 -6.081 3.799 1.00 0.00 H new ATOM 0 HD3 PRO A1615 18.313 -6.142 2.056 1.00 0.00 H new ATOM 1344 N SER A1616 18.258 -8.071 5.650 1.00 0.00 N ATOM 1345 CA SER A1616 17.880 -7.833 7.030 1.00 0.00 C ATOM 1346 C SER A1616 17.907 -9.120 7.861 1.00 0.00 C ATOM 1347 O SER A1616 18.726 -9.252 8.766 1.00 0.00 O ATOM 1348 CB SER A1616 16.487 -7.162 7.071 1.00 0.00 C ATOM 1349 OG SER A1616 16.122 -6.716 8.378 1.00 0.00 O ATOM 0 H SER A1616 17.531 -7.818 4.981 1.00 0.00 H new ATOM 0 HA SER A1616 18.612 -7.162 7.480 1.00 0.00 H new ATOM 0 HB2 SER A1616 16.478 -6.313 6.387 1.00 0.00 H new ATOM 0 HB3 SER A1616 15.739 -7.868 6.712 1.00 0.00 H new ATOM 0 HG SER A1616 15.236 -6.299 8.346 1.00 0.00 H new ATOM 1355 N LYS A1617 17.073 -10.080 7.520 1.00 0.00 N ATOM 1356 CA LYS A1617 16.985 -11.313 8.298 1.00 0.00 C ATOM 1357 C LYS A1617 16.975 -12.478 7.346 1.00 0.00 C ATOM 1358 O LYS A1617 17.911 -13.277 7.308 1.00 0.00 O ATOM 1359 CB LYS A1617 15.720 -11.327 9.189 1.00 0.00 C ATOM 1360 CG LYS A1617 15.560 -10.113 10.117 1.00 0.00 C ATOM 1361 CD LYS A1617 16.723 -9.945 11.096 1.00 0.00 C ATOM 1362 CE LYS A1617 16.803 -11.071 12.105 1.00 0.00 C ATOM 1363 NZ LYS A1617 17.954 -10.908 13.009 1.00 0.00 N1+ ATOM 0 H LYS A1617 16.447 -10.038 6.716 1.00 0.00 H new ATOM 0 HA LYS A1617 17.846 -11.382 8.963 1.00 0.00 H new ATOM 0 HB2 LYS A1617 14.843 -11.390 8.545 1.00 0.00 H new ATOM 0 HB3 LYS A1617 15.734 -12.231 9.798 1.00 0.00 H new ATOM 0 HG2 LYS A1617 15.470 -9.211 9.512 1.00 0.00 H new ATOM 0 HG3 LYS A1617 14.632 -10.214 10.679 1.00 0.00 H new ATOM 0 HD2 LYS A1617 17.658 -9.895 10.538 1.00 0.00 H new ATOM 0 HD3 LYS A1617 16.615 -8.997 11.623 1.00 0.00 H new ATOM 0 HE2 LYS A1617 15.883 -11.103 12.689 1.00 0.00 H new ATOM 0 HE3 LYS A1617 16.882 -12.024 11.582 1.00 0.00 H new ATOM 0 HZ1 LYS A1617 17.978 -11.697 13.687 1.00 0.00 H new ATOM 0 HZ2 LYS A1617 18.833 -10.902 12.454 1.00 0.00 H new ATOM 0 HZ3 LYS A1617 17.865 -10.010 13.526 1.00 0.00 H new ATOM 1377 N ASN A1618 15.925 -12.570 6.564 1.00 0.00 N ATOM 1378 CA ASN A1618 15.876 -13.545 5.499 1.00 0.00 C ATOM 1379 C ASN A1618 16.455 -12.917 4.260 1.00 0.00 C ATOM 1380 O ASN A1618 16.778 -11.723 4.270 1.00 0.00 O ATOM 1381 CB ASN A1618 14.465 -14.092 5.249 1.00 0.00 C ATOM 1382 CG ASN A1618 14.092 -15.261 6.164 1.00 0.00 C ATOM 1383 OD1 ASN A1618 14.318 -16.429 5.818 1.00 0.00 O ATOM 1384 ND2 ASN A1618 13.515 -14.983 7.302 1.00 0.00 N ATOM 0 H ASN A1618 15.095 -11.983 6.644 1.00 0.00 H new ATOM 0 HA ASN A1618 16.467 -14.412 5.793 1.00 0.00 H new ATOM 0 HB2 ASN A1618 13.742 -13.288 5.387 1.00 0.00 H new ATOM 0 HB3 ASN A1618 14.388 -14.415 4.211 1.00 0.00 H new ATOM 0 HD21 ASN A1618 13.238 -15.737 7.931 1.00 0.00 H new ATOM 0 HD22 ASN A1618 13.341 -14.012 7.562 1.00 0.00 H new ATOM 1391 N ALA A1619 16.585 -13.671 3.212 1.00 0.00 N ATOM 1392 CA ALA A1619 17.280 -13.199 2.029 1.00 0.00 C ATOM 1393 C ALA A1619 16.357 -13.088 0.823 1.00 0.00 C ATOM 1394 O ALA A1619 16.776 -13.278 -0.321 1.00 0.00 O ATOM 1395 CB ALA A1619 18.459 -14.112 1.747 1.00 0.00 C ATOM 0 H ALA A1619 16.221 -14.621 3.141 1.00 0.00 H new ATOM 0 HA ALA A1619 17.644 -12.190 2.221 1.00 0.00 H new ATOM 0 HB1 ALA A1619 18.986 -13.763 0.859 1.00 0.00 H new ATOM 0 HB2 ALA A1619 19.139 -14.102 2.599 1.00 0.00 H new ATOM 0 HB3 ALA A1619 18.101 -15.128 1.580 1.00 0.00 H new ATOM 1401 N LEU A1620 15.125 -12.722 1.074 1.00 0.00 N ATOM 1402 CA LEU A1620 14.148 -12.511 0.021 1.00 0.00 C ATOM 1403 C LEU A1620 14.241 -11.082 -0.419 1.00 0.00 C ATOM 1404 O LEU A1620 15.207 -10.388 -0.108 1.00 0.00 O ATOM 1405 CB LEU A1620 12.706 -12.781 0.502 1.00 0.00 C ATOM 1406 CG LEU A1620 12.337 -14.212 0.868 1.00 0.00 C ATOM 1407 CD1 LEU A1620 12.839 -14.584 2.239 1.00 0.00 C ATOM 1408 CD2 LEU A1620 10.849 -14.400 0.769 1.00 0.00 C ATOM 0 H LEU A1620 14.765 -12.560 2.014 1.00 0.00 H new ATOM 0 HA LEU A1620 14.366 -13.204 -0.792 1.00 0.00 H new ATOM 0 HB2 LEU A1620 12.521 -12.154 1.374 1.00 0.00 H new ATOM 0 HB3 LEU A1620 12.024 -12.449 -0.281 1.00 0.00 H new ATOM 0 HG LEU A1620 12.824 -14.880 0.158 1.00 0.00 H new ATOM 0 HD11 LEU A1620 12.556 -15.612 2.464 1.00 0.00 H new ATOM 0 HD12 LEU A1620 13.925 -14.493 2.266 1.00 0.00 H new ATOM 0 HD13 LEU A1620 12.400 -13.917 2.981 1.00 0.00 H new ATOM 0 HD21 LEU A1620 10.594 -15.426 1.032 1.00 0.00 H new ATOM 0 HD22 LEU A1620 10.349 -13.715 1.454 1.00 0.00 H new ATOM 0 HD23 LEU A1620 10.523 -14.196 -0.251 1.00 0.00 H new ATOM 1420 N LYS A1621 13.293 -10.645 -1.157 1.00 0.00 N ATOM 1421 CA LYS A1621 13.227 -9.268 -1.479 1.00 0.00 C ATOM 1422 C LYS A1621 12.213 -8.618 -0.601 1.00 0.00 C ATOM 1423 O LYS A1621 11.349 -9.304 -0.028 1.00 0.00 O ATOM 1424 CB LYS A1621 12.880 -9.006 -2.934 1.00 0.00 C ATOM 1425 CG LYS A1621 13.930 -9.425 -3.934 1.00 0.00 C ATOM 1426 CD LYS A1621 13.812 -10.873 -4.337 1.00 0.00 C ATOM 1427 CE LYS A1621 14.741 -11.194 -5.492 1.00 0.00 C ATOM 1428 NZ LYS A1621 14.486 -10.330 -6.671 1.00 0.00 N1+ ATOM 0 H LYS A1621 12.549 -11.220 -1.552 1.00 0.00 H new ATOM 0 HA LYS A1621 14.220 -8.849 -1.316 1.00 0.00 H new ATOM 0 HB2 LYS A1621 11.951 -9.526 -3.168 1.00 0.00 H new ATOM 0 HB3 LYS A1621 12.688 -7.940 -3.058 1.00 0.00 H new ATOM 0 HG2 LYS A1621 13.849 -8.798 -4.822 1.00 0.00 H new ATOM 0 HG3 LYS A1621 14.919 -9.251 -3.510 1.00 0.00 H new ATOM 0 HD2 LYS A1621 14.050 -11.511 -3.486 1.00 0.00 H new ATOM 0 HD3 LYS A1621 12.783 -11.092 -4.622 1.00 0.00 H new ATOM 0 HE2 LYS A1621 15.775 -11.071 -5.170 1.00 0.00 H new ATOM 0 HE3 LYS A1621 14.618 -12.239 -5.776 1.00 0.00 H new ATOM 0 HZ1 LYS A1621 14.593 -10.890 -7.541 1.00 0.00 H new ATOM 0 HZ2 LYS A1621 13.519 -9.950 -6.620 1.00 0.00 H new ATOM 0 HZ3 LYS A1621 15.167 -9.544 -6.679 1.00 0.00 H new ATOM 1442 N TYR A1622 12.316 -7.332 -0.468 1.00 0.00 N ATOM 1443 CA TYR A1622 11.353 -6.593 0.292 1.00 0.00 C ATOM 1444 C TYR A1622 10.028 -6.559 -0.433 1.00 0.00 C ATOM 1445 O TYR A1622 9.976 -6.614 -1.674 1.00 0.00 O ATOM 1446 CB TYR A1622 11.815 -5.163 0.546 1.00 0.00 C ATOM 1447 CG TYR A1622 12.925 -5.007 1.544 1.00 0.00 C ATOM 1448 CD1 TYR A1622 12.699 -5.269 2.880 1.00 0.00 C ATOM 1449 CD2 TYR A1622 14.181 -4.561 1.162 1.00 0.00 C ATOM 1450 CE1 TYR A1622 13.682 -5.105 3.818 1.00 0.00 C ATOM 1451 CE2 TYR A1622 15.187 -4.390 2.093 1.00 0.00 C ATOM 1452 CZ TYR A1622 14.930 -4.664 3.431 1.00 0.00 C ATOM 1453 OH TYR A1622 15.925 -4.516 4.381 1.00 0.00 O ATOM 0 H TYR A1622 13.061 -6.769 -0.878 1.00 0.00 H new ATOM 0 HA TYR A1622 11.241 -7.099 1.251 1.00 0.00 H new ATOM 0 HB2 TYR A1622 12.139 -4.731 -0.401 1.00 0.00 H new ATOM 0 HB3 TYR A1622 10.960 -4.579 0.886 1.00 0.00 H new ATOM 0 HD1 TYR A1622 11.724 -5.611 3.193 1.00 0.00 H new ATOM 0 HD2 TYR A1622 14.376 -4.344 0.122 1.00 0.00 H new ATOM 0 HE1 TYR A1622 13.481 -5.320 4.857 1.00 0.00 H new ATOM 0 HE2 TYR A1622 16.163 -4.047 1.784 1.00 0.00 H new ATOM 0 HH TYR A1622 16.745 -4.199 3.949 1.00 0.00 H new ATOM 1463 N LYS A1623 8.980 -6.506 0.319 1.00 0.00 N ATOM 1464 CA LYS A1623 7.679 -6.338 -0.221 1.00 0.00 C ATOM 1465 C LYS A1623 6.960 -5.420 0.729 1.00 0.00 C ATOM 1466 O LYS A1623 7.293 -5.378 1.917 1.00 0.00 O ATOM 1467 CB LYS A1623 6.885 -7.664 -0.396 1.00 0.00 C ATOM 1468 CG LYS A1623 6.020 -8.011 0.789 1.00 0.00 C ATOM 1469 CD LYS A1623 5.076 -9.171 0.535 1.00 0.00 C ATOM 1470 CE LYS A1623 5.793 -10.478 0.419 1.00 0.00 C ATOM 1471 NZ LYS A1623 4.853 -11.607 0.255 1.00 0.00 N1+ ATOM 0 H LYS A1623 9.006 -6.579 1.336 1.00 0.00 H new ATOM 0 HA LYS A1623 7.759 -5.934 -1.230 1.00 0.00 H new ATOM 0 HB2 LYS A1623 6.257 -7.587 -1.283 1.00 0.00 H new ATOM 0 HB3 LYS A1623 7.588 -8.478 -0.573 1.00 0.00 H new ATOM 0 HG2 LYS A1623 6.661 -8.254 1.637 1.00 0.00 H new ATOM 0 HG3 LYS A1623 5.437 -7.134 1.071 1.00 0.00 H new ATOM 0 HD2 LYS A1623 4.350 -9.229 1.346 1.00 0.00 H new ATOM 0 HD3 LYS A1623 4.515 -8.985 -0.381 1.00 0.00 H new ATOM 0 HE2 LYS A1623 6.473 -10.445 -0.432 1.00 0.00 H new ATOM 0 HE3 LYS A1623 6.402 -10.639 1.308 1.00 0.00 H new ATOM 0 HZ1 LYS A1623 5.388 -12.496 0.178 1.00 0.00 H new ATOM 0 HZ2 LYS A1623 4.220 -11.654 1.079 1.00 0.00 H new ATOM 0 HZ3 LYS A1623 4.289 -11.467 -0.607 1.00 0.00 H new ATOM 1485 N SER A1624 6.028 -4.705 0.248 1.00 0.00 N ATOM 1486 CA SER A1624 5.318 -3.792 1.054 1.00 0.00 C ATOM 1487 C SER A1624 3.861 -4.130 1.016 1.00 0.00 C ATOM 1488 O SER A1624 3.290 -4.300 -0.055 1.00 0.00 O ATOM 1489 CB SER A1624 5.563 -2.372 0.572 1.00 0.00 C ATOM 1490 OG SER A1624 4.882 -1.440 1.375 1.00 0.00 O ATOM 0 H SER A1624 5.729 -4.733 -0.727 1.00 0.00 H new ATOM 0 HA SER A1624 5.666 -3.861 2.085 1.00 0.00 H new ATOM 0 HB2 SER A1624 6.632 -2.158 0.588 1.00 0.00 H new ATOM 0 HB3 SER A1624 5.234 -2.274 -0.463 1.00 0.00 H new ATOM 0 HG SER A1624 5.268 -1.440 2.276 1.00 0.00 H new ATOM 1496 N VAL A1625 3.278 -4.267 2.169 1.00 0.00 N ATOM 1497 CA VAL A1625 1.910 -4.584 2.293 1.00 0.00 C ATOM 1498 C VAL A1625 1.222 -3.479 3.064 1.00 0.00 C ATOM 1499 O VAL A1625 1.357 -3.354 4.296 1.00 0.00 O ATOM 1500 CB VAL A1625 1.730 -5.940 2.985 1.00 0.00 C ATOM 1501 CG1 VAL A1625 0.275 -6.210 3.205 1.00 0.00 C ATOM 1502 CG2 VAL A1625 2.326 -7.037 2.127 1.00 0.00 C ATOM 0 H VAL A1625 3.761 -4.157 3.061 1.00 0.00 H new ATOM 0 HA VAL A1625 1.459 -4.664 1.304 1.00 0.00 H new ATOM 0 HB VAL A1625 2.240 -5.918 3.948 1.00 0.00 H new ATOM 0 HG11 VAL A1625 0.154 -7.175 3.697 1.00 0.00 H new ATOM 0 HG12 VAL A1625 -0.149 -5.427 3.833 1.00 0.00 H new ATOM 0 HG13 VAL A1625 -0.241 -6.225 2.245 1.00 0.00 H new ATOM 0 HG21 VAL A1625 2.195 -7.999 2.623 1.00 0.00 H new ATOM 0 HG22 VAL A1625 1.823 -7.056 1.160 1.00 0.00 H new ATOM 0 HG23 VAL A1625 3.389 -6.846 1.979 1.00 0.00 H new ATOM 1512 N ILE A1626 0.579 -2.639 2.330 1.00 0.00 N ATOM 1513 CA ILE A1626 -0.114 -1.505 2.867 1.00 0.00 C ATOM 1514 C ILE A1626 -1.577 -1.875 3.044 1.00 0.00 C ATOM 1515 O ILE A1626 -2.265 -2.211 2.067 1.00 0.00 O ATOM 1516 CB ILE A1626 -0.013 -0.314 1.890 1.00 0.00 C ATOM 1517 CG1 ILE A1626 1.445 -0.075 1.503 1.00 0.00 C ATOM 1518 CG2 ILE A1626 -0.573 0.932 2.550 1.00 0.00 C ATOM 1519 CD1 ILE A1626 1.635 0.969 0.431 1.00 0.00 C ATOM 0 H ILE A1626 0.515 -2.717 1.315 1.00 0.00 H new ATOM 0 HA ILE A1626 0.330 -1.223 3.822 1.00 0.00 H new ATOM 0 HB ILE A1626 -0.587 -0.542 0.992 1.00 0.00 H new ATOM 0 HG12 ILE A1626 2.001 0.226 2.391 1.00 0.00 H new ATOM 0 HG13 ILE A1626 1.877 -1.015 1.160 1.00 0.00 H new ATOM 0 HG21 ILE A1626 -0.501 1.773 1.860 1.00 0.00 H new ATOM 0 HG22 ILE A1626 -1.618 0.766 2.813 1.00 0.00 H new ATOM 0 HG23 ILE A1626 -0.003 1.154 3.452 1.00 0.00 H new ATOM 0 HD11 ILE A1626 2.698 1.079 0.214 1.00 0.00 H new ATOM 0 HD12 ILE A1626 1.110 0.662 -0.473 1.00 0.00 H new ATOM 0 HD13 ILE A1626 1.235 1.922 0.777 1.00 0.00 H new ATOM 1531 N SER A1627 -2.021 -1.894 4.267 1.00 0.00 N ATOM 1532 CA SER A1627 -3.384 -2.197 4.569 1.00 0.00 C ATOM 1533 C SER A1627 -4.212 -0.915 4.605 1.00 0.00 C ATOM 1534 O SER A1627 -3.956 -0.019 5.408 1.00 0.00 O ATOM 1535 CB SER A1627 -3.471 -2.963 5.895 1.00 0.00 C ATOM 1536 OG SER A1627 -2.777 -2.300 6.950 1.00 0.00 O ATOM 0 H SER A1627 -1.443 -1.699 5.084 1.00 0.00 H new ATOM 0 HA SER A1627 -3.794 -2.836 3.787 1.00 0.00 H new ATOM 0 HB2 SER A1627 -4.518 -3.086 6.173 1.00 0.00 H new ATOM 0 HB3 SER A1627 -3.057 -3.962 5.762 1.00 0.00 H new ATOM 0 HG SER A1627 -2.860 -2.822 7.775 1.00 0.00 H new ATOM 1542 N PHE A1628 -5.170 -0.827 3.728 1.00 0.00 N ATOM 1543 CA PHE A1628 -6.019 0.320 3.627 1.00 0.00 C ATOM 1544 C PHE A1628 -7.243 0.095 4.429 1.00 0.00 C ATOM 1545 O PHE A1628 -8.108 -0.716 4.093 1.00 0.00 O ATOM 1546 CB PHE A1628 -6.367 0.657 2.193 1.00 0.00 C ATOM 1547 CG PHE A1628 -5.185 1.008 1.375 1.00 0.00 C ATOM 1548 CD1 PHE A1628 -4.430 0.033 0.777 1.00 0.00 C ATOM 1549 CD2 PHE A1628 -4.830 2.316 1.215 1.00 0.00 C ATOM 1550 CE1 PHE A1628 -3.331 0.362 0.030 1.00 0.00 C ATOM 1551 CE2 PHE A1628 -3.738 2.665 0.468 1.00 0.00 C ATOM 1552 CZ PHE A1628 -2.982 1.691 -0.126 1.00 0.00 C ATOM 0 H PHE A1628 -5.385 -1.562 3.054 1.00 0.00 H new ATOM 0 HA PHE A1628 -5.475 1.179 4.021 1.00 0.00 H new ATOM 0 HB2 PHE A1628 -6.875 -0.194 1.739 1.00 0.00 H new ATOM 0 HB3 PHE A1628 -7.069 1.491 2.182 1.00 0.00 H new ATOM 0 HD1 PHE A1628 -4.705 -1.005 0.896 1.00 0.00 H new ATOM 0 HD2 PHE A1628 -5.421 3.088 1.686 1.00 0.00 H new ATOM 0 HE1 PHE A1628 -2.739 -0.413 -0.435 1.00 0.00 H new ATOM 0 HE2 PHE A1628 -3.474 3.705 0.348 1.00 0.00 H new ATOM 0 HZ PHE A1628 -2.117 1.959 -0.714 1.00 0.00 H new ATOM 1562 N VAL A1629 -7.284 0.803 5.466 1.00 0.00 N ATOM 1563 CA VAL A1629 -8.273 0.735 6.470 1.00 0.00 C ATOM 1564 C VAL A1629 -9.230 1.895 6.329 1.00 0.00 C ATOM 1565 O VAL A1629 -8.803 3.025 6.140 1.00 0.00 O ATOM 1566 CB VAL A1629 -7.549 0.823 7.818 1.00 0.00 C ATOM 1567 CG1 VAL A1629 -8.509 1.074 8.949 1.00 0.00 C ATOM 1568 CG2 VAL A1629 -6.721 -0.431 8.055 1.00 0.00 C ATOM 0 H VAL A1629 -6.574 1.508 5.665 1.00 0.00 H new ATOM 0 HA VAL A1629 -8.844 -0.190 6.391 1.00 0.00 H new ATOM 0 HB VAL A1629 -6.873 1.677 7.785 1.00 0.00 H new ATOM 0 HG11 VAL A1629 -7.958 1.130 9.888 1.00 0.00 H new ATOM 0 HG12 VAL A1629 -9.033 2.014 8.779 1.00 0.00 H new ATOM 0 HG13 VAL A1629 -9.232 0.260 9.000 1.00 0.00 H new ATOM 0 HG21 VAL A1629 -6.212 -0.355 9.016 1.00 0.00 H new ATOM 0 HG22 VAL A1629 -7.375 -1.303 8.059 1.00 0.00 H new ATOM 0 HG23 VAL A1629 -5.982 -0.535 7.260 1.00 0.00 H new ATOM 1578 N CYS A1630 -10.493 1.593 6.379 1.00 0.00 N ATOM 1579 CA CYS A1630 -11.566 2.571 6.318 1.00 0.00 C ATOM 1580 C CYS A1630 -11.423 3.640 7.377 1.00 0.00 C ATOM 1581 O CYS A1630 -11.289 3.345 8.568 1.00 0.00 O ATOM 1582 CB CYS A1630 -12.947 1.891 6.486 1.00 0.00 C ATOM 1583 SG CYS A1630 -14.287 3.028 7.086 1.00 0.00 S ATOM 0 H CYS A1630 -10.827 0.633 6.466 1.00 0.00 H new ATOM 0 HA CYS A1630 -11.498 3.038 5.336 1.00 0.00 H new ATOM 0 HB2 CYS A1630 -13.249 1.465 5.529 1.00 0.00 H new ATOM 0 HB3 CYS A1630 -12.848 1.062 7.187 1.00 0.00 H new ATOM 1588 N THR A1631 -11.395 4.864 6.948 1.00 0.00 N ATOM 1589 CA THR A1631 -11.480 5.953 7.873 1.00 0.00 C ATOM 1590 C THR A1631 -12.691 6.786 7.496 1.00 0.00 C ATOM 1591 O THR A1631 -13.013 6.905 6.312 1.00 0.00 O ATOM 1592 CB THR A1631 -10.165 6.797 8.010 1.00 0.00 C ATOM 1593 OG1 THR A1631 -10.287 7.762 9.066 1.00 0.00 O ATOM 1594 CG2 THR A1631 -9.811 7.513 6.746 1.00 0.00 C ATOM 0 H THR A1631 -11.314 5.134 5.968 1.00 0.00 H new ATOM 0 HA THR A1631 -11.604 5.547 8.877 1.00 0.00 H new ATOM 0 HB THR A1631 -9.370 6.087 8.238 1.00 0.00 H new ATOM 0 HG1 THR A1631 -10.551 8.627 8.689 1.00 0.00 H new ATOM 0 HG21 THR A1631 -8.893 8.082 6.895 1.00 0.00 H new ATOM 0 HG22 THR A1631 -9.662 6.787 5.946 1.00 0.00 H new ATOM 0 HG23 THR A1631 -10.619 8.192 6.474 1.00 0.00 H new ATOM 1602 N HIS A1632 -13.371 7.316 8.489 1.00 0.00 N ATOM 1603 CA HIS A1632 -14.649 8.045 8.328 1.00 0.00 C ATOM 1604 C HIS A1632 -14.526 9.368 7.551 1.00 0.00 C ATOM 1605 O HIS A1632 -15.517 10.088 7.373 1.00 0.00 O ATOM 1606 CB HIS A1632 -15.326 8.271 9.686 1.00 0.00 C ATOM 1607 CG HIS A1632 -15.910 7.028 10.310 1.00 0.00 C ATOM 1608 ND1 HIS A1632 -17.232 6.925 10.683 1.00 0.00 N ATOM 1609 CD2 HIS A1632 -15.341 5.845 10.648 1.00 0.00 C ATOM 1610 CE1 HIS A1632 -17.448 5.742 11.219 1.00 0.00 C ATOM 1611 NE2 HIS A1632 -16.319 5.069 11.208 1.00 0.00 N ATOM 0 H HIS A1632 -13.060 7.261 9.459 1.00 0.00 H new ATOM 0 HA HIS A1632 -15.278 7.400 7.715 1.00 0.00 H new ATOM 0 HB2 HIS A1632 -14.597 8.699 10.374 1.00 0.00 H new ATOM 0 HB3 HIS A1632 -16.120 9.008 9.564 1.00 0.00 H new ATOM 0 HD2 HIS A1632 -14.308 5.567 10.502 1.00 0.00 H new ATOM 0 HE1 HIS A1632 -18.392 5.385 11.603 1.00 0.00 H new ATOM 0 HE2 HIS A1632 -16.192 4.120 11.560 1.00 0.00 H new ATOM 1620 N ASP A1633 -13.323 9.671 7.093 1.00 0.00 N ATOM 1621 CA ASP A1633 -13.020 10.888 6.313 1.00 0.00 C ATOM 1622 C ASP A1633 -13.649 10.759 4.914 1.00 0.00 C ATOM 1623 O ASP A1633 -14.456 9.854 4.674 1.00 0.00 O ATOM 1624 CB ASP A1633 -11.486 11.052 6.191 1.00 0.00 C ATOM 1625 CG ASP A1633 -10.784 11.300 7.513 1.00 0.00 C ATOM 1626 OD1 ASP A1633 -10.596 10.335 8.310 1.00 0.00 O1- ATOM 1627 OD2 ASP A1633 -10.404 12.448 7.791 1.00 0.00 O ATOM 0 H ASP A1633 -12.508 9.078 7.248 1.00 0.00 H new ATOM 0 HA ASP A1633 -13.432 11.763 6.815 1.00 0.00 H new ATOM 0 HB2 ASP A1633 -11.070 10.154 5.734 1.00 0.00 H new ATOM 0 HB3 ASP A1633 -11.272 11.881 5.517 1.00 0.00 H new ATOM 1632 N SER A1634 -13.300 11.620 3.982 1.00 0.00 N ATOM 1633 CA SER A1634 -13.866 11.496 2.657 1.00 0.00 C ATOM 1634 C SER A1634 -12.787 11.623 1.549 1.00 0.00 C ATOM 1635 O SER A1634 -12.316 12.730 1.242 1.00 0.00 O ATOM 1636 CB SER A1634 -15.001 12.507 2.466 1.00 0.00 C ATOM 1637 OG SER A1634 -15.774 12.206 1.307 1.00 0.00 O ATOM 0 H SER A1634 -12.646 12.392 4.110 1.00 0.00 H new ATOM 0 HA SER A1634 -14.285 10.494 2.563 1.00 0.00 H new ATOM 0 HB2 SER A1634 -15.645 12.505 3.346 1.00 0.00 H new ATOM 0 HB3 SER A1634 -14.586 13.511 2.378 1.00 0.00 H new ATOM 0 HG SER A1634 -16.492 12.867 1.212 1.00 0.00 H new ATOM 1643 N GLY A1635 -12.403 10.475 0.971 1.00 0.00 N ATOM 1644 CA GLY A1635 -11.420 10.412 -0.116 1.00 0.00 C ATOM 1645 C GLY A1635 -10.096 11.056 0.226 1.00 0.00 C ATOM 1646 O GLY A1635 -9.590 11.917 -0.501 1.00 0.00 O ATOM 0 H GLY A1635 -12.768 9.563 1.246 1.00 0.00 H new ATOM 0 HA2 GLY A1635 -11.249 9.368 -0.380 1.00 0.00 H new ATOM 0 HA3 GLY A1635 -11.835 10.900 -0.998 1.00 0.00 H new ATOM 1650 N ALA A1636 -9.553 10.635 1.319 1.00 0.00 N ATOM 1651 CA ALA A1636 -8.316 11.142 1.858 1.00 0.00 C ATOM 1652 C ALA A1636 -7.332 10.001 1.959 1.00 0.00 C ATOM 1653 O ALA A1636 -7.651 8.874 1.569 1.00 0.00 O ATOM 1654 CB ALA A1636 -8.580 11.701 3.226 1.00 0.00 C ATOM 0 H ALA A1636 -9.968 9.899 1.891 1.00 0.00 H new ATOM 0 HA ALA A1636 -7.910 11.923 1.216 1.00 0.00 H new ATOM 0 HB1 ALA A1636 -7.652 12.088 3.646 1.00 0.00 H new ATOM 0 HB2 ALA A1636 -9.310 12.507 3.155 1.00 0.00 H new ATOM 0 HB3 ALA A1636 -8.970 10.914 3.872 1.00 0.00 H new ATOM 1660 N ASN A1637 -6.154 10.255 2.442 1.00 0.00 N ATOM 1661 CA ASN A1637 -5.222 9.191 2.628 1.00 0.00 C ATOM 1662 C ASN A1637 -4.804 9.164 4.071 1.00 0.00 C ATOM 1663 O ASN A1637 -4.294 8.164 4.548 1.00 0.00 O ATOM 1664 CB ASN A1637 -4.002 9.315 1.702 1.00 0.00 C ATOM 1665 CG ASN A1637 -2.983 10.369 2.097 1.00 0.00 C ATOM 1666 OD1 ASN A1637 -3.085 11.525 1.697 1.00 0.00 O ATOM 1667 ND2 ASN A1637 -1.972 9.965 2.836 1.00 0.00 N ATOM 0 H ASN A1637 -5.820 11.180 2.711 1.00 0.00 H new ATOM 0 HA ASN A1637 -5.708 8.252 2.364 1.00 0.00 H new ATOM 0 HB2 ASN A1637 -3.500 8.348 1.660 1.00 0.00 H new ATOM 0 HB3 ASN A1637 -4.354 9.535 0.694 1.00 0.00 H new ATOM 0 HD21 ASN A1637 -1.236 10.622 3.096 1.00 0.00 H new ATOM 0 HD22 ASN A1637 -1.924 8.995 3.148 1.00 0.00 H new ATOM 1674 N ASN A1638 -5.011 10.306 4.739 1.00 0.00 N ATOM 1675 CA ASN A1638 -4.743 10.513 6.162 1.00 0.00 C ATOM 1676 C ASN A1638 -3.296 10.399 6.503 1.00 0.00 C ATOM 1677 O ASN A1638 -2.594 11.401 6.677 1.00 0.00 O ATOM 1678 CB ASN A1638 -5.598 9.612 7.084 1.00 0.00 C ATOM 1679 CG ASN A1638 -7.068 10.002 7.159 1.00 0.00 C ATOM 1680 OD1 ASN A1638 -7.639 10.558 6.213 1.00 0.00 O ATOM 1681 ND2 ASN A1638 -7.691 9.728 8.286 1.00 0.00 N ATOM 0 H ASN A1638 -5.383 11.139 4.284 1.00 0.00 H new ATOM 0 HA ASN A1638 -5.045 11.543 6.353 1.00 0.00 H new ATOM 0 HB2 ASN A1638 -5.525 8.582 6.734 1.00 0.00 H new ATOM 0 HB3 ASN A1638 -5.176 9.637 8.089 1.00 0.00 H new ATOM 0 HD21 ASN A1638 -8.674 9.975 8.398 1.00 0.00 H new ATOM 0 HD22 ASN A1638 -7.190 9.269 9.047 1.00 0.00 H new ATOM 1688 N LYS A1639 -2.850 9.202 6.523 1.00 0.00 N ATOM 1689 CA LYS A1639 -1.510 8.868 6.946 1.00 0.00 C ATOM 1690 C LYS A1639 -1.160 7.407 6.675 1.00 0.00 C ATOM 1691 O LYS A1639 -1.931 6.497 7.001 1.00 0.00 O ATOM 1692 CB LYS A1639 -1.332 9.136 8.452 1.00 0.00 C ATOM 1693 CG LYS A1639 0.036 8.758 9.013 1.00 0.00 C ATOM 1694 CD LYS A1639 0.121 9.055 10.494 1.00 0.00 C ATOM 1695 CE LYS A1639 -1.033 8.413 11.248 1.00 0.00 C ATOM 1696 NZ LYS A1639 -0.980 8.685 12.701 1.00 0.00 N1+ ATOM 0 H LYS A1639 -3.405 8.394 6.242 1.00 0.00 H new ATOM 0 HA LYS A1639 -0.841 9.501 6.363 1.00 0.00 H new ATOM 0 HB2 LYS A1639 -1.506 10.195 8.641 1.00 0.00 H new ATOM 0 HB3 LYS A1639 -2.098 8.585 8.998 1.00 0.00 H new ATOM 0 HG2 LYS A1639 0.222 7.698 8.841 1.00 0.00 H new ATOM 0 HG3 LYS A1639 0.814 9.309 8.484 1.00 0.00 H new ATOM 0 HD2 LYS A1639 1.068 8.686 10.888 1.00 0.00 H new ATOM 0 HD3 LYS A1639 0.108 10.133 10.653 1.00 0.00 H new ATOM 0 HE2 LYS A1639 -1.976 8.783 10.846 1.00 0.00 H new ATOM 0 HE3 LYS A1639 -1.017 7.336 11.082 1.00 0.00 H new ATOM 0 HZ1 LYS A1639 -1.787 8.226 13.170 1.00 0.00 H new ATOM 0 HZ2 LYS A1639 -0.093 8.309 13.092 1.00 0.00 H new ATOM 0 HZ3 LYS A1639 -1.023 9.711 12.864 1.00 0.00 H new ATOM 1710 N PRO A1640 -0.021 7.172 6.047 1.00 0.00 N ATOM 1711 CA PRO A1640 0.569 5.861 5.972 1.00 0.00 C ATOM 1712 C PRO A1640 1.497 5.645 7.178 1.00 0.00 C ATOM 1713 O PRO A1640 2.352 6.502 7.484 1.00 0.00 O ATOM 1714 CB PRO A1640 1.383 5.910 4.686 1.00 0.00 C ATOM 1715 CG PRO A1640 1.456 7.345 4.265 1.00 0.00 C ATOM 1716 CD PRO A1640 0.758 8.158 5.301 1.00 0.00 C ATOM 0 HA PRO A1640 -0.164 5.054 5.980 1.00 0.00 H new ATOM 0 HB2 PRO A1640 2.382 5.505 4.847 1.00 0.00 H new ATOM 0 HB3 PRO A1640 0.914 5.304 3.910 1.00 0.00 H new ATOM 0 HG2 PRO A1640 2.494 7.662 4.166 1.00 0.00 H new ATOM 0 HG3 PRO A1640 0.986 7.482 3.291 1.00 0.00 H new ATOM 0 HD2 PRO A1640 1.466 8.680 5.945 1.00 0.00 H new ATOM 0 HD3 PRO A1640 0.118 8.917 4.851 1.00 0.00 H new ATOM 1724 N VAL A1641 1.337 4.550 7.871 1.00 0.00 N ATOM 1725 CA VAL A1641 2.145 4.310 9.047 1.00 0.00 C ATOM 1726 C VAL A1641 2.764 2.929 8.998 1.00 0.00 C ATOM 1727 O VAL A1641 2.275 2.074 8.295 1.00 0.00 O ATOM 1728 CB VAL A1641 1.295 4.480 10.343 1.00 0.00 C ATOM 1729 CG1 VAL A1641 0.788 3.165 10.946 1.00 0.00 C ATOM 1730 CG2 VAL A1641 1.982 5.353 11.363 1.00 0.00 C ATOM 0 H VAL A1641 0.665 3.815 7.650 1.00 0.00 H new ATOM 0 HA VAL A1641 2.948 5.047 9.063 1.00 0.00 H new ATOM 0 HB VAL A1641 0.394 5.002 10.022 1.00 0.00 H new ATOM 0 HG11 VAL A1641 0.207 3.377 11.844 1.00 0.00 H new ATOM 0 HG12 VAL A1641 0.159 2.650 10.220 1.00 0.00 H new ATOM 0 HG13 VAL A1641 1.637 2.532 11.204 1.00 0.00 H new ATOM 0 HG21 VAL A1641 1.352 5.443 12.248 1.00 0.00 H new ATOM 0 HG22 VAL A1641 2.937 4.906 11.640 1.00 0.00 H new ATOM 0 HG23 VAL A1641 2.154 6.342 10.939 1.00 0.00 H new ATOM 1740 N PHE A1642 3.820 2.730 9.738 1.00 0.00 N ATOM 1741 CA PHE A1642 4.463 1.480 9.852 1.00 0.00 C ATOM 1742 C PHE A1642 3.993 0.826 11.104 1.00 0.00 C ATOM 1743 O PHE A1642 3.906 1.464 12.160 1.00 0.00 O ATOM 1744 CB PHE A1642 5.977 1.681 9.886 1.00 0.00 C ATOM 1745 CG PHE A1642 6.747 0.424 10.023 1.00 0.00 C ATOM 1746 CD1 PHE A1642 6.898 -0.418 8.947 1.00 0.00 C ATOM 1747 CD2 PHE A1642 7.314 0.080 11.233 1.00 0.00 C ATOM 1748 CE1 PHE A1642 7.598 -1.582 9.065 1.00 0.00 C ATOM 1749 CE2 PHE A1642 8.017 -1.081 11.365 1.00 0.00 C ATOM 1750 CZ PHE A1642 8.164 -1.919 10.280 1.00 0.00 C ATOM 0 H PHE A1642 4.259 3.467 10.290 1.00 0.00 H new ATOM 0 HA PHE A1642 4.223 0.848 8.997 1.00 0.00 H new ATOM 0 HB2 PHE A1642 6.287 2.187 8.972 1.00 0.00 H new ATOM 0 HB3 PHE A1642 6.227 2.341 10.717 1.00 0.00 H new ATOM 0 HD1 PHE A1642 6.457 -0.154 7.997 1.00 0.00 H new ATOM 0 HD2 PHE A1642 7.200 0.736 12.083 1.00 0.00 H new ATOM 0 HE1 PHE A1642 7.710 -2.237 8.214 1.00 0.00 H new ATOM 0 HE2 PHE A1642 8.457 -1.343 12.316 1.00 0.00 H new ATOM 0 HZ PHE A1642 8.721 -2.839 10.380 1.00 0.00 H new ATOM 1760 N VAL A1643 3.646 -0.398 10.993 1.00 0.00 N ATOM 1761 CA VAL A1643 3.221 -1.148 12.110 1.00 0.00 C ATOM 1762 C VAL A1643 4.196 -2.292 12.404 1.00 0.00 C ATOM 1763 O VAL A1643 4.711 -2.409 13.521 1.00 0.00 O ATOM 1764 CB VAL A1643 1.731 -1.611 11.955 1.00 0.00 C ATOM 1765 CG1 VAL A1643 1.417 -2.098 10.546 1.00 0.00 C ATOM 1766 CG2 VAL A1643 1.416 -2.692 12.948 1.00 0.00 C ATOM 0 H VAL A1643 3.649 -0.914 10.113 1.00 0.00 H new ATOM 0 HA VAL A1643 3.237 -0.505 12.990 1.00 0.00 H new ATOM 0 HB VAL A1643 1.105 -0.739 12.148 1.00 0.00 H new ATOM 0 HG11 VAL A1643 0.373 -2.407 10.492 1.00 0.00 H new ATOM 0 HG12 VAL A1643 1.594 -1.292 9.834 1.00 0.00 H new ATOM 0 HG13 VAL A1643 2.059 -2.944 10.302 1.00 0.00 H new ATOM 0 HG21 VAL A1643 0.378 -3.004 12.829 1.00 0.00 H new ATOM 0 HG22 VAL A1643 2.073 -3.545 12.778 1.00 0.00 H new ATOM 0 HG23 VAL A1643 1.567 -2.313 13.959 1.00 0.00 H new ATOM 1776 N SER A1644 4.495 -3.091 11.416 1.00 0.00 N ATOM 1777 CA SER A1644 5.353 -4.229 11.646 1.00 0.00 C ATOM 1778 C SER A1644 6.144 -4.619 10.402 1.00 0.00 C ATOM 1779 O SER A1644 5.718 -4.369 9.276 1.00 0.00 O ATOM 1780 CB SER A1644 4.516 -5.409 12.171 1.00 0.00 C ATOM 1781 OG SER A1644 3.392 -5.670 11.326 1.00 0.00 O ATOM 0 H SER A1644 4.165 -2.981 10.457 1.00 0.00 H new ATOM 0 HA SER A1644 6.089 -3.951 12.400 1.00 0.00 H new ATOM 0 HB2 SER A1644 5.140 -6.300 12.234 1.00 0.00 H new ATOM 0 HB3 SER A1644 4.170 -5.190 13.181 1.00 0.00 H new ATOM 0 HG SER A1644 2.881 -6.426 11.685 1.00 0.00 H new ATOM 1787 N LEU A1645 7.317 -5.147 10.609 1.00 0.00 N ATOM 1788 CA LEU A1645 8.111 -5.670 9.542 1.00 0.00 C ATOM 1789 C LEU A1645 8.134 -7.162 9.693 1.00 0.00 C ATOM 1790 O LEU A1645 8.259 -7.681 10.802 1.00 0.00 O ATOM 1791 CB LEU A1645 9.541 -5.053 9.559 1.00 0.00 C ATOM 1792 CG LEU A1645 10.540 -5.416 8.414 1.00 0.00 C ATOM 1793 CD1 LEU A1645 11.189 -6.778 8.578 1.00 0.00 C ATOM 1794 CD2 LEU A1645 9.880 -5.316 7.060 1.00 0.00 C ATOM 0 H LEU A1645 7.749 -5.226 11.530 1.00 0.00 H new ATOM 0 HA LEU A1645 7.685 -5.407 8.574 1.00 0.00 H new ATOM 0 HB2 LEU A1645 9.431 -3.969 9.567 1.00 0.00 H new ATOM 0 HB3 LEU A1645 10.008 -5.333 10.503 1.00 0.00 H new ATOM 0 HG LEU A1645 11.339 -4.678 8.483 1.00 0.00 H new ATOM 0 HD11 LEU A1645 11.869 -6.960 7.746 1.00 0.00 H new ATOM 0 HD12 LEU A1645 11.746 -6.805 9.514 1.00 0.00 H new ATOM 0 HD13 LEU A1645 10.419 -7.549 8.592 1.00 0.00 H new ATOM 0 HD21 LEU A1645 10.601 -5.574 6.284 1.00 0.00 H new ATOM 0 HD22 LEU A1645 9.036 -6.004 7.015 1.00 0.00 H new ATOM 0 HD23 LEU A1645 9.526 -4.297 6.902 1.00 0.00 H new ATOM 1806 N ASP A1646 8.025 -7.825 8.604 1.00 0.00 N ATOM 1807 CA ASP A1646 7.992 -9.253 8.568 1.00 0.00 C ATOM 1808 C ASP A1646 9.335 -9.690 8.177 1.00 0.00 C ATOM 1809 O ASP A1646 9.788 -9.401 7.089 1.00 0.00 O ATOM 1810 CB ASP A1646 6.988 -9.785 7.564 1.00 0.00 C ATOM 1811 CG ASP A1646 6.964 -11.279 7.535 1.00 0.00 C ATOM 1812 OD1 ASP A1646 7.843 -11.857 6.918 1.00 0.00 O1- ATOM 1813 OD2 ASP A1646 6.076 -11.887 8.166 1.00 0.00 O ATOM 0 H ASP A1646 7.954 -7.387 7.685 1.00 0.00 H new ATOM 0 HA ASP A1646 7.692 -9.632 9.545 1.00 0.00 H new ATOM 0 HB2 ASP A1646 5.995 -9.411 7.812 1.00 0.00 H new ATOM 0 HB3 ASP A1646 7.233 -9.407 6.571 1.00 0.00 H new ATOM 1818 N LYS A1647 9.975 -10.337 9.045 1.00 0.00 N ATOM 1819 CA LYS A1647 11.347 -10.728 8.838 1.00 0.00 C ATOM 1820 C LYS A1647 11.453 -12.072 8.173 1.00 0.00 C ATOM 1821 O LYS A1647 12.549 -12.548 7.895 1.00 0.00 O ATOM 1822 CB LYS A1647 12.045 -10.720 10.166 1.00 0.00 C ATOM 1823 CG LYS A1647 11.733 -9.467 10.930 1.00 0.00 C ATOM 1824 CD LYS A1647 12.382 -9.444 12.277 1.00 0.00 C ATOM 1825 CE LYS A1647 12.079 -8.143 12.984 1.00 0.00 C ATOM 1826 NZ LYS A1647 12.786 -8.024 14.271 1.00 0.00 N1+ ATOM 0 H LYS A1647 9.584 -10.629 9.941 1.00 0.00 H new ATOM 0 HA LYS A1647 11.825 -10.018 8.164 1.00 0.00 H new ATOM 0 HB2 LYS A1647 11.739 -11.590 10.747 1.00 0.00 H new ATOM 0 HB3 LYS A1647 13.122 -10.800 10.015 1.00 0.00 H new ATOM 0 HG2 LYS A1647 12.064 -8.602 10.355 1.00 0.00 H new ATOM 0 HG3 LYS A1647 10.653 -9.376 11.048 1.00 0.00 H new ATOM 0 HD2 LYS A1647 12.024 -10.282 12.875 1.00 0.00 H new ATOM 0 HD3 LYS A1647 13.460 -9.565 12.171 1.00 0.00 H new ATOM 0 HE2 LYS A1647 12.359 -7.309 12.340 1.00 0.00 H new ATOM 0 HE3 LYS A1647 11.005 -8.067 13.154 1.00 0.00 H new ATOM 0 HZ1 LYS A1647 12.545 -7.116 14.717 1.00 0.00 H new ATOM 0 HZ2 LYS A1647 12.500 -8.803 14.898 1.00 0.00 H new ATOM 0 HZ3 LYS A1647 13.812 -8.069 14.109 1.00 0.00 H new ATOM 1840 N GLN A1648 10.325 -12.637 7.868 1.00 0.00 N ATOM 1841 CA GLN A1648 10.253 -13.953 7.260 1.00 0.00 C ATOM 1842 C GLN A1648 10.350 -13.802 5.769 1.00 0.00 C ATOM 1843 O GLN A1648 11.036 -14.561 5.090 1.00 0.00 O ATOM 1844 CB GLN A1648 8.924 -14.621 7.591 1.00 0.00 C ATOM 1845 CG GLN A1648 8.655 -14.775 9.062 1.00 0.00 C ATOM 1846 CD GLN A1648 7.264 -15.302 9.352 1.00 0.00 C ATOM 1847 OE1 GLN A1648 6.288 -14.892 8.579 1.00 0.00 O flip ATOM 1848 NE2 GLN A1648 7.060 -16.017 10.328 1.00 0.00 N flip ATOM 0 H GLN A1648 9.416 -12.204 8.031 1.00 0.00 H new ATOM 0 HA GLN A1648 11.069 -14.565 7.644 1.00 0.00 H new ATOM 0 HB2 GLN A1648 8.118 -14.038 7.146 1.00 0.00 H new ATOM 0 HB3 GLN A1648 8.900 -15.606 7.125 1.00 0.00 H new ATOM 0 HG2 GLN A1648 9.392 -15.452 9.493 1.00 0.00 H new ATOM 0 HG3 GLN A1648 8.783 -13.810 9.553 1.00 0.00 H new ATOM 0 HE21 GLN A1648 7.841 -16.320 10.910 1.00 0.00 H new ATOM 0 HE22 GLN A1648 6.110 -16.309 10.557 1.00 0.00 H new ATOM 1857 N THR A1649 9.669 -12.819 5.265 1.00 0.00 N ATOM 1858 CA THR A1649 9.614 -12.588 3.857 1.00 0.00 C ATOM 1859 C THR A1649 9.844 -11.114 3.529 1.00 0.00 C ATOM 1860 O THR A1649 9.568 -10.655 2.419 1.00 0.00 O ATOM 1861 CB THR A1649 8.289 -13.178 3.240 1.00 0.00 C ATOM 1862 OG1 THR A1649 8.126 -12.828 1.852 1.00 0.00 O ATOM 1863 CG2 THR A1649 7.063 -12.767 4.040 1.00 0.00 C ATOM 0 H THR A1649 9.134 -12.153 5.822 1.00 0.00 H new ATOM 0 HA THR A1649 10.433 -13.127 3.380 1.00 0.00 H new ATOM 0 HB THR A1649 8.385 -14.262 3.296 1.00 0.00 H new ATOM 0 HG1 THR A1649 8.512 -11.942 1.691 1.00 0.00 H new ATOM 0 HG21 THR A1649 6.170 -13.194 3.583 1.00 0.00 H new ATOM 0 HG22 THR A1649 7.157 -13.132 5.063 1.00 0.00 H new ATOM 0 HG23 THR A1649 6.982 -11.680 4.049 1.00 0.00 H new ATOM 1871 N CYS A1650 10.415 -10.405 4.502 1.00 0.00 N ATOM 1872 CA CYS A1650 10.777 -8.990 4.398 1.00 0.00 C ATOM 1873 C CYS A1650 9.615 -8.135 3.920 1.00 0.00 C ATOM 1874 O CYS A1650 9.695 -7.399 2.942 1.00 0.00 O ATOM 1875 CB CYS A1650 12.038 -8.831 3.578 1.00 0.00 C ATOM 1876 SG CYS A1650 13.458 -9.732 4.315 1.00 0.00 S ATOM 0 H CYS A1650 10.645 -10.809 5.410 1.00 0.00 H new ATOM 0 HA CYS A1650 11.003 -8.611 5.395 1.00 0.00 H new ATOM 0 HB2 CYS A1650 11.861 -9.198 2.567 1.00 0.00 H new ATOM 0 HB3 CYS A1650 12.285 -7.773 3.494 1.00 0.00 H new ATOM 1881 N THR A1651 8.541 -8.249 4.642 1.00 0.00 N ATOM 1882 CA THR A1651 7.309 -7.611 4.311 1.00 0.00 C ATOM 1883 C THR A1651 7.042 -6.393 5.199 1.00 0.00 C ATOM 1884 O THR A1651 6.876 -6.506 6.410 1.00 0.00 O ATOM 1885 CB THR A1651 6.198 -8.629 4.459 1.00 0.00 C ATOM 1886 OG1 THR A1651 6.511 -9.741 3.618 1.00 0.00 O ATOM 1887 CG2 THR A1651 4.886 -8.039 4.040 1.00 0.00 C ATOM 0 H THR A1651 8.499 -8.802 5.498 1.00 0.00 H new ATOM 0 HA THR A1651 7.359 -7.246 3.285 1.00 0.00 H new ATOM 0 HB THR A1651 6.115 -8.939 5.501 1.00 0.00 H new ATOM 0 HG1 THR A1651 5.691 -10.239 3.415 1.00 0.00 H new ATOM 0 HG21 THR A1651 4.099 -8.785 4.153 1.00 0.00 H new ATOM 0 HG22 THR A1651 4.660 -7.175 4.665 1.00 0.00 H new ATOM 0 HG23 THR A1651 4.944 -7.728 2.997 1.00 0.00 H new ATOM 1895 N LEU A1652 7.082 -5.254 4.583 1.00 0.00 N ATOM 1896 CA LEU A1652 6.818 -3.974 5.200 1.00 0.00 C ATOM 1897 C LEU A1652 5.317 -3.810 5.408 1.00 0.00 C ATOM 1898 O LEU A1652 4.587 -3.584 4.446 1.00 0.00 O ATOM 1899 CB LEU A1652 7.307 -2.835 4.266 1.00 0.00 C ATOM 1900 CG LEU A1652 8.821 -2.546 4.137 1.00 0.00 C ATOM 1901 CD1 LEU A1652 9.359 -1.947 5.398 1.00 0.00 C ATOM 1902 CD2 LEU A1652 9.637 -3.775 3.740 1.00 0.00 C ATOM 0 H LEU A1652 7.309 -5.178 3.591 1.00 0.00 H new ATOM 0 HA LEU A1652 7.340 -3.927 6.156 1.00 0.00 H new ATOM 0 HB2 LEU A1652 6.930 -3.050 3.266 1.00 0.00 H new ATOM 0 HB3 LEU A1652 6.827 -1.914 4.597 1.00 0.00 H new ATOM 0 HG LEU A1652 8.925 -1.826 3.325 1.00 0.00 H new ATOM 0 HD11 LEU A1652 10.425 -1.753 5.283 1.00 0.00 H new ATOM 0 HD12 LEU A1652 8.840 -1.011 5.607 1.00 0.00 H new ATOM 0 HD13 LEU A1652 9.204 -2.640 6.225 1.00 0.00 H new ATOM 0 HD21 LEU A1652 10.690 -3.504 3.667 1.00 0.00 H new ATOM 0 HD22 LEU A1652 9.514 -4.553 4.494 1.00 0.00 H new ATOM 0 HD23 LEU A1652 9.290 -4.146 2.776 1.00 0.00 H new ATOM 1914 N TYR A1653 4.854 -3.962 6.618 1.00 0.00 N ATOM 1915 CA TYR A1653 3.457 -3.772 6.912 1.00 0.00 C ATOM 1916 C TYR A1653 3.179 -2.347 7.296 1.00 0.00 C ATOM 1917 O TYR A1653 3.673 -1.837 8.325 1.00 0.00 O ATOM 1918 CB TYR A1653 2.940 -4.731 7.990 1.00 0.00 C ATOM 1919 CG TYR A1653 2.789 -6.153 7.515 1.00 0.00 C ATOM 1920 CD1 TYR A1653 1.653 -6.540 6.825 1.00 0.00 C ATOM 1921 CD2 TYR A1653 3.775 -7.099 7.734 1.00 0.00 C ATOM 1922 CE1 TYR A1653 1.497 -7.825 6.367 1.00 0.00 C ATOM 1923 CE2 TYR A1653 3.629 -8.390 7.272 1.00 0.00 C ATOM 1924 CZ TYR A1653 2.486 -8.746 6.588 1.00 0.00 C ATOM 1925 OH TYR A1653 2.342 -10.027 6.111 1.00 0.00 O ATOM 0 H TYR A1653 5.426 -4.219 7.422 1.00 0.00 H new ATOM 0 HA TYR A1653 2.914 -4.004 5.996 1.00 0.00 H new ATOM 0 HB2 TYR A1653 3.624 -4.712 8.839 1.00 0.00 H new ATOM 0 HB3 TYR A1653 1.975 -4.373 8.349 1.00 0.00 H new ATOM 0 HD1 TYR A1653 0.873 -5.816 6.643 1.00 0.00 H new ATOM 0 HD2 TYR A1653 4.669 -6.823 8.273 1.00 0.00 H new ATOM 0 HE1 TYR A1653 0.600 -8.108 5.836 1.00 0.00 H new ATOM 0 HE2 TYR A1653 4.407 -9.119 7.445 1.00 0.00 H new ATOM 0 HH TYR A1653 3.131 -10.556 6.351 1.00 0.00 H new ATOM 1935 N PHE A1654 2.430 -1.704 6.463 1.00 0.00 N ATOM 1936 CA PHE A1654 2.006 -0.352 6.682 1.00 0.00 C ATOM 1937 C PHE A1654 0.514 -0.329 6.876 1.00 0.00 C ATOM 1938 O PHE A1654 -0.201 -1.174 6.305 1.00 0.00 O ATOM 1939 CB PHE A1654 2.361 0.533 5.483 1.00 0.00 C ATOM 1940 CG PHE A1654 3.821 0.611 5.202 1.00 0.00 C ATOM 1941 CD1 PHE A1654 4.697 1.061 6.163 1.00 0.00 C ATOM 1942 CD2 PHE A1654 4.316 0.249 3.975 1.00 0.00 C ATOM 1943 CE1 PHE A1654 6.039 1.143 5.903 1.00 0.00 C ATOM 1944 CE2 PHE A1654 5.661 0.331 3.712 1.00 0.00 C ATOM 1945 CZ PHE A1654 6.521 0.777 4.676 1.00 0.00 C ATOM 0 H PHE A1654 2.086 -2.108 5.592 1.00 0.00 H new ATOM 0 HA PHE A1654 2.515 0.032 7.566 1.00 0.00 H new ATOM 0 HB2 PHE A1654 1.851 0.152 4.599 1.00 0.00 H new ATOM 0 HB3 PHE A1654 1.981 1.539 5.661 1.00 0.00 H new ATOM 0 HD1 PHE A1654 4.322 1.353 7.133 1.00 0.00 H new ATOM 0 HD2 PHE A1654 3.642 -0.104 3.209 1.00 0.00 H new ATOM 0 HE1 PHE A1654 6.717 1.496 6.666 1.00 0.00 H new ATOM 0 HE2 PHE A1654 6.040 0.043 2.743 1.00 0.00 H new ATOM 0 HZ PHE A1654 7.579 0.840 4.470 1.00 0.00 H new ATOM 1955 N SER A1655 0.028 0.588 7.664 1.00 0.00 N ATOM 1956 CA SER A1655 -1.363 0.725 7.818 1.00 0.00 C ATOM 1957 C SER A1655 -1.774 2.111 7.372 1.00 0.00 C ATOM 1958 O SER A1655 -1.178 3.125 7.779 1.00 0.00 O ATOM 1959 CB SER A1655 -1.805 0.345 9.231 1.00 0.00 C ATOM 1960 OG SER A1655 -0.952 0.873 10.208 1.00 0.00 O ATOM 0 H SER A1655 0.590 1.246 8.204 1.00 0.00 H new ATOM 0 HA SER A1655 -1.892 0.021 7.176 1.00 0.00 H new ATOM 0 HB2 SER A1655 -2.819 0.705 9.403 1.00 0.00 H new ATOM 0 HB3 SER A1655 -1.833 -0.741 9.322 1.00 0.00 H new ATOM 0 HG SER A1655 -1.270 0.609 11.097 1.00 0.00 H new ATOM 1966 N TRP A1656 -2.721 2.146 6.495 1.00 0.00 N ATOM 1967 CA TRP A1656 -3.137 3.342 5.847 1.00 0.00 C ATOM 1968 C TRP A1656 -4.612 3.524 6.100 1.00 0.00 C ATOM 1969 O TRP A1656 -5.407 2.672 5.754 1.00 0.00 O ATOM 1970 CB TRP A1656 -2.892 3.139 4.354 1.00 0.00 C ATOM 1971 CG TRP A1656 -3.035 4.340 3.474 1.00 0.00 C ATOM 1972 CD1 TRP A1656 -4.152 5.081 3.240 1.00 0.00 C ATOM 1973 CD2 TRP A1656 -2.015 4.886 2.648 1.00 0.00 C ATOM 1974 NE1 TRP A1656 -3.879 6.061 2.322 1.00 0.00 N ATOM 1975 CE2 TRP A1656 -2.570 5.966 1.956 1.00 0.00 C ATOM 1976 CE3 TRP A1656 -0.680 4.569 2.439 1.00 0.00 C ATOM 1977 CZ2 TRP A1656 -1.835 6.728 1.067 1.00 0.00 C ATOM 1978 CZ3 TRP A1656 0.046 5.326 1.559 1.00 0.00 C ATOM 1979 CH2 TRP A1656 -0.532 6.394 0.885 1.00 0.00 C ATOM 0 H TRP A1656 -3.241 1.319 6.202 1.00 0.00 H new ATOM 0 HA TRP A1656 -2.598 4.217 6.211 1.00 0.00 H new ATOM 0 HB2 TRP A1656 -1.884 2.743 4.227 1.00 0.00 H new ATOM 0 HB3 TRP A1656 -3.582 2.374 3.998 1.00 0.00 H new ATOM 0 HD1 TRP A1656 -5.112 4.920 3.709 1.00 0.00 H new ATOM 0 HE1 TRP A1656 -4.546 6.748 1.971 1.00 0.00 H new ATOM 0 HE3 TRP A1656 -0.223 3.741 2.960 1.00 0.00 H new ATOM 0 HZ2 TRP A1656 -2.280 7.557 0.538 1.00 0.00 H new ATOM 0 HZ3 TRP A1656 1.085 5.089 1.386 1.00 0.00 H new ATOM 0 HH2 TRP A1656 0.070 6.973 0.200 1.00 0.00 H new ATOM 1990 N HIS A1657 -4.972 4.586 6.729 1.00 0.00 N ATOM 1991 CA HIS A1657 -6.361 4.860 6.967 1.00 0.00 C ATOM 1992 C HIS A1657 -6.891 5.727 5.856 1.00 0.00 C ATOM 1993 O HIS A1657 -6.602 6.903 5.788 1.00 0.00 O ATOM 1994 CB HIS A1657 -6.585 5.523 8.334 1.00 0.00 C ATOM 1995 CG HIS A1657 -6.389 4.603 9.516 1.00 0.00 C ATOM 1996 ND1 HIS A1657 -7.069 4.744 10.695 1.00 0.00 N ATOM 1997 CD2 HIS A1657 -5.569 3.537 9.698 1.00 0.00 C ATOM 1998 CE1 HIS A1657 -6.686 3.820 11.542 1.00 0.00 C ATOM 1999 NE2 HIS A1657 -5.777 3.073 10.963 1.00 0.00 N ATOM 0 H HIS A1657 -4.327 5.288 7.093 1.00 0.00 H new ATOM 0 HA HIS A1657 -6.904 3.915 6.983 1.00 0.00 H new ATOM 0 HB2 HIS A1657 -5.903 6.368 8.430 1.00 0.00 H new ATOM 0 HB3 HIS A1657 -7.597 5.926 8.367 1.00 0.00 H new ATOM 0 HD2 HIS A1657 -4.878 3.131 8.974 1.00 0.00 H new ATOM 0 HE1 HIS A1657 -7.057 3.695 12.549 1.00 0.00 H new ATOM 0 HE2 HIS A1657 -5.304 2.276 11.389 1.00 0.00 H new ATOM 2008 N THR A1658 -7.641 5.141 4.981 1.00 0.00 N ATOM 2009 CA THR A1658 -8.174 5.846 3.877 1.00 0.00 C ATOM 2010 C THR A1658 -9.700 5.639 3.808 1.00 0.00 C ATOM 2011 O THR A1658 -10.209 4.548 4.042 1.00 0.00 O ATOM 2012 CB THR A1658 -7.470 5.468 2.526 1.00 0.00 C ATOM 2013 OG1 THR A1658 -8.004 6.231 1.460 1.00 0.00 O ATOM 2014 CG2 THR A1658 -7.641 4.015 2.213 1.00 0.00 C ATOM 0 H THR A1658 -7.899 4.155 5.018 1.00 0.00 H new ATOM 0 HA THR A1658 -7.974 6.907 4.029 1.00 0.00 H new ATOM 0 HB THR A1658 -6.408 5.684 2.641 1.00 0.00 H new ATOM 0 HG1 THR A1658 -7.656 7.146 1.506 1.00 0.00 H new ATOM 0 HG21 THR A1658 -7.142 3.784 1.272 1.00 0.00 H new ATOM 0 HG22 THR A1658 -7.203 3.417 3.012 1.00 0.00 H new ATOM 0 HG23 THR A1658 -8.703 3.784 2.127 1.00 0.00 H new ATOM 2022 N PRO A1659 -10.450 6.708 3.542 1.00 0.00 N ATOM 2023 CA PRO A1659 -11.926 6.674 3.403 1.00 0.00 C ATOM 2024 C PRO A1659 -12.319 5.964 2.150 1.00 0.00 C ATOM 2025 O PRO A1659 -13.450 5.529 1.967 1.00 0.00 O ATOM 2026 CB PRO A1659 -12.273 8.143 3.239 1.00 0.00 C ATOM 2027 CG PRO A1659 -11.097 8.865 3.746 1.00 0.00 C ATOM 2028 CD PRO A1659 -9.943 8.050 3.369 1.00 0.00 C ATOM 0 HA PRO A1659 -12.417 6.172 4.236 1.00 0.00 H new ATOM 0 HB2 PRO A1659 -12.469 8.389 2.195 1.00 0.00 H new ATOM 0 HB3 PRO A1659 -13.170 8.403 3.801 1.00 0.00 H new ATOM 0 HG2 PRO A1659 -11.032 9.862 3.311 1.00 0.00 H new ATOM 0 HG3 PRO A1659 -11.151 8.992 4.827 1.00 0.00 H new ATOM 0 HD2 PRO A1659 -9.629 8.238 2.342 1.00 0.00 H new ATOM 0 HD3 PRO A1659 -9.081 8.245 4.006 1.00 0.00 H new ATOM 2036 N LEU A1660 -11.353 5.820 1.315 1.00 0.00 N ATOM 2037 CA LEU A1660 -11.456 5.284 0.077 1.00 0.00 C ATOM 2038 C LEU A1660 -11.510 3.741 0.258 1.00 0.00 C ATOM 2039 O LEU A1660 -12.072 3.021 -0.563 1.00 0.00 O ATOM 2040 CB LEU A1660 -10.180 5.838 -0.536 1.00 0.00 C ATOM 2041 CG LEU A1660 -9.798 5.591 -1.925 1.00 0.00 C ATOM 2042 CD1 LEU A1660 -8.467 6.295 -2.143 1.00 0.00 C ATOM 2043 CD2 LEU A1660 -9.643 4.161 -2.084 1.00 0.00 C ATOM 0 H LEU A1660 -10.401 6.112 1.536 1.00 0.00 H new ATOM 0 HA LEU A1660 -12.324 5.513 -0.542 1.00 0.00 H new ATOM 0 HB2 LEU A1660 -10.221 6.920 -0.413 1.00 0.00 H new ATOM 0 HB3 LEU A1660 -9.357 5.478 0.081 1.00 0.00 H new ATOM 0 HG LEU A1660 -10.536 5.956 -2.639 1.00 0.00 H new ATOM 0 HD11 LEU A1660 -8.137 6.140 -3.170 1.00 0.00 H new ATOM 0 HD12 LEU A1660 -8.585 7.363 -1.957 1.00 0.00 H new ATOM 0 HD13 LEU A1660 -7.723 5.888 -1.458 1.00 0.00 H new ATOM 0 HD21 LEU A1660 -9.357 3.938 -3.112 1.00 0.00 H new ATOM 0 HD22 LEU A1660 -8.869 3.801 -1.406 1.00 0.00 H new ATOM 0 HD23 LEU A1660 -10.586 3.665 -1.854 1.00 0.00 H new ATOM 2055 N ALA A1661 -10.978 3.274 1.387 1.00 0.00 N ATOM 2056 CA ALA A1661 -10.985 1.877 1.743 1.00 0.00 C ATOM 2057 C ALA A1661 -12.286 1.543 2.376 1.00 0.00 C ATOM 2058 O ALA A1661 -12.584 0.391 2.663 1.00 0.00 O ATOM 2059 CB ALA A1661 -9.908 1.618 2.749 1.00 0.00 C ATOM 0 H ALA A1661 -10.528 3.871 2.080 1.00 0.00 H new ATOM 0 HA ALA A1661 -10.826 1.277 0.847 1.00 0.00 H new ATOM 0 HB1 ALA A1661 -9.910 0.562 3.021 1.00 0.00 H new ATOM 0 HB2 ALA A1661 -8.940 1.881 2.322 1.00 0.00 H new ATOM 0 HB3 ALA A1661 -10.088 2.222 3.638 1.00 0.00 H new ATOM 2065 N CYS A1662 -13.048 2.547 2.600 1.00 0.00 N ATOM 2066 CA CYS A1662 -14.257 2.393 3.281 1.00 0.00 C ATOM 2067 C CYS A1662 -15.361 2.222 2.293 1.00 0.00 C ATOM 2068 O CYS A1662 -15.397 2.895 1.249 1.00 0.00 O ATOM 2069 CB CYS A1662 -14.513 3.597 4.138 1.00 0.00 C ATOM 2070 SG CYS A1662 -15.589 3.253 5.547 1.00 0.00 S ATOM 0 H CYS A1662 -12.840 3.503 2.310 1.00 0.00 H new ATOM 0 HA CYS A1662 -14.207 1.511 3.920 1.00 0.00 H new ATOM 0 HB2 CYS A1662 -13.561 3.985 4.502 1.00 0.00 H new ATOM 0 HB3 CYS A1662 -14.964 4.380 3.528 1.00 0.00 H new ATOM 2075 N GLU A1663 -16.239 1.326 2.578 1.00 0.00 N ATOM 2076 CA GLU A1663 -17.341 1.121 1.730 1.00 0.00 C ATOM 2077 C GLU A1663 -18.430 2.041 2.168 1.00 0.00 C ATOM 2078 O GLU A1663 -18.943 1.965 3.293 1.00 0.00 O ATOM 2079 CB GLU A1663 -17.815 -0.276 1.785 1.00 0.00 C ATOM 2080 CG GLU A1663 -18.859 -0.620 0.752 1.00 0.00 C ATOM 2081 CD GLU A1663 -19.201 -2.065 0.779 1.00 0.00 C ATOM 2082 OE1 GLU A1663 -19.791 -2.544 1.778 1.00 0.00 O ATOM 2083 OE2 GLU A1663 -18.892 -2.747 -0.189 1.00 0.00 O1- ATOM 0 H GLU A1663 -16.208 0.723 3.400 1.00 0.00 H new ATOM 0 HA GLU A1663 -17.046 1.323 0.700 1.00 0.00 H new ATOM 0 HB2 GLU A1663 -16.962 -0.942 1.657 1.00 0.00 H new ATOM 0 HB3 GLU A1663 -18.225 -0.469 2.776 1.00 0.00 H new ATOM 0 HG2 GLU A1663 -19.758 -0.030 0.932 1.00 0.00 H new ATOM 0 HG3 GLU A1663 -18.493 -0.351 -0.239 1.00 0.00 H new ATOM 2090 N LYS A1664 -18.731 2.919 1.308 1.00 0.00 N ATOM 2091 CA LYS A1664 -19.751 3.914 1.527 1.00 0.00 C ATOM 2092 C LYS A1664 -21.116 3.331 1.205 1.00 0.00 C ATOM 2093 O LYS A1664 -22.157 3.888 1.587 1.00 0.00 O ATOM 2094 CB LYS A1664 -19.459 5.153 0.698 1.00 0.00 C ATOM 2095 CG LYS A1664 -18.111 5.792 1.019 1.00 0.00 C ATOM 2096 CD LYS A1664 -17.818 6.973 0.112 1.00 0.00 C ATOM 2097 CE LYS A1664 -17.723 6.540 -1.341 1.00 0.00 C ATOM 2098 NZ LYS A1664 -17.476 7.675 -2.247 1.00 0.00 N1+ ATOM 0 H LYS A1664 -18.277 2.989 0.398 1.00 0.00 H new ATOM 0 HA LYS A1664 -19.752 4.212 2.576 1.00 0.00 H new ATOM 0 HB2 LYS A1664 -19.485 4.888 -0.359 1.00 0.00 H new ATOM 0 HB3 LYS A1664 -20.249 5.886 0.863 1.00 0.00 H new ATOM 0 HG2 LYS A1664 -18.103 6.121 2.058 1.00 0.00 H new ATOM 0 HG3 LYS A1664 -17.321 5.048 0.914 1.00 0.00 H new ATOM 0 HD2 LYS A1664 -18.603 7.722 0.220 1.00 0.00 H new ATOM 0 HD3 LYS A1664 -16.883 7.445 0.415 1.00 0.00 H new ATOM 0 HE2 LYS A1664 -16.920 5.810 -1.449 1.00 0.00 H new ATOM 0 HE3 LYS A1664 -18.648 6.041 -1.631 1.00 0.00 H new ATOM 0 HZ1 LYS A1664 -17.419 7.331 -3.227 1.00 0.00 H new ATOM 0 HZ2 LYS A1664 -18.254 8.360 -2.165 1.00 0.00 H new ATOM 0 HZ3 LYS A1664 -16.580 8.136 -1.989 1.00 0.00 H new ATOM 2112 N GLU A1665 -21.102 2.206 0.511 1.00 0.00 N ATOM 2113 CA GLU A1665 -22.305 1.457 0.248 1.00 0.00 C ATOM 2114 C GLU A1665 -22.726 0.840 1.557 1.00 0.00 C ATOM 2115 O GLU A1665 -21.941 0.143 2.191 1.00 0.00 O ATOM 2116 CB GLU A1665 -22.049 0.352 -0.782 1.00 0.00 C ATOM 2117 CG GLU A1665 -21.621 0.847 -2.149 1.00 0.00 C ATOM 2118 CD GLU A1665 -22.674 1.680 -2.826 1.00 0.00 C ATOM 2119 OE1 GLU A1665 -23.621 1.103 -3.407 1.00 0.00 O ATOM 2120 OE2 GLU A1665 -22.575 2.915 -2.806 1.00 0.00 O1- ATOM 0 H GLU A1665 -20.256 1.792 0.118 1.00 0.00 H new ATOM 0 HA GLU A1665 -23.078 2.110 -0.157 1.00 0.00 H new ATOM 0 HB2 GLU A1665 -21.279 -0.315 -0.395 1.00 0.00 H new ATOM 0 HB3 GLU A1665 -22.958 -0.240 -0.893 1.00 0.00 H new ATOM 0 HG2 GLU A1665 -20.709 1.435 -2.048 1.00 0.00 H new ATOM 0 HG3 GLU A1665 -21.380 -0.008 -2.780 1.00 0.00 H new ATOM 2127 N GLU A1666 -23.907 1.128 1.986 1.00 0.00 N ATOM 2128 CA GLU A1666 -24.362 0.627 3.248 1.00 0.00 C ATOM 2129 C GLU A1666 -24.711 -0.851 3.183 1.00 0.00 C ATOM 2130 O GLU A1666 -25.287 -1.329 2.193 1.00 0.00 O ATOM 2131 CB GLU A1666 -25.458 1.501 3.829 1.00 0.00 C ATOM 2132 CG GLU A1666 -24.944 2.891 4.166 1.00 0.00 C ATOM 2133 CD GLU A1666 -25.971 3.768 4.803 1.00 0.00 C ATOM 2134 OE1 GLU A1666 -26.727 4.413 4.080 1.00 0.00 O ATOM 2135 OE2 GLU A1666 -26.023 3.840 6.056 1.00 0.00 O1- ATOM 0 H GLU A1666 -24.580 1.708 1.485 1.00 0.00 H new ATOM 0 HA GLU A1666 -23.534 0.688 3.954 1.00 0.00 H new ATOM 0 HB2 GLU A1666 -26.279 1.579 3.116 1.00 0.00 H new ATOM 0 HB3 GLU A1666 -25.860 1.033 4.728 1.00 0.00 H new ATOM 0 HG2 GLU A1666 -24.089 2.801 4.836 1.00 0.00 H new ATOM 0 HG3 GLU A1666 -24.586 3.368 3.254 1.00 0.00 H new ATOM 2142 N PRO A1667 -24.313 -1.594 4.222 1.00 0.00 N ATOM 2143 CA PRO A1667 -24.453 -3.047 4.290 1.00 0.00 C ATOM 2144 C PRO A1667 -25.882 -3.568 4.200 1.00 0.00 C ATOM 2145 O PRO A1667 -26.858 -2.792 4.216 1.00 0.00 O ATOM 2146 CB PRO A1667 -23.849 -3.399 5.649 1.00 0.00 C ATOM 2147 CG PRO A1667 -23.932 -2.160 6.415 1.00 0.00 C ATOM 2148 CD PRO A1667 -23.677 -1.074 5.436 1.00 0.00 C ATOM 0 HA PRO A1667 -23.964 -3.509 3.432 1.00 0.00 H new ATOM 0 HB2 PRO A1667 -24.402 -4.203 6.133 1.00 0.00 H new ATOM 0 HB3 PRO A1667 -22.817 -3.737 5.550 1.00 0.00 H new ATOM 0 HG2 PRO A1667 -24.912 -2.049 6.878 1.00 0.00 H new ATOM 0 HG3 PRO A1667 -23.196 -2.145 7.219 1.00 0.00 H new ATOM 0 HD2 PRO A1667 -24.117 -0.129 5.753 1.00 0.00 H new ATOM 0 HD3 PRO A1667 -22.611 -0.897 5.293 1.00 0.00 H new ATOM 2156 N ARG A1668 -25.986 -4.896 4.117 1.00 0.00 N ATOM 2157 CA ARG A1668 -27.261 -5.603 4.050 1.00 0.00 C ATOM 2158 C ARG A1668 -28.135 -5.264 5.242 1.00 0.00 C ATOM 2159 O ARG A1668 -29.360 -5.181 5.127 1.00 0.00 O ATOM 2160 CB ARG A1668 -27.044 -7.123 3.903 1.00 0.00 C ATOM 2161 CG ARG A1668 -26.069 -7.738 4.900 1.00 0.00 C ATOM 2162 CD ARG A1668 -25.841 -9.202 4.595 1.00 0.00 C ATOM 2163 NE ARG A1668 -24.757 -9.791 5.399 1.00 0.00 N ATOM 2164 CZ ARG A1668 -24.181 -10.978 5.139 1.00 0.00 C ATOM 2165 NH1 ARG A1668 -24.697 -11.787 4.213 1.00 0.00 N1+ ATOM 2166 NH2 ARG A1668 -23.130 -11.376 5.848 1.00 0.00 N ATOM 0 H ARG A1668 -25.176 -5.516 4.094 1.00 0.00 H new ATOM 0 HA ARG A1668 -27.791 -5.267 3.159 1.00 0.00 H new ATOM 0 HB2 ARG A1668 -28.007 -7.623 4.005 1.00 0.00 H new ATOM 0 HB3 ARG A1668 -26.684 -7.327 2.894 1.00 0.00 H new ATOM 0 HG2 ARG A1668 -25.120 -7.203 4.865 1.00 0.00 H new ATOM 0 HG3 ARG A1668 -26.459 -7.629 5.912 1.00 0.00 H new ATOM 0 HD2 ARG A1668 -26.763 -9.754 4.777 1.00 0.00 H new ATOM 0 HD3 ARG A1668 -25.605 -9.315 3.537 1.00 0.00 H new ATOM 0 HE ARG A1668 -24.421 -9.264 6.205 1.00 0.00 H new ATOM 0 HH11 ARG A1668 -25.532 -11.506 3.699 1.00 0.00 H new ATOM 0 HH12 ARG A1668 -24.257 -12.686 4.019 1.00 0.00 H new ATOM 0 HH21 ARG A1668 -22.760 -10.781 6.589 1.00 0.00 H new ATOM 0 HH22 ARG A1668 -22.693 -12.276 5.651 1.00 0.00 H new ATOM 2180 N HIS A1669 -27.509 -5.063 6.373 1.00 0.00 N ATOM 2181 CA HIS A1669 -28.190 -4.583 7.531 1.00 0.00 C ATOM 2182 C HIS A1669 -27.452 -3.362 8.032 1.00 0.00 C ATOM 2183 O HIS A1669 -26.520 -3.463 8.815 1.00 0.00 O ATOM 2184 CB HIS A1669 -28.324 -5.667 8.621 1.00 0.00 C ATOM 2185 CG HIS A1669 -29.069 -5.220 9.857 1.00 0.00 C ATOM 2186 ND1 HIS A1669 -30.424 -5.366 10.022 1.00 0.00 N ATOM 2187 CD2 HIS A1669 -28.627 -4.639 10.991 1.00 0.00 C ATOM 2188 CE1 HIS A1669 -30.775 -4.895 11.191 1.00 0.00 C ATOM 2189 NE2 HIS A1669 -29.703 -4.447 11.802 1.00 0.00 N ATOM 0 H HIS A1669 -26.512 -5.230 6.509 1.00 0.00 H new ATOM 0 HA HIS A1669 -29.213 -4.314 7.268 1.00 0.00 H new ATOM 0 HB2 HIS A1669 -28.835 -6.531 8.196 1.00 0.00 H new ATOM 0 HB3 HIS A1669 -27.327 -5.998 8.912 1.00 0.00 H new ATOM 0 HD2 HIS A1669 -27.604 -4.374 11.215 1.00 0.00 H new ATOM 0 HE1 HIS A1669 -31.779 -4.878 11.587 1.00 0.00 H new ATOM 0 HE2 HIS A1669 -29.680 -4.025 12.730 1.00 0.00 H new ATOM 2198 N HIS A1670 -27.818 -2.237 7.508 1.00 0.00 N ATOM 2199 CA HIS A1670 -27.208 -0.983 7.874 1.00 0.00 C ATOM 2200 C HIS A1670 -27.999 -0.344 8.989 1.00 0.00 C ATOM 2201 O HIS A1670 -27.497 -0.257 10.110 1.00 0.00 O ATOM 2202 CB HIS A1670 -27.038 -0.030 6.658 1.00 0.00 C ATOM 2203 CG HIS A1670 -28.297 0.323 5.904 1.00 0.00 C ATOM 2204 ND1 HIS A1670 -28.950 1.520 6.043 1.00 0.00 N ATOM 2205 CD2 HIS A1670 -28.996 -0.371 4.978 1.00 0.00 C ATOM 2206 CE1 HIS A1670 -29.991 1.548 5.248 1.00 0.00 C ATOM 2207 NE2 HIS A1670 -30.040 0.414 4.591 1.00 0.00 N ATOM 0 H HIS A1670 -28.554 -2.153 6.807 1.00 0.00 H new ATOM 0 HA HIS A1670 -26.198 -1.184 8.232 1.00 0.00 H new ATOM 0 HB2 HIS A1670 -26.579 0.894 7.009 1.00 0.00 H new ATOM 0 HB3 HIS A1670 -26.338 -0.488 5.959 1.00 0.00 H new ATOM 0 HD2 HIS A1670 -28.769 -1.362 4.613 1.00 0.00 H new ATOM 0 HE1 HIS A1670 -30.690 2.366 5.150 1.00 0.00 H new ATOM 0 HE2 HIS A1670 -30.747 0.160 3.901 1.00 0.00 H new TER 2216 HIS A1670