USER MOD reduce.3.24.130724 H: found=0, std=0, add=599, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 0 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 Single : A 1 GLY N :NH3+ -117:sc= -0.0368 (180deg=-1.49!) USER MOD Single : A 6 ASN : amide:sc= -0.278 K(o=-0.28,f=-2.1!) USER MOD Single : A 9 THR OG1 : rot 145:sc= 0.775 USER MOD Single : A 13 ASN : amide:sc= -0.198 K(o=-0.2,f=-0.74) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 20 THR OG1 : rot -55:sc= 0.971 USER MOD Single : A 21 THR OG1 : rot 180:sc= -1.17! USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 TYR OH : rot 180:sc= -0.695 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 36 ASN : amide:sc= -0.938 X(o=-0.94,f=-1.3) USER MOD Single : A 37 LYS NZ :NH3+ -143:sc= 0.088 (180deg=0) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 156:sc= -1.83! (180deg=-1.84!) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 GLN : amide:sc= -0.996 K(o=-1,f=-7.4!) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 ASN : amide:sc= -0.666 X(o=-0.67,f=-1.1) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 HIS : no HD1:sc= -2.65! C(o=-2.6!,f=-1.8!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 8.479 -0.034 2.106 1.00 0.00 N ATOM 2 CA GLY A 1 9.852 -0.488 1.975 1.00 0.00 C ATOM 3 C GLY A 1 9.909 -1.918 1.433 1.00 0.00 C ATOM 4 O GLY A 1 9.571 -2.159 0.276 1.00 0.00 O ATOM 0 H1 GLY A 1 8.320 0.777 1.475 1.00 0.00 H new ATOM 0 H2 GLY A 1 7.832 -0.806 1.848 1.00 0.00 H new ATOM 0 H3 GLY A 1 8.301 0.253 3.090 1.00 0.00 H new ATOM 0 HA2 GLY A 1 10.397 0.179 1.307 1.00 0.00 H new ATOM 0 HA3 GLY A 1 10.347 -0.443 2.945 1.00 0.00 H new ATOM 5 N GLU A 2 10.339 -2.827 2.295 1.00 0.00 N ATOM 6 CA GLU A 2 10.444 -4.226 1.916 1.00 0.00 C ATOM 7 C GLU A 2 9.255 -4.630 1.042 1.00 0.00 C ATOM 8 O GLU A 2 9.394 -4.777 -0.171 1.00 0.00 O ATOM 9 CB GLU A 2 10.544 -5.122 3.153 1.00 0.00 C ATOM 10 CG GLU A 2 12.004 -5.321 3.568 1.00 0.00 C ATOM 11 CD GLU A 2 12.100 -6.142 4.855 1.00 0.00 C ATOM 12 OE1 GLU A 2 11.205 -5.966 5.710 1.00 0.00 O ATOM 13 OE2 GLU A 2 13.067 -6.928 4.956 1.00 0.00 O ATOM 0 H GLU A 2 10.619 -2.623 3.254 1.00 0.00 H new ATOM 0 HA GLU A 2 11.357 -4.358 1.336 1.00 0.00 H new ATOM 0 HB2 GLU A 2 9.986 -4.676 3.976 1.00 0.00 H new ATOM 0 HB3 GLU A 2 10.086 -6.089 2.944 1.00 0.00 H new ATOM 0 HG2 GLU A 2 12.548 -5.825 2.769 1.00 0.00 H new ATOM 0 HG3 GLU A 2 12.480 -4.351 3.714 1.00 0.00 H new ATOM 14 N ILE A 3 8.113 -4.798 1.693 1.00 0.00 N ATOM 15 CA ILE A 3 6.901 -5.183 0.990 1.00 0.00 C ATOM 16 C ILE A 3 6.873 -4.500 -0.379 1.00 0.00 C ATOM 17 O ILE A 3 6.386 -5.074 -1.353 1.00 0.00 O ATOM 18 CB ILE A 3 5.668 -4.891 1.848 1.00 0.00 C ATOM 19 CG1 ILE A 3 5.641 -5.784 3.090 1.00 0.00 C ATOM 20 CG2 ILE A 3 4.385 -5.014 1.024 1.00 0.00 C ATOM 21 CD1 ILE A 3 5.116 -7.180 2.750 1.00 0.00 C ATOM 0 H ILE A 3 8.002 -4.675 2.699 1.00 0.00 H new ATOM 0 HA ILE A 3 6.889 -6.258 0.811 1.00 0.00 H new ATOM 0 HB ILE A 3 5.729 -3.859 2.195 1.00 0.00 H new ATOM 0 HG12 ILE A 3 6.644 -5.861 3.509 1.00 0.00 H new ATOM 0 HG13 ILE A 3 5.010 -5.331 3.855 1.00 0.00 H new ATOM 0 HG21 ILE A 3 3.524 -4.802 1.658 1.00 0.00 H new ATOM 0 HG22 ILE A 3 4.413 -4.302 0.199 1.00 0.00 H new ATOM 0 HG23 ILE A 3 4.303 -6.026 0.628 1.00 0.00 H new ATOM 0 HD11 ILE A 3 5.107 -7.795 3.650 1.00 0.00 H new ATOM 0 HD12 ILE A 3 4.103 -7.101 2.354 1.00 0.00 H new ATOM 0 HD13 ILE A 3 5.763 -7.640 2.003 1.00 0.00 H new ATOM 22 N LEU A 4 7.400 -3.286 -0.411 1.00 0.00 N ATOM 23 CA LEU A 4 7.441 -2.519 -1.644 1.00 0.00 C ATOM 24 C LEU A 4 8.266 -3.279 -2.684 1.00 0.00 C ATOM 25 O LEU A 4 7.741 -3.692 -3.717 1.00 0.00 O ATOM 26 CB LEU A 4 7.947 -1.099 -1.376 1.00 0.00 C ATOM 27 CG LEU A 4 7.305 0.010 -2.213 1.00 0.00 C ATOM 28 CD1 LEU A 4 6.555 1.002 -1.323 1.00 0.00 C ATOM 29 CD2 LEU A 4 8.346 0.702 -3.095 1.00 0.00 C ATOM 0 H LEU A 4 7.803 -2.814 0.398 1.00 0.00 H new ATOM 0 HA LEU A 4 6.438 -2.403 -2.054 1.00 0.00 H new ATOM 0 HB2 LEU A 4 7.788 -0.870 -0.322 1.00 0.00 H new ATOM 0 HB3 LEU A 4 9.023 -1.080 -1.547 1.00 0.00 H new ATOM 0 HG LEU A 4 6.571 -0.444 -2.879 1.00 0.00 H new ATOM 0 HD11 LEU A 4 6.108 1.780 -1.942 1.00 0.00 H new ATOM 0 HD12 LEU A 4 5.771 0.479 -0.775 1.00 0.00 H new ATOM 0 HD13 LEU A 4 7.251 1.455 -0.617 1.00 0.00 H new ATOM 0 HD21 LEU A 4 7.864 1.486 -3.680 1.00 0.00 H new ATOM 0 HD22 LEU A 4 9.121 1.142 -2.467 1.00 0.00 H new ATOM 0 HD23 LEU A 4 8.796 -0.028 -3.768 1.00 0.00 H new ATOM 30 N CYS A 5 9.545 -3.441 -2.376 1.00 0.00 N ATOM 31 CA CYS A 5 10.447 -4.144 -3.272 1.00 0.00 C ATOM 32 C CYS A 5 11.697 -4.537 -2.483 1.00 0.00 C ATOM 33 O CYS A 5 12.217 -5.640 -2.645 1.00 0.00 O ATOM 34 CB CYS A 5 10.790 -3.304 -4.504 1.00 0.00 C ATOM 35 SG CYS A 5 10.261 -4.030 -6.099 1.00 0.00 S ATOM 0 H CYS A 5 9.978 -3.097 -1.519 1.00 0.00 H new ATOM 0 HA CYS A 5 9.960 -5.042 -3.651 1.00 0.00 H new ATOM 0 HB2 CYS A 5 10.329 -2.322 -4.397 1.00 0.00 H new ATOM 0 HB3 CYS A 5 11.868 -3.148 -4.532 1.00 0.00 H new ATOM 36 N ASN A 6 12.145 -3.613 -1.645 1.00 0.00 N ATOM 37 CA ASN A 6 13.324 -3.849 -0.831 1.00 0.00 C ATOM 38 C ASN A 6 13.348 -5.313 -0.387 1.00 0.00 C ATOM 39 O ASN A 6 14.417 -5.906 -0.248 1.00 0.00 O ATOM 40 CB ASN A 6 13.311 -2.974 0.425 1.00 0.00 C ATOM 41 CG ASN A 6 14.605 -2.167 0.546 1.00 0.00 C ATOM 42 OD1 ASN A 6 15.599 -2.441 -0.105 1.00 0.00 O ATOM 43 ND2 ASN A 6 14.535 -1.160 1.411 1.00 0.00 N ATOM 0 H ASN A 6 11.712 -2.699 -1.513 1.00 0.00 H new ATOM 0 HA ASN A 6 14.201 -3.606 -1.431 1.00 0.00 H new ATOM 0 HB2 ASN A 6 12.458 -2.296 0.391 1.00 0.00 H new ATOM 0 HB3 ASN A 6 13.186 -3.601 1.308 1.00 0.00 H new ATOM 0 HD21 ASN A 6 15.346 -0.560 1.562 1.00 0.00 H new ATOM 0 HD22 ASN A 6 13.670 -0.987 1.923 1.00 0.00 H new ATOM 44 N LEU A 7 12.156 -5.854 -0.176 1.00 0.00 N ATOM 45 CA LEU A 7 12.027 -7.236 0.250 1.00 0.00 C ATOM 46 C LEU A 7 12.848 -8.131 -0.682 1.00 0.00 C ATOM 47 O LEU A 7 13.908 -8.625 -0.300 1.00 0.00 O ATOM 48 CB LEU A 7 10.552 -7.634 0.341 1.00 0.00 C ATOM 49 CG LEU A 7 10.253 -8.941 1.076 1.00 0.00 C ATOM 50 CD1 LEU A 7 10.613 -10.151 0.213 1.00 0.00 C ATOM 51 CD2 LEU A 7 10.956 -8.978 2.435 1.00 0.00 C ATOM 0 H LEU A 7 11.272 -5.359 -0.292 1.00 0.00 H new ATOM 0 HA LEU A 7 12.431 -7.364 1.254 1.00 0.00 H new ATOM 0 HB2 LEU A 7 10.009 -6.829 0.837 1.00 0.00 H new ATOM 0 HB3 LEU A 7 10.154 -7.710 -0.671 1.00 0.00 H new ATOM 0 HG LEU A 7 9.181 -8.988 1.265 1.00 0.00 H new ATOM 0 HD11 LEU A 7 10.390 -11.067 0.760 1.00 0.00 H new ATOM 0 HD12 LEU A 7 10.030 -10.127 -0.708 1.00 0.00 H new ATOM 0 HD13 LEU A 7 11.675 -10.122 -0.029 1.00 0.00 H new ATOM 0 HD21 LEU A 7 10.727 -9.918 2.938 1.00 0.00 H new ATOM 0 HD22 LEU A 7 12.033 -8.897 2.290 1.00 0.00 H new ATOM 0 HD23 LEU A 7 10.609 -8.145 3.047 1.00 0.00 H new ATOM 52 N CYS A 8 12.327 -8.312 -1.887 1.00 0.00 N ATOM 53 CA CYS A 8 12.998 -9.138 -2.876 1.00 0.00 C ATOM 54 C CYS A 8 13.980 -8.257 -3.651 1.00 0.00 C ATOM 55 O CYS A 8 15.193 -8.387 -3.494 1.00 0.00 O ATOM 56 CB CYS A 8 12.000 -9.834 -3.803 1.00 0.00 C ATOM 57 SG CYS A 8 12.487 -9.871 -5.567 1.00 0.00 S ATOM 0 H CYS A 8 11.448 -7.901 -2.201 1.00 0.00 H new ATOM 0 HA CYS A 8 13.546 -9.937 -2.376 1.00 0.00 H new ATOM 0 HB2 CYS A 8 11.859 -10.858 -3.458 1.00 0.00 H new ATOM 0 HB3 CYS A 8 11.036 -9.333 -3.717 1.00 0.00 H new ATOM 58 N THR A 9 13.418 -7.382 -4.472 1.00 0.00 N ATOM 59 CA THR A 9 14.229 -6.479 -5.272 1.00 0.00 C ATOM 60 C THR A 9 15.434 -5.989 -4.467 1.00 0.00 C ATOM 61 O THR A 9 16.483 -5.688 -5.034 1.00 0.00 O ATOM 62 CB THR A 9 13.328 -5.347 -5.767 1.00 0.00 C ATOM 63 OG1 THR A 9 12.637 -5.914 -6.877 1.00 0.00 O ATOM 64 CG2 THR A 9 14.121 -4.188 -6.373 1.00 0.00 C ATOM 0 H THR A 9 12.411 -7.279 -4.601 1.00 0.00 H new ATOM 0 HA THR A 9 14.644 -6.987 -6.142 1.00 0.00 H new ATOM 0 HB THR A 9 12.723 -4.977 -4.939 1.00 0.00 H new ATOM 0 HG1 THR A 9 11.724 -5.559 -6.910 1.00 0.00 H new ATOM 0 HG21 THR A 9 13.433 -3.412 -6.708 1.00 0.00 H new ATOM 0 HG22 THR A 9 14.794 -3.776 -5.622 1.00 0.00 H new ATOM 0 HG23 THR A 9 14.702 -4.549 -7.222 1.00 0.00 H new ATOM 65 N GLY A 10 15.244 -5.924 -3.157 1.00 0.00 N ATOM 66 CA GLY A 10 16.301 -5.476 -2.269 1.00 0.00 C ATOM 67 C GLY A 10 17.348 -6.572 -2.065 1.00 0.00 C ATOM 68 O GLY A 10 18.548 -6.306 -2.105 1.00 0.00 O ATOM 0 H GLY A 10 14.373 -6.175 -2.690 1.00 0.00 H new ATOM 0 HA2 GLY A 10 16.776 -4.587 -2.683 1.00 0.00 H new ATOM 0 HA3 GLY A 10 15.876 -5.191 -1.307 1.00 0.00 H new ATOM 69 N LEU A 11 16.856 -7.784 -1.849 1.00 0.00 N ATOM 70 CA LEU A 11 17.732 -8.922 -1.638 1.00 0.00 C ATOM 71 C LEU A 11 18.415 -9.287 -2.959 1.00 0.00 C ATOM 72 O LEU A 11 19.555 -9.748 -2.966 1.00 0.00 O ATOM 73 CB LEU A 11 16.963 -10.082 -1.004 1.00 0.00 C ATOM 74 CG LEU A 11 16.482 -11.172 -1.964 1.00 0.00 C ATOM 75 CD1 LEU A 11 17.654 -11.782 -2.733 1.00 0.00 C ATOM 76 CD2 LEU A 11 15.667 -12.235 -1.222 1.00 0.00 C ATOM 0 H LEU A 11 15.860 -8.001 -1.816 1.00 0.00 H new ATOM 0 HA LEU A 11 18.520 -8.668 -0.929 1.00 0.00 H new ATOM 0 HB2 LEU A 11 17.600 -10.545 -0.250 1.00 0.00 H new ATOM 0 HB3 LEU A 11 16.096 -9.676 -0.483 1.00 0.00 H new ATOM 0 HG LEU A 11 15.820 -10.713 -2.698 1.00 0.00 H new ATOM 0 HD11 LEU A 11 17.284 -12.554 -3.408 1.00 0.00 H new ATOM 0 HD12 LEU A 11 18.154 -11.005 -3.310 1.00 0.00 H new ATOM 0 HD13 LEU A 11 18.360 -12.223 -2.030 1.00 0.00 H new ATOM 0 HD21 LEU A 11 15.337 -12.998 -1.927 1.00 0.00 H new ATOM 0 HD22 LEU A 11 16.286 -12.696 -0.452 1.00 0.00 H new ATOM 0 HD23 LEU A 11 14.798 -11.769 -0.758 1.00 0.00 H new ATOM 77 N ILE A 12 17.688 -9.064 -4.044 1.00 0.00 N ATOM 78 CA ILE A 12 18.208 -9.363 -5.368 1.00 0.00 C ATOM 79 C ILE A 12 19.529 -8.618 -5.572 1.00 0.00 C ATOM 80 O ILE A 12 20.557 -9.233 -5.849 1.00 0.00 O ATOM 81 CB ILE A 12 17.158 -9.059 -6.438 1.00 0.00 C ATOM 82 CG1 ILE A 12 15.923 -9.945 -6.261 1.00 0.00 C ATOM 83 CG2 ILE A 12 17.755 -9.181 -7.842 1.00 0.00 C ATOM 84 CD1 ILE A 12 16.305 -11.427 -6.270 1.00 0.00 C ATOM 0 H ILE A 12 16.743 -8.680 -4.034 1.00 0.00 H new ATOM 0 HA ILE A 12 18.424 -10.427 -5.461 1.00 0.00 H new ATOM 0 HB ILE A 12 16.833 -8.026 -6.315 1.00 0.00 H new ATOM 0 HG12 ILE A 12 15.427 -9.700 -5.322 1.00 0.00 H new ATOM 0 HG13 ILE A 12 15.210 -9.745 -7.061 1.00 0.00 H new ATOM 0 HG21 ILE A 12 16.988 -8.960 -8.584 1.00 0.00 H new ATOM 0 HG22 ILE A 12 18.578 -8.475 -7.950 1.00 0.00 H new ATOM 0 HG23 ILE A 12 18.125 -10.195 -7.993 1.00 0.00 H new ATOM 0 HD11 ILE A 12 15.409 -12.034 -6.142 1.00 0.00 H new ATOM 0 HD12 ILE A 12 16.779 -11.675 -7.220 1.00 0.00 H new ATOM 0 HD13 ILE A 12 16.999 -11.629 -5.454 1.00 0.00 H new ATOM 85 N ASN A 13 19.457 -7.302 -5.427 1.00 0.00 N ATOM 86 CA ASN A 13 20.633 -6.466 -5.592 1.00 0.00 C ATOM 87 C ASN A 13 21.760 -6.996 -4.703 1.00 0.00 C ATOM 88 O ASN A 13 22.934 -6.886 -5.051 1.00 0.00 O ATOM 89 CB ASN A 13 20.345 -5.021 -5.180 1.00 0.00 C ATOM 90 CG ASN A 13 19.903 -4.185 -6.382 1.00 0.00 C ATOM 91 OD1 ASN A 13 18.727 -4.054 -6.681 1.00 0.00 O ATOM 92 ND2 ASN A 13 20.907 -3.629 -7.053 1.00 0.00 N ATOM 0 H ASN A 13 18.602 -6.795 -5.197 1.00 0.00 H new ATOM 0 HA ASN A 13 20.918 -6.491 -6.644 1.00 0.00 H new ATOM 0 HB2 ASN A 13 19.568 -5.005 -4.416 1.00 0.00 H new ATOM 0 HB3 ASN A 13 21.238 -4.581 -4.735 1.00 0.00 H new ATOM 0 HD21 ASN A 13 20.715 -3.052 -7.872 1.00 0.00 H new ATOM 0 HD22 ASN A 13 21.869 -3.779 -6.749 1.00 0.00 H new ATOM 93 N THR A 14 21.361 -7.560 -3.572 1.00 0.00 N ATOM 94 CA THR A 14 22.323 -8.107 -2.630 1.00 0.00 C ATOM 95 C THR A 14 22.983 -9.360 -3.208 1.00 0.00 C ATOM 96 O THR A 14 24.142 -9.647 -2.916 1.00 0.00 O ATOM 97 CB THR A 14 21.598 -8.359 -1.307 1.00 0.00 C ATOM 98 OG1 THR A 14 21.843 -7.178 -0.547 1.00 0.00 O ATOM 99 CG2 THR A 14 22.248 -9.473 -0.485 1.00 0.00 C ATOM 0 H THR A 14 20.386 -7.650 -3.287 1.00 0.00 H new ATOM 0 HA THR A 14 23.136 -7.406 -2.444 1.00 0.00 H new ATOM 0 HB THR A 14 20.558 -8.616 -1.507 1.00 0.00 H new ATOM 0 HG1 THR A 14 21.407 -7.255 0.327 1.00 0.00 H new ATOM 0 HG21 THR A 14 21.694 -9.611 0.444 1.00 0.00 H new ATOM 0 HG22 THR A 14 22.235 -10.401 -1.056 1.00 0.00 H new ATOM 0 HG23 THR A 14 23.279 -9.202 -0.256 1.00 0.00 H new ATOM 100 N LEU A 15 22.215 -10.074 -4.019 1.00 0.00 N ATOM 101 CA LEU A 15 22.710 -11.289 -4.642 1.00 0.00 C ATOM 102 C LEU A 15 23.822 -10.935 -5.630 1.00 0.00 C ATOM 103 O LEU A 15 24.676 -11.767 -5.936 1.00 0.00 O ATOM 104 CB LEU A 15 21.559 -12.078 -5.268 1.00 0.00 C ATOM 105 CG LEU A 15 20.290 -12.199 -4.421 1.00 0.00 C ATOM 106 CD1 LEU A 15 19.277 -13.138 -5.082 1.00 0.00 C ATOM 107 CD2 LEU A 15 20.623 -12.629 -2.991 1.00 0.00 C ATOM 0 H LEU A 15 21.253 -9.833 -4.259 1.00 0.00 H new ATOM 0 HA LEU A 15 23.148 -11.949 -3.893 1.00 0.00 H new ATOM 0 HB2 LEU A 15 21.296 -11.608 -6.216 1.00 0.00 H new ATOM 0 HB3 LEU A 15 21.916 -13.082 -5.498 1.00 0.00 H new ATOM 0 HG LEU A 15 19.825 -11.215 -4.360 1.00 0.00 H new ATOM 0 HD11 LEU A 15 18.385 -13.206 -4.460 1.00 0.00 H new ATOM 0 HD12 LEU A 15 19.006 -12.748 -6.063 1.00 0.00 H new ATOM 0 HD13 LEU A 15 19.718 -14.128 -5.194 1.00 0.00 H new ATOM 0 HD21 LEU A 15 19.703 -12.707 -2.411 1.00 0.00 H new ATOM 0 HD22 LEU A 15 21.124 -13.597 -3.009 1.00 0.00 H new ATOM 0 HD23 LEU A 15 21.279 -11.890 -2.532 1.00 0.00 H new ATOM 108 N GLU A 16 23.776 -9.698 -6.104 1.00 0.00 N ATOM 109 CA GLU A 16 24.770 -9.222 -7.053 1.00 0.00 C ATOM 110 C GLU A 16 26.158 -9.215 -6.409 1.00 0.00 C ATOM 111 O GLU A 16 27.164 -9.397 -7.092 1.00 0.00 O ATOM 112 CB GLU A 16 24.403 -7.835 -7.581 1.00 0.00 C ATOM 113 CG GLU A 16 24.183 -7.865 -9.095 1.00 0.00 C ATOM 114 CD GLU A 16 24.625 -6.550 -9.740 1.00 0.00 C ATOM 115 OE1 GLU A 16 24.009 -5.516 -9.401 1.00 0.00 O ATOM 116 OE2 GLU A 16 25.570 -6.608 -10.557 1.00 0.00 O ATOM 0 H GLU A 16 23.066 -9.011 -5.849 1.00 0.00 H new ATOM 0 HA GLU A 16 24.789 -9.904 -7.903 1.00 0.00 H new ATOM 0 HB2 GLU A 16 23.499 -7.481 -7.086 1.00 0.00 H new ATOM 0 HB3 GLU A 16 25.197 -7.128 -7.339 1.00 0.00 H new ATOM 0 HG2 GLU A 16 24.741 -8.694 -9.531 1.00 0.00 H new ATOM 0 HG3 GLU A 16 23.129 -8.043 -9.309 1.00 0.00 H new ATOM 117 N ASN A 17 26.167 -9.002 -5.101 1.00 0.00 N ATOM 118 CA ASN A 17 27.414 -8.967 -4.357 1.00 0.00 C ATOM 119 C ASN A 17 27.484 -10.183 -3.430 1.00 0.00 C ATOM 120 O ASN A 17 28.570 -10.607 -3.037 1.00 0.00 O ATOM 121 CB ASN A 17 27.507 -7.708 -3.494 1.00 0.00 C ATOM 122 CG ASN A 17 28.946 -7.462 -3.034 1.00 0.00 C ATOM 123 OD1 ASN A 17 29.321 -7.740 -1.907 1.00 0.00 O ATOM 124 ND2 ASN A 17 29.727 -6.926 -3.968 1.00 0.00 N ATOM 0 H ASN A 17 25.330 -8.852 -4.538 1.00 0.00 H new ATOM 0 HA ASN A 17 28.234 -8.972 -5.075 1.00 0.00 H new ATOM 0 HB2 ASN A 17 27.151 -6.848 -4.060 1.00 0.00 H new ATOM 0 HB3 ASN A 17 26.856 -7.810 -2.625 1.00 0.00 H new ATOM 0 HD21 ASN A 17 30.705 -6.723 -3.760 1.00 0.00 H new ATOM 0 HD22 ASN A 17 29.348 -6.718 -4.892 1.00 0.00 H new ATOM 125 N LEU A 18 26.311 -10.708 -3.107 1.00 0.00 N ATOM 126 CA LEU A 18 26.226 -11.865 -2.233 1.00 0.00 C ATOM 127 C LEU A 18 27.362 -12.836 -2.565 1.00 0.00 C ATOM 128 O LEU A 18 28.395 -12.837 -1.898 1.00 0.00 O ATOM 129 CB LEU A 18 24.835 -12.497 -2.316 1.00 0.00 C ATOM 130 CG LEU A 18 24.523 -13.573 -1.273 1.00 0.00 C ATOM 131 CD1 LEU A 18 23.892 -12.958 -0.023 1.00 0.00 C ATOM 132 CD2 LEU A 18 23.651 -14.679 -1.870 1.00 0.00 C ATOM 0 H LEU A 18 25.412 -10.354 -3.435 1.00 0.00 H new ATOM 0 HA LEU A 18 26.355 -11.566 -1.193 1.00 0.00 H new ATOM 0 HB2 LEU A 18 24.092 -11.705 -2.225 1.00 0.00 H new ATOM 0 HB3 LEU A 18 24.715 -12.934 -3.307 1.00 0.00 H new ATOM 0 HG LEU A 18 25.462 -14.034 -0.966 1.00 0.00 H new ATOM 0 HD11 LEU A 18 23.680 -13.744 0.702 1.00 0.00 H new ATOM 0 HD12 LEU A 18 24.581 -12.236 0.415 1.00 0.00 H new ATOM 0 HD13 LEU A 18 22.964 -12.455 -0.294 1.00 0.00 H new ATOM 0 HD21 LEU A 18 23.444 -15.430 -1.108 1.00 0.00 H new ATOM 0 HD22 LEU A 18 22.712 -14.252 -2.223 1.00 0.00 H new ATOM 0 HD23 LEU A 18 24.174 -15.144 -2.705 1.00 0.00 H new ATOM 133 N LEU A 19 27.132 -13.636 -3.595 1.00 0.00 N ATOM 134 CA LEU A 19 28.123 -14.608 -4.024 1.00 0.00 C ATOM 135 C LEU A 19 28.836 -14.086 -5.273 1.00 0.00 C ATOM 136 O LEU A 19 30.033 -14.309 -5.448 1.00 0.00 O ATOM 137 CB LEU A 19 27.479 -15.982 -4.213 1.00 0.00 C ATOM 138 CG LEU A 19 26.217 -16.251 -3.390 1.00 0.00 C ATOM 139 CD1 LEU A 19 24.963 -15.831 -4.158 1.00 0.00 C ATOM 140 CD2 LEU A 19 26.155 -17.713 -2.943 1.00 0.00 C ATOM 0 H LEU A 19 26.273 -13.631 -4.146 1.00 0.00 H new ATOM 0 HA LEU A 19 28.884 -14.741 -3.255 1.00 0.00 H new ATOM 0 HB2 LEU A 19 27.234 -16.104 -5.268 1.00 0.00 H new ATOM 0 HB3 LEU A 19 28.218 -16.744 -3.967 1.00 0.00 H new ATOM 0 HG LEU A 19 26.260 -15.641 -2.487 1.00 0.00 H new ATOM 0 HD11 LEU A 19 24.080 -16.033 -3.551 1.00 0.00 H new ATOM 0 HD12 LEU A 19 25.014 -14.766 -4.382 1.00 0.00 H new ATOM 0 HD13 LEU A 19 24.900 -16.395 -5.089 1.00 0.00 H new ATOM 0 HD21 LEU A 19 25.249 -17.877 -2.360 1.00 0.00 H new ATOM 0 HD22 LEU A 19 26.145 -18.361 -3.819 1.00 0.00 H new ATOM 0 HD23 LEU A 19 27.027 -17.944 -2.331 1.00 0.00 H new ATOM 141 N THR A 20 28.071 -13.401 -6.109 1.00 0.00 N ATOM 142 CA THR A 20 28.614 -12.846 -7.338 1.00 0.00 C ATOM 143 C THR A 20 29.496 -13.876 -8.044 1.00 0.00 C ATOM 144 O THR A 20 30.619 -13.568 -8.444 1.00 0.00 O ATOM 145 CB THR A 20 29.353 -11.553 -6.985 1.00 0.00 C ATOM 146 OG1 THR A 20 29.880 -11.103 -8.231 1.00 0.00 O ATOM 147 CG2 THR A 20 30.594 -11.803 -6.124 1.00 0.00 C ATOM 0 H THR A 20 27.079 -13.217 -5.960 1.00 0.00 H new ATOM 0 HA THR A 20 27.822 -12.603 -8.047 1.00 0.00 H new ATOM 0 HB THR A 20 28.676 -10.881 -6.458 1.00 0.00 H new ATOM 0 HG1 THR A 20 30.419 -11.815 -8.634 1.00 0.00 H new ATOM 0 HG21 THR A 20 31.081 -10.853 -5.903 1.00 0.00 H new ATOM 0 HG22 THR A 20 30.299 -12.286 -5.192 1.00 0.00 H new ATOM 0 HG23 THR A 20 31.287 -12.449 -6.663 1.00 0.00 H new ATOM 148 N THR A 21 28.956 -15.078 -8.178 1.00 0.00 N ATOM 149 CA THR A 21 29.680 -16.157 -8.830 1.00 0.00 C ATOM 150 C THR A 21 30.612 -16.851 -7.834 1.00 0.00 C ATOM 151 O THR A 21 31.572 -16.250 -7.354 1.00 0.00 O ATOM 152 CB THR A 21 30.410 -15.572 -10.039 1.00 0.00 C ATOM 153 OG1 THR A 21 29.514 -14.585 -10.544 1.00 0.00 O ATOM 154 CG2 THR A 21 30.543 -16.577 -11.186 1.00 0.00 C ATOM 0 H THR A 21 28.025 -15.329 -7.846 1.00 0.00 H new ATOM 0 HA THR A 21 29.001 -16.932 -9.186 1.00 0.00 H new ATOM 0 HB THR A 21 31.401 -15.235 -9.735 1.00 0.00 H new ATOM 0 HG1 THR A 21 29.911 -14.154 -11.330 1.00 0.00 H new ATOM 0 HG21 THR A 21 31.069 -16.111 -12.019 1.00 0.00 H new ATOM 0 HG22 THR A 21 31.104 -17.447 -10.844 1.00 0.00 H new ATOM 0 HG23 THR A 21 29.551 -16.890 -11.512 1.00 0.00 H new ATOM 155 N LYS A 22 30.296 -18.106 -7.554 1.00 0.00 N ATOM 156 CA LYS A 22 31.093 -18.890 -6.625 1.00 0.00 C ATOM 157 C LYS A 22 30.418 -20.243 -6.395 1.00 0.00 C ATOM 158 O LYS A 22 30.949 -21.280 -6.788 1.00 0.00 O ATOM 159 CB LYS A 22 31.343 -18.101 -5.338 1.00 0.00 C ATOM 160 CG LYS A 22 32.837 -17.828 -5.144 1.00 0.00 C ATOM 161 CD LYS A 22 33.076 -16.920 -3.936 1.00 0.00 C ATOM 162 CE LYS A 22 34.572 -16.760 -3.658 1.00 0.00 C ATOM 163 NZ LYS A 22 34.969 -15.339 -3.758 1.00 0.00 N ATOM 0 H LYS A 22 29.499 -18.600 -7.954 1.00 0.00 H new ATOM 0 HA LYS A 22 32.078 -19.093 -7.045 1.00 0.00 H new ATOM 0 HB2 LYS A 22 30.799 -17.157 -5.374 1.00 0.00 H new ATOM 0 HB3 LYS A 22 30.958 -18.659 -4.484 1.00 0.00 H new ATOM 0 HG2 LYS A 22 33.368 -18.770 -5.006 1.00 0.00 H new ATOM 0 HG3 LYS A 22 33.244 -17.361 -6.041 1.00 0.00 H new ATOM 0 HD2 LYS A 22 32.630 -15.942 -4.117 1.00 0.00 H new ATOM 0 HD3 LYS A 22 32.582 -17.338 -3.059 1.00 0.00 H new ATOM 0 HE2 LYS A 22 34.806 -17.140 -2.663 1.00 0.00 H new ATOM 0 HE3 LYS A 22 35.146 -17.355 -4.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 35.987 -15.249 -3.566 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 34.764 -14.988 -4.715 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 34.435 -14.780 -3.063 1.00 0.00 H new ATOM 164 N GLY A 23 29.256 -20.189 -5.761 1.00 0.00 N ATOM 165 CA GLY A 23 28.502 -21.398 -5.474 1.00 0.00 C ATOM 166 C GLY A 23 27.022 -21.214 -5.812 1.00 0.00 C ATOM 167 O GLY A 23 26.407 -22.088 -6.420 1.00 0.00 O ATOM 0 H GLY A 23 28.818 -19.327 -5.438 1.00 0.00 H new ATOM 0 HA2 GLY A 23 28.909 -22.230 -6.049 1.00 0.00 H new ATOM 0 HA3 GLY A 23 28.609 -21.656 -4.420 1.00 0.00 H new ATOM 168 N ALA A 24 26.491 -20.071 -5.402 1.00 0.00 N ATOM 169 CA ALA A 24 25.094 -19.761 -5.653 1.00 0.00 C ATOM 170 C ALA A 24 24.220 -20.519 -4.652 1.00 0.00 C ATOM 171 O ALA A 24 22.997 -20.390 -4.669 1.00 0.00 O ATOM 172 CB ALA A 24 24.749 -20.102 -7.104 1.00 0.00 C ATOM 0 H ALA A 24 27.004 -19.348 -4.897 1.00 0.00 H new ATOM 0 HA ALA A 24 24.906 -18.696 -5.514 1.00 0.00 H new ATOM 0 HB1 ALA A 24 23.701 -19.870 -7.293 1.00 0.00 H new ATOM 0 HB2 ALA A 24 25.377 -19.516 -7.775 1.00 0.00 H new ATOM 0 HB3 ALA A 24 24.923 -21.164 -7.279 1.00 0.00 H new ATOM 173 N ASP A 25 24.881 -21.292 -3.803 1.00 0.00 N ATOM 174 CA ASP A 25 24.181 -22.069 -2.796 1.00 0.00 C ATOM 175 C ASP A 25 23.840 -21.168 -1.607 1.00 0.00 C ATOM 176 O ASP A 25 22.793 -21.329 -0.982 1.00 0.00 O ATOM 177 CB ASP A 25 25.050 -23.219 -2.284 1.00 0.00 C ATOM 178 CG ASP A 25 25.445 -24.252 -3.341 1.00 0.00 C ATOM 179 OD1 ASP A 25 24.536 -24.990 -3.780 1.00 0.00 O ATOM 180 OD2 ASP A 25 26.646 -24.281 -3.687 1.00 0.00 O ATOM 0 H ASP A 25 25.896 -21.396 -3.792 1.00 0.00 H new ATOM 0 HA ASP A 25 23.278 -22.475 -3.252 1.00 0.00 H new ATOM 0 HB2 ASP A 25 25.958 -22.802 -1.848 1.00 0.00 H new ATOM 0 HB3 ASP A 25 24.516 -23.728 -1.482 1.00 0.00 H new ATOM 181 N LYS A 26 24.743 -20.239 -1.332 1.00 0.00 N ATOM 182 CA LYS A 26 24.552 -19.312 -0.230 1.00 0.00 C ATOM 183 C LYS A 26 23.393 -18.369 -0.558 1.00 0.00 C ATOM 184 O LYS A 26 22.880 -17.681 0.324 1.00 0.00 O ATOM 185 CB LYS A 26 25.860 -18.589 0.096 1.00 0.00 C ATOM 186 CG LYS A 26 25.624 -17.090 0.288 1.00 0.00 C ATOM 187 CD LYS A 26 24.906 -16.813 1.610 1.00 0.00 C ATOM 188 CE LYS A 26 25.889 -16.334 2.680 1.00 0.00 C ATOM 189 NZ LYS A 26 25.295 -16.472 4.029 1.00 0.00 N ATOM 0 H LYS A 26 25.610 -20.108 -1.854 1.00 0.00 H new ATOM 0 HA LYS A 26 24.279 -19.850 0.677 1.00 0.00 H new ATOM 0 HB2 LYS A 26 26.297 -19.011 1.001 1.00 0.00 H new ATOM 0 HB3 LYS A 26 26.578 -18.748 -0.709 1.00 0.00 H new ATOM 0 HG2 LYS A 26 26.578 -16.563 0.271 1.00 0.00 H new ATOM 0 HG3 LYS A 26 25.031 -16.703 -0.540 1.00 0.00 H new ATOM 0 HD2 LYS A 26 24.134 -16.059 1.457 1.00 0.00 H new ATOM 0 HD3 LYS A 26 24.404 -17.718 1.952 1.00 0.00 H new ATOM 0 HE2 LYS A 26 26.811 -16.913 2.621 1.00 0.00 H new ATOM 0 HE3 LYS A 26 26.155 -15.293 2.498 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 25.975 -16.142 4.743 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 24.428 -15.900 4.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 25.064 -17.470 4.206 1.00 0.00 H new ATOM 190 N VAL A 27 23.014 -18.368 -1.827 1.00 0.00 N ATOM 191 CA VAL A 27 21.925 -17.520 -2.282 1.00 0.00 C ATOM 192 C VAL A 27 20.604 -18.049 -1.720 1.00 0.00 C ATOM 193 O VAL A 27 19.854 -17.309 -1.085 1.00 0.00 O ATOM 194 CB VAL A 27 21.933 -17.434 -3.810 1.00 0.00 C ATOM 195 CG1 VAL A 27 20.859 -18.340 -4.416 1.00 0.00 C ATOM 196 CG2 VAL A 27 21.759 -15.988 -4.278 1.00 0.00 C ATOM 0 H VAL A 27 23.441 -18.941 -2.555 1.00 0.00 H new ATOM 0 HA VAL A 27 22.052 -16.503 -1.912 1.00 0.00 H new ATOM 0 HB VAL A 27 22.904 -17.785 -4.161 1.00 0.00 H new ATOM 0 HG11 VAL A 27 20.886 -18.260 -5.503 1.00 0.00 H new ATOM 0 HG12 VAL A 27 21.047 -19.373 -4.123 1.00 0.00 H new ATOM 0 HG13 VAL A 27 19.878 -18.033 -4.054 1.00 0.00 H new ATOM 0 HG21 VAL A 27 21.768 -15.955 -5.367 1.00 0.00 H new ATOM 0 HG22 VAL A 27 20.809 -15.599 -3.911 1.00 0.00 H new ATOM 0 HG23 VAL A 27 22.575 -15.379 -3.889 1.00 0.00 H new ATOM 197 N LYS A 28 20.359 -19.326 -1.974 1.00 0.00 N ATOM 198 CA LYS A 28 19.141 -19.963 -1.501 1.00 0.00 C ATOM 199 C LYS A 28 19.212 -20.125 0.019 1.00 0.00 C ATOM 200 O LYS A 28 18.191 -20.326 0.674 1.00 0.00 O ATOM 201 CB LYS A 28 18.897 -21.275 -2.248 1.00 0.00 C ATOM 202 CG LYS A 28 19.883 -22.354 -1.796 1.00 0.00 C ATOM 203 CD LYS A 28 19.148 -23.535 -1.160 1.00 0.00 C ATOM 204 CE LYS A 28 20.089 -24.356 -0.276 1.00 0.00 C ATOM 205 NZ LYS A 28 19.709 -25.786 -0.299 1.00 0.00 N ATOM 0 H LYS A 28 20.983 -19.937 -2.501 1.00 0.00 H new ATOM 0 HA LYS A 28 18.276 -19.336 -1.715 1.00 0.00 H new ATOM 0 HB2 LYS A 28 17.876 -21.613 -2.072 1.00 0.00 H new ATOM 0 HB3 LYS A 28 18.998 -21.111 -3.321 1.00 0.00 H new ATOM 0 HG2 LYS A 28 20.465 -22.700 -2.650 1.00 0.00 H new ATOM 0 HG3 LYS A 28 20.588 -21.931 -1.080 1.00 0.00 H new ATOM 0 HD2 LYS A 28 18.311 -23.169 -0.565 1.00 0.00 H new ATOM 0 HD3 LYS A 28 18.730 -24.171 -1.941 1.00 0.00 H new ATOM 0 HE2 LYS A 28 21.116 -24.241 -0.623 1.00 0.00 H new ATOM 0 HE3 LYS A 28 20.055 -23.981 0.747 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 20.358 -26.328 0.306 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 18.737 -25.893 0.054 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 19.764 -26.144 -1.274 1.00 0.00 H new ATOM 206 N ASP A 29 20.429 -20.030 0.536 1.00 0.00 N ATOM 207 CA ASP A 29 20.646 -20.164 1.965 1.00 0.00 C ATOM 208 C ASP A 29 20.280 -18.849 2.658 1.00 0.00 C ATOM 209 O ASP A 29 19.792 -18.854 3.787 1.00 0.00 O ATOM 210 CB ASP A 29 22.114 -20.466 2.274 1.00 0.00 C ATOM 211 CG ASP A 29 22.344 -21.493 3.384 1.00 0.00 C ATOM 212 OD1 ASP A 29 21.644 -21.382 4.413 1.00 0.00 O ATOM 213 OD2 ASP A 29 23.214 -22.367 3.178 1.00 0.00 O ATOM 0 H ASP A 29 21.274 -19.862 -0.010 1.00 0.00 H new ATOM 0 HA ASP A 29 20.025 -20.985 2.324 1.00 0.00 H new ATOM 0 HB2 ASP A 29 22.595 -20.824 1.364 1.00 0.00 H new ATOM 0 HB3 ASP A 29 22.610 -19.536 2.552 1.00 0.00 H new ATOM 214 N TYR A 30 20.529 -17.756 1.952 1.00 0.00 N ATOM 215 CA TYR A 30 20.230 -16.437 2.485 1.00 0.00 C ATOM 216 C TYR A 30 18.815 -16.000 2.105 1.00 0.00 C ATOM 217 O TYR A 30 18.177 -15.245 2.837 1.00 0.00 O ATOM 218 CB TYR A 30 21.237 -15.484 1.837 1.00 0.00 C ATOM 219 CG TYR A 30 20.720 -14.054 1.669 1.00 0.00 C ATOM 220 CD1 TYR A 30 19.857 -13.748 0.637 1.00 0.00 C ATOM 221 CD2 TYR A 30 21.116 -13.069 2.551 1.00 0.00 C ATOM 222 CE1 TYR A 30 19.370 -12.402 0.479 1.00 0.00 C ATOM 223 CE2 TYR A 30 20.630 -11.723 2.393 1.00 0.00 C ATOM 224 CZ TYR A 30 19.780 -11.456 1.366 1.00 0.00 C ATOM 225 OH TYR A 30 19.321 -10.185 1.217 1.00 0.00 O ATOM 0 H TYR A 30 20.934 -17.756 1.016 1.00 0.00 H new ATOM 0 HA TYR A 30 20.295 -16.438 3.573 1.00 0.00 H new ATOM 0 HB2 TYR A 30 22.143 -15.463 2.442 1.00 0.00 H new ATOM 0 HB3 TYR A 30 21.516 -15.876 0.859 1.00 0.00 H new ATOM 0 HD1 TYR A 30 19.546 -14.519 -0.053 1.00 0.00 H new ATOM 0 HD2 TYR A 30 21.791 -13.308 3.360 1.00 0.00 H new ATOM 0 HE1 TYR A 30 18.695 -12.150 -0.325 1.00 0.00 H new ATOM 0 HE2 TYR A 30 20.934 -10.943 3.075 1.00 0.00 H new ATOM 0 HH TYR A 30 19.696 -9.617 1.922 1.00 0.00 H new ATOM 226 N ILE A 31 18.363 -16.494 0.962 1.00 0.00 N ATOM 227 CA ILE A 31 17.034 -16.163 0.475 1.00 0.00 C ATOM 228 C ILE A 31 15.988 -16.789 1.400 1.00 0.00 C ATOM 229 O ILE A 31 14.905 -16.236 1.582 1.00 0.00 O ATOM 230 CB ILE A 31 16.882 -16.574 -0.991 1.00 0.00 C ATOM 231 CG1 ILE A 31 17.519 -15.537 -1.918 1.00 0.00 C ATOM 232 CG2 ILE A 31 15.415 -16.831 -1.339 1.00 0.00 C ATOM 233 CD1 ILE A 31 18.316 -16.216 -3.034 1.00 0.00 C ATOM 0 H ILE A 31 18.894 -17.122 0.358 1.00 0.00 H new ATOM 0 HA ILE A 31 16.878 -15.085 0.497 1.00 0.00 H new ATOM 0 HB ILE A 31 17.416 -17.512 -1.141 1.00 0.00 H new ATOM 0 HG12 ILE A 31 16.743 -14.907 -2.352 1.00 0.00 H new ATOM 0 HG13 ILE A 31 18.175 -14.884 -1.343 1.00 0.00 H new ATOM 0 HG21 ILE A 31 15.335 -17.121 -2.387 1.00 0.00 H new ATOM 0 HG22 ILE A 31 15.027 -17.632 -0.710 1.00 0.00 H new ATOM 0 HG23 ILE A 31 14.836 -15.923 -1.169 1.00 0.00 H new ATOM 0 HD11 ILE A 31 18.758 -15.457 -3.679 1.00 0.00 H new ATOM 0 HD12 ILE A 31 19.106 -16.826 -2.597 1.00 0.00 H new ATOM 0 HD13 ILE A 31 17.652 -16.849 -3.622 1.00 0.00 H new ATOM 234 N SER A 32 16.349 -17.934 1.961 1.00 0.00 N ATOM 235 CA SER A 32 15.455 -18.641 2.862 1.00 0.00 C ATOM 236 C SER A 32 15.374 -17.906 4.202 1.00 0.00 C ATOM 237 O SER A 32 14.284 -17.613 4.689 1.00 0.00 O ATOM 238 CB SER A 32 15.916 -20.084 3.076 1.00 0.00 C ATOM 239 OG SER A 32 15.149 -21.008 2.310 1.00 0.00 O ATOM 0 H SER A 32 17.249 -18.390 1.809 1.00 0.00 H new ATOM 0 HA SER A 32 14.464 -18.668 2.409 1.00 0.00 H new ATOM 0 HB2 SER A 32 16.968 -20.173 2.804 1.00 0.00 H new ATOM 0 HB3 SER A 32 15.838 -20.337 4.133 1.00 0.00 H new ATOM 0 HG SER A 32 15.475 -21.918 2.473 1.00 0.00 H new ATOM 240 N SER A 33 16.545 -17.627 4.760 1.00 0.00 N ATOM 241 CA SER A 33 16.620 -16.932 6.033 1.00 0.00 C ATOM 242 C SER A 33 15.948 -15.562 5.922 1.00 0.00 C ATOM 243 O SER A 33 15.385 -15.063 6.895 1.00 0.00 O ATOM 244 CB SER A 33 18.072 -16.775 6.490 1.00 0.00 C ATOM 245 OG SER A 33 18.162 -16.246 7.810 1.00 0.00 O ATOM 0 H SER A 33 17.448 -17.870 4.353 1.00 0.00 H new ATOM 0 HA SER A 33 16.095 -17.528 6.779 1.00 0.00 H new ATOM 0 HB2 SER A 33 18.570 -17.744 6.453 1.00 0.00 H new ATOM 0 HB3 SER A 33 18.600 -16.118 5.799 1.00 0.00 H new ATOM 0 HG SER A 33 19.104 -16.162 8.065 1.00 0.00 H new ATOM 246 N LEU A 34 16.028 -14.994 4.728 1.00 0.00 N ATOM 247 CA LEU A 34 15.434 -13.692 4.478 1.00 0.00 C ATOM 248 C LEU A 34 13.928 -13.854 4.270 1.00 0.00 C ATOM 249 O LEU A 34 13.133 -13.127 4.864 1.00 0.00 O ATOM 250 CB LEU A 34 16.144 -12.994 3.314 1.00 0.00 C ATOM 251 CG LEU A 34 17.328 -12.102 3.689 1.00 0.00 C ATOM 252 CD1 LEU A 34 16.850 -10.780 4.294 1.00 0.00 C ATOM 253 CD2 LEU A 34 18.297 -12.838 4.615 1.00 0.00 C ATOM 0 H LEU A 34 16.495 -15.412 3.923 1.00 0.00 H new ATOM 0 HA LEU A 34 15.568 -13.040 5.341 1.00 0.00 H new ATOM 0 HB2 LEU A 34 16.495 -13.757 2.619 1.00 0.00 H new ATOM 0 HB3 LEU A 34 15.413 -12.388 2.779 1.00 0.00 H new ATOM 0 HG LEU A 34 17.874 -11.860 2.777 1.00 0.00 H new ATOM 0 HD11 LEU A 34 17.712 -10.165 4.552 1.00 0.00 H new ATOM 0 HD12 LEU A 34 16.231 -10.251 3.570 1.00 0.00 H new ATOM 0 HD13 LEU A 34 16.266 -10.981 5.192 1.00 0.00 H new ATOM 0 HD21 LEU A 34 19.130 -12.181 4.866 1.00 0.00 H new ATOM 0 HD22 LEU A 34 17.777 -13.130 5.527 1.00 0.00 H new ATOM 0 HD23 LEU A 34 18.676 -13.728 4.112 1.00 0.00 H new ATOM 254 N CYS A 35 13.578 -14.815 3.426 1.00 0.00 N ATOM 255 CA CYS A 35 12.181 -15.082 3.134 1.00 0.00 C ATOM 256 C CYS A 35 11.565 -15.793 4.340 1.00 0.00 C ATOM 257 O CYS A 35 10.363 -16.056 4.363 1.00 0.00 O ATOM 258 CB CYS A 35 12.018 -15.896 1.847 1.00 0.00 C ATOM 259 SG CYS A 35 10.503 -15.523 0.890 1.00 0.00 S ATOM 0 H CYS A 35 14.239 -15.418 2.936 1.00 0.00 H new ATOM 0 HA CYS A 35 11.657 -14.142 2.961 1.00 0.00 H new ATOM 0 HB2 CYS A 35 12.885 -15.721 1.211 1.00 0.00 H new ATOM 0 HB3 CYS A 35 12.018 -16.956 2.102 1.00 0.00 H new ATOM 260 N ASN A 36 12.416 -16.084 5.314 1.00 0.00 N ATOM 261 CA ASN A 36 11.969 -16.758 6.520 1.00 0.00 C ATOM 262 C ASN A 36 11.149 -15.786 7.369 1.00 0.00 C ATOM 263 O ASN A 36 11.446 -15.580 8.545 1.00 0.00 O ATOM 264 CB ASN A 36 13.160 -17.230 7.359 1.00 0.00 C ATOM 265 CG ASN A 36 12.687 -17.922 8.640 1.00 0.00 C ATOM 266 OD1 ASN A 36 11.680 -18.610 8.669 1.00 0.00 O ATOM 267 ND2 ASN A 36 13.469 -17.702 9.692 1.00 0.00 N ATOM 0 H ASN A 36 13.412 -15.865 5.292 1.00 0.00 H new ATOM 0 HA ASN A 36 11.371 -17.620 6.223 1.00 0.00 H new ATOM 0 HB2 ASN A 36 13.772 -17.917 6.775 1.00 0.00 H new ATOM 0 HB3 ASN A 36 13.791 -16.378 7.613 1.00 0.00 H new ATOM 0 HD21 ASN A 36 13.240 -18.120 10.594 1.00 0.00 H new ATOM 0 HD22 ASN A 36 14.298 -17.115 9.597 1.00 0.00 H new ATOM 268 N LYS A 37 10.132 -15.213 6.740 1.00 0.00 N ATOM 269 CA LYS A 37 9.267 -14.268 7.423 1.00 0.00 C ATOM 270 C LYS A 37 8.187 -13.779 6.456 1.00 0.00 C ATOM 271 O LYS A 37 7.841 -12.599 6.450 1.00 0.00 O ATOM 272 CB LYS A 37 10.091 -13.139 8.046 1.00 0.00 C ATOM 273 CG LYS A 37 9.633 -12.848 9.476 1.00 0.00 C ATOM 274 CD LYS A 37 8.590 -11.728 9.501 1.00 0.00 C ATOM 275 CE LYS A 37 7.321 -12.176 10.228 1.00 0.00 C ATOM 276 NZ LYS A 37 6.441 -12.939 9.315 1.00 0.00 N ATOM 0 H LYS A 37 9.889 -15.386 5.765 1.00 0.00 H new ATOM 0 HA LYS A 37 8.755 -14.754 8.254 1.00 0.00 H new ATOM 0 HB2 LYS A 37 11.146 -13.413 8.047 1.00 0.00 H new ATOM 0 HB3 LYS A 37 9.996 -12.238 7.440 1.00 0.00 H new ATOM 0 HG2 LYS A 37 9.212 -13.751 9.918 1.00 0.00 H new ATOM 0 HG3 LYS A 37 10.491 -12.565 10.086 1.00 0.00 H new ATOM 0 HD2 LYS A 37 9.006 -10.850 9.995 1.00 0.00 H new ATOM 0 HD3 LYS A 37 8.344 -11.433 8.481 1.00 0.00 H new ATOM 0 HE2 LYS A 37 7.586 -12.793 11.087 1.00 0.00 H new ATOM 0 HE3 LYS A 37 6.789 -11.306 10.612 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 5.447 -12.711 9.520 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 6.659 -12.685 8.330 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 6.598 -13.958 9.453 1.00 0.00 H new ATOM 277 N ALA A 38 7.685 -14.713 5.660 1.00 0.00 N ATOM 278 CA ALA A 38 6.653 -14.393 4.690 1.00 0.00 C ATOM 279 C ALA A 38 5.304 -14.907 5.198 1.00 0.00 C ATOM 280 O ALA A 38 4.631 -14.232 5.975 1.00 0.00 O ATOM 281 CB ALA A 38 7.028 -14.985 3.330 1.00 0.00 C ATOM 0 H ALA A 38 7.975 -15.691 5.668 1.00 0.00 H new ATOM 0 HA ALA A 38 6.568 -13.314 4.563 1.00 0.00 H new ATOM 0 HB1 ALA A 38 6.253 -14.744 2.602 1.00 0.00 H new ATOM 0 HB2 ALA A 38 7.978 -14.565 3.000 1.00 0.00 H new ATOM 0 HB3 ALA A 38 7.120 -16.068 3.417 1.00 0.00 H new ATOM 282 N SER A 39 4.951 -16.099 4.739 1.00 0.00 N ATOM 283 CA SER A 39 3.694 -16.712 5.137 1.00 0.00 C ATOM 284 C SER A 39 2.603 -15.645 5.249 1.00 0.00 C ATOM 285 O SER A 39 1.806 -15.662 6.186 1.00 0.00 O ATOM 286 CB SER A 39 3.842 -17.458 6.465 1.00 0.00 C ATOM 287 OG SER A 39 3.065 -18.653 6.494 1.00 0.00 O ATOM 0 H SER A 39 5.513 -16.657 4.096 1.00 0.00 H new ATOM 0 HA SER A 39 3.410 -17.435 4.373 1.00 0.00 H new ATOM 0 HB2 SER A 39 4.891 -17.703 6.628 1.00 0.00 H new ATOM 0 HB3 SER A 39 3.536 -16.806 7.283 1.00 0.00 H new ATOM 0 HG SER A 39 3.187 -19.102 7.357 1.00 0.00 H new ATOM 288 N GLY A 40 2.603 -14.741 4.280 1.00 0.00 N ATOM 289 CA GLY A 40 1.623 -13.668 4.257 1.00 0.00 C ATOM 290 C GLY A 40 1.374 -13.184 2.828 1.00 0.00 C ATOM 291 O GLY A 40 1.105 -13.986 1.935 1.00 0.00 O ATOM 0 H GLY A 40 3.266 -14.730 3.505 1.00 0.00 H new ATOM 0 HA2 GLY A 40 0.687 -14.016 4.695 1.00 0.00 H new ATOM 0 HA3 GLY A 40 1.973 -12.838 4.870 1.00 0.00 H new ATOM 292 N PHE A 41 1.472 -11.873 2.655 1.00 0.00 N ATOM 293 CA PHE A 41 1.260 -11.273 1.350 1.00 0.00 C ATOM 294 C PHE A 41 2.347 -11.706 0.364 1.00 0.00 C ATOM 295 O PHE A 41 2.102 -11.792 -0.839 1.00 0.00 O ATOM 296 CB PHE A 41 1.333 -9.756 1.536 1.00 0.00 C ATOM 297 CG PHE A 41 1.139 -8.959 0.245 1.00 0.00 C ATOM 298 CD1 PHE A 41 2.037 -9.080 -0.769 1.00 0.00 C ATOM 299 CD2 PHE A 41 0.070 -8.130 0.112 1.00 0.00 C ATOM 300 CE1 PHE A 41 1.857 -8.341 -1.968 1.00 0.00 C ATOM 301 CE2 PHE A 41 -0.110 -7.390 -1.086 1.00 0.00 C ATOM 302 CZ PHE A 41 0.787 -7.511 -2.101 1.00 0.00 C ATOM 0 H PHE A 41 1.695 -11.211 3.398 1.00 0.00 H new ATOM 0 HA PHE A 41 0.296 -11.588 0.949 1.00 0.00 H new ATOM 0 HB2 PHE A 41 0.573 -9.452 2.256 1.00 0.00 H new ATOM 0 HB3 PHE A 41 2.301 -9.500 1.967 1.00 0.00 H new ATOM 0 HD1 PHE A 41 2.887 -9.738 -0.662 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -0.643 -8.034 0.918 1.00 0.00 H new ATOM 0 HE1 PHE A 41 2.569 -8.438 -2.774 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -0.959 -6.731 -1.191 1.00 0.00 H new ATOM 0 HZ PHE A 41 0.650 -6.948 -3.013 1.00 0.00 H new ATOM 303 N ILE A 42 3.526 -11.967 0.909 1.00 0.00 N ATOM 304 CA ILE A 42 4.652 -12.389 0.093 1.00 0.00 C ATOM 305 C ILE A 42 4.642 -13.913 -0.034 1.00 0.00 C ATOM 306 O ILE A 42 5.374 -14.477 -0.845 1.00 0.00 O ATOM 307 CB ILE A 42 5.960 -11.827 0.654 1.00 0.00 C ATOM 308 CG1 ILE A 42 5.691 -10.851 1.801 1.00 0.00 C ATOM 309 CG2 ILE A 42 6.803 -11.191 -0.454 1.00 0.00 C ATOM 310 CD1 ILE A 42 5.589 -11.591 3.137 1.00 0.00 C ATOM 0 H ILE A 42 3.726 -11.894 1.907 1.00 0.00 H new ATOM 0 HA ILE A 42 4.564 -11.985 -0.915 1.00 0.00 H new ATOM 0 HB ILE A 42 6.539 -12.654 1.065 1.00 0.00 H new ATOM 0 HG12 ILE A 42 6.491 -10.112 1.850 1.00 0.00 H new ATOM 0 HG13 ILE A 42 4.766 -10.307 1.611 1.00 0.00 H new ATOM 0 HG21 ILE A 42 7.727 -10.799 -0.029 1.00 0.00 H new ATOM 0 HG22 ILE A 42 7.040 -11.942 -1.207 1.00 0.00 H new ATOM 0 HG23 ILE A 42 6.243 -10.378 -0.916 1.00 0.00 H new ATOM 0 HD11 ILE A 42 5.398 -10.875 3.936 1.00 0.00 H new ATOM 0 HD12 ILE A 42 4.772 -12.312 3.092 1.00 0.00 H new ATOM 0 HD13 ILE A 42 6.524 -12.114 3.335 1.00 0.00 H new ATOM 311 N ALA A 43 3.803 -14.538 0.781 1.00 0.00 N ATOM 312 CA ALA A 43 3.688 -15.986 0.771 1.00 0.00 C ATOM 313 C ALA A 43 3.846 -16.495 -0.664 1.00 0.00 C ATOM 314 O ALA A 43 4.777 -17.242 -0.963 1.00 0.00 O ATOM 315 CB ALA A 43 2.351 -16.396 1.391 1.00 0.00 C ATOM 0 H ALA A 43 3.197 -14.067 1.452 1.00 0.00 H new ATOM 0 HA ALA A 43 4.478 -16.439 1.371 1.00 0.00 H new ATOM 0 HB1 ALA A 43 2.264 -17.483 1.384 1.00 0.00 H new ATOM 0 HB2 ALA A 43 2.300 -16.035 2.418 1.00 0.00 H new ATOM 0 HB3 ALA A 43 1.534 -15.963 0.814 1.00 0.00 H new ATOM 316 N THR A 44 2.922 -16.070 -1.513 1.00 0.00 N ATOM 317 CA THR A 44 2.947 -16.474 -2.909 1.00 0.00 C ATOM 318 C THR A 44 4.192 -15.918 -3.603 1.00 0.00 C ATOM 319 O THR A 44 4.663 -16.484 -4.588 1.00 0.00 O ATOM 320 CB THR A 44 1.637 -16.021 -3.556 1.00 0.00 C ATOM 321 OG1 THR A 44 1.880 -16.144 -4.955 1.00 0.00 O ATOM 322 CG2 THR A 44 1.369 -14.528 -3.353 1.00 0.00 C ATOM 0 H THR A 44 2.152 -15.450 -1.262 1.00 0.00 H new ATOM 0 HA THR A 44 3.016 -17.557 -3.006 1.00 0.00 H new ATOM 0 HB THR A 44 0.809 -16.597 -3.142 1.00 0.00 H new ATOM 0 HG1 THR A 44 1.080 -15.872 -5.451 1.00 0.00 H new ATOM 0 HG21 THR A 44 0.427 -14.259 -3.832 1.00 0.00 H new ATOM 0 HG22 THR A 44 1.309 -14.311 -2.287 1.00 0.00 H new ATOM 0 HG23 THR A 44 2.180 -13.949 -3.796 1.00 0.00 H new ATOM 323 N LEU A 45 4.689 -14.815 -3.063 1.00 0.00 N ATOM 324 CA LEU A 45 5.869 -14.176 -3.617 1.00 0.00 C ATOM 325 C LEU A 45 7.086 -15.076 -3.390 1.00 0.00 C ATOM 326 O LEU A 45 7.944 -15.197 -4.262 1.00 0.00 O ATOM 327 CB LEU A 45 6.033 -12.765 -3.048 1.00 0.00 C ATOM 328 CG LEU A 45 5.027 -11.722 -3.540 1.00 0.00 C ATOM 329 CD1 LEU A 45 5.726 -10.402 -3.874 1.00 0.00 C ATOM 330 CD2 LEU A 45 4.217 -12.257 -4.722 1.00 0.00 C ATOM 0 H LEU A 45 4.295 -14.348 -2.247 1.00 0.00 H new ATOM 0 HA LEU A 45 5.762 -14.049 -4.694 1.00 0.00 H new ATOM 0 HB2 LEU A 45 5.965 -12.823 -1.962 1.00 0.00 H new ATOM 0 HB3 LEU A 45 7.037 -12.413 -3.286 1.00 0.00 H new ATOM 0 HG LEU A 45 4.323 -11.519 -2.733 1.00 0.00 H new ATOM 0 HD11 LEU A 45 4.989 -9.678 -4.221 1.00 0.00 H new ATOM 0 HD12 LEU A 45 6.221 -10.017 -2.983 1.00 0.00 H new ATOM 0 HD13 LEU A 45 6.466 -10.570 -4.656 1.00 0.00 H new ATOM 0 HD21 LEU A 45 3.510 -11.496 -5.052 1.00 0.00 H new ATOM 0 HD22 LEU A 45 4.891 -12.506 -5.542 1.00 0.00 H new ATOM 0 HD23 LEU A 45 3.673 -13.150 -4.415 1.00 0.00 H new ATOM 331 N CYS A 46 7.121 -15.682 -2.213 1.00 0.00 N ATOM 332 CA CYS A 46 8.218 -16.568 -1.859 1.00 0.00 C ATOM 333 C CYS A 46 8.142 -17.807 -2.753 1.00 0.00 C ATOM 334 O CYS A 46 9.079 -18.103 -3.492 1.00 0.00 O ATOM 335 CB CYS A 46 8.195 -16.933 -0.373 1.00 0.00 C ATOM 336 SG CYS A 46 9.802 -17.480 0.308 1.00 0.00 S ATOM 0 H CYS A 46 6.408 -15.577 -1.492 1.00 0.00 H new ATOM 0 HA CYS A 46 9.168 -16.059 -2.025 1.00 0.00 H new ATOM 0 HB2 CYS A 46 7.852 -16.068 0.194 1.00 0.00 H new ATOM 0 HB3 CYS A 46 7.463 -17.726 -0.219 1.00 0.00 H new ATOM 337 N THR A 47 7.016 -18.499 -2.656 1.00 0.00 N ATOM 338 CA THR A 47 6.805 -19.700 -3.446 1.00 0.00 C ATOM 339 C THR A 47 7.010 -19.403 -4.933 1.00 0.00 C ATOM 340 O THR A 47 7.226 -20.317 -5.729 1.00 0.00 O ATOM 341 CB THR A 47 5.411 -20.242 -3.122 1.00 0.00 C ATOM 342 OG1 THR A 47 5.509 -20.658 -1.762 1.00 0.00 O ATOM 343 CG2 THR A 47 5.091 -21.529 -3.884 1.00 0.00 C ATOM 0 H THR A 47 6.240 -18.251 -2.042 1.00 0.00 H new ATOM 0 HA THR A 47 7.535 -20.470 -3.196 1.00 0.00 H new ATOM 0 HB THR A 47 4.663 -19.486 -3.359 1.00 0.00 H new ATOM 0 HG1 THR A 47 4.648 -21.022 -1.468 1.00 0.00 H new ATOM 0 HG21 THR A 47 4.091 -21.871 -3.617 1.00 0.00 H new ATOM 0 HG22 THR A 47 5.135 -21.338 -4.956 1.00 0.00 H new ATOM 0 HG23 THR A 47 5.819 -22.297 -3.622 1.00 0.00 H new ATOM 344 N LYS A 48 6.936 -18.122 -5.264 1.00 0.00 N ATOM 345 CA LYS A 48 7.111 -17.693 -6.641 1.00 0.00 C ATOM 346 C LYS A 48 8.555 -17.953 -7.072 1.00 0.00 C ATOM 347 O LYS A 48 8.797 -18.611 -8.083 1.00 0.00 O ATOM 348 CB LYS A 48 6.672 -16.237 -6.808 1.00 0.00 C ATOM 349 CG LYS A 48 5.332 -16.149 -7.542 1.00 0.00 C ATOM 350 CD LYS A 48 5.432 -16.764 -8.940 1.00 0.00 C ATOM 351 CE LYS A 48 4.217 -17.644 -9.240 1.00 0.00 C ATOM 352 NZ LYS A 48 4.616 -19.066 -9.333 1.00 0.00 N ATOM 0 H LYS A 48 6.757 -17.367 -4.602 1.00 0.00 H new ATOM 0 HA LYS A 48 6.471 -18.273 -7.305 1.00 0.00 H new ATOM 0 HB2 LYS A 48 6.586 -15.765 -5.829 1.00 0.00 H new ATOM 0 HB3 LYS A 48 7.431 -15.686 -7.363 1.00 0.00 H new ATOM 0 HG2 LYS A 48 4.564 -16.666 -6.967 1.00 0.00 H new ATOM 0 HG3 LYS A 48 5.024 -15.106 -7.620 1.00 0.00 H new ATOM 0 HD2 LYS A 48 5.505 -15.972 -9.685 1.00 0.00 H new ATOM 0 HD3 LYS A 48 6.343 -17.358 -9.016 1.00 0.00 H new ATOM 0 HE2 LYS A 48 3.469 -17.521 -8.457 1.00 0.00 H new ATOM 0 HE3 LYS A 48 3.754 -17.328 -10.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 3.795 -19.671 -9.130 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 4.965 -19.267 -10.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 5.369 -19.261 -8.642 1.00 0.00 H new ATOM 353 N VAL A 49 9.479 -17.422 -6.283 1.00 0.00 N ATOM 354 CA VAL A 49 10.894 -17.589 -6.571 1.00 0.00 C ATOM 355 C VAL A 49 11.210 -19.079 -6.710 1.00 0.00 C ATOM 356 O VAL A 49 11.918 -19.484 -7.629 1.00 0.00 O ATOM 357 CB VAL A 49 11.732 -16.897 -5.494 1.00 0.00 C ATOM 358 CG1 VAL A 49 13.151 -17.467 -5.453 1.00 0.00 C ATOM 359 CG2 VAL A 49 11.755 -15.381 -5.706 1.00 0.00 C ATOM 0 H VAL A 49 9.275 -16.877 -5.446 1.00 0.00 H new ATOM 0 HA VAL A 49 11.150 -17.114 -7.518 1.00 0.00 H new ATOM 0 HB VAL A 49 11.265 -17.093 -4.529 1.00 0.00 H new ATOM 0 HG11 VAL A 49 13.725 -16.958 -4.679 1.00 0.00 H new ATOM 0 HG12 VAL A 49 13.109 -18.533 -5.231 1.00 0.00 H new ATOM 0 HG13 VAL A 49 13.632 -17.317 -6.420 1.00 0.00 H new ATOM 0 HG21 VAL A 49 12.357 -14.914 -4.927 1.00 0.00 H new ATOM 0 HG22 VAL A 49 12.186 -15.157 -6.682 1.00 0.00 H new ATOM 0 HG23 VAL A 49 10.738 -14.992 -5.661 1.00 0.00 H new ATOM 360 N LEU A 50 10.668 -19.855 -5.781 1.00 0.00 N ATOM 361 CA LEU A 50 10.884 -21.292 -5.788 1.00 0.00 C ATOM 362 C LEU A 50 10.314 -21.882 -7.079 1.00 0.00 C ATOM 363 O LEU A 50 10.987 -22.649 -7.766 1.00 0.00 O ATOM 364 CB LEU A 50 10.313 -21.925 -4.518 1.00 0.00 C ATOM 365 CG LEU A 50 10.236 -21.013 -3.291 1.00 0.00 C ATOM 366 CD1 LEU A 50 9.716 -21.779 -2.071 1.00 0.00 C ATOM 367 CD2 LEU A 50 11.584 -20.345 -3.018 1.00 0.00 C ATOM 0 H LEU A 50 10.080 -19.515 -5.020 1.00 0.00 H new ATOM 0 HA LEU A 50 11.950 -21.518 -5.777 1.00 0.00 H new ATOM 0 HB2 LEU A 50 9.310 -22.291 -4.737 1.00 0.00 H new ATOM 0 HB3 LEU A 50 10.921 -22.793 -4.263 1.00 0.00 H new ATOM 0 HG LEU A 50 9.521 -20.217 -3.501 1.00 0.00 H new ATOM 0 HD11 LEU A 50 9.671 -21.109 -1.213 1.00 0.00 H new ATOM 0 HD12 LEU A 50 8.719 -22.166 -2.282 1.00 0.00 H new ATOM 0 HD13 LEU A 50 10.388 -22.608 -1.849 1.00 0.00 H new ATOM 0 HD21 LEU A 50 11.501 -19.703 -2.141 1.00 0.00 H new ATOM 0 HD22 LEU A 50 12.339 -21.110 -2.837 1.00 0.00 H new ATOM 0 HD23 LEU A 50 11.874 -19.745 -3.881 1.00 0.00 H new ATOM 368 N ASP A 51 9.078 -21.503 -7.371 1.00 0.00 N ATOM 369 CA ASP A 51 8.410 -21.986 -8.567 1.00 0.00 C ATOM 370 C ASP A 51 9.259 -21.644 -9.793 1.00 0.00 C ATOM 371 O ASP A 51 9.314 -22.417 -10.749 1.00 0.00 O ATOM 372 CB ASP A 51 7.042 -21.322 -8.740 1.00 0.00 C ATOM 373 CG ASP A 51 6.106 -22.018 -9.730 1.00 0.00 C ATOM 374 OD1 ASP A 51 6.326 -23.226 -9.967 1.00 0.00 O ATOM 375 OD2 ASP A 51 5.192 -21.326 -10.228 1.00 0.00 O ATOM 0 H ASP A 51 8.522 -20.867 -6.799 1.00 0.00 H new ATOM 0 HA ASP A 51 8.278 -23.063 -8.468 1.00 0.00 H new ATOM 0 HB2 ASP A 51 6.551 -21.278 -7.768 1.00 0.00 H new ATOM 0 HB3 ASP A 51 7.193 -20.293 -9.068 1.00 0.00 H new ATOM 376 N PHE A 52 9.900 -20.487 -9.726 1.00 0.00 N ATOM 377 CA PHE A 52 10.744 -20.035 -10.819 1.00 0.00 C ATOM 378 C PHE A 52 12.104 -20.735 -10.788 1.00 0.00 C ATOM 379 O PHE A 52 12.499 -21.374 -11.762 1.00 0.00 O ATOM 380 CB PHE A 52 10.954 -18.532 -10.628 1.00 0.00 C ATOM 381 CG PHE A 52 11.857 -17.890 -11.684 1.00 0.00 C ATOM 382 CD1 PHE A 52 11.505 -17.932 -12.997 1.00 0.00 C ATOM 383 CD2 PHE A 52 13.013 -17.279 -11.309 1.00 0.00 C ATOM 384 CE1 PHE A 52 12.344 -17.337 -13.976 1.00 0.00 C ATOM 385 CE2 PHE A 52 13.852 -16.685 -12.288 1.00 0.00 C ATOM 386 CZ PHE A 52 13.499 -16.725 -13.601 1.00 0.00 C ATOM 0 H PHE A 52 9.852 -19.849 -8.932 1.00 0.00 H new ATOM 0 HA PHE A 52 10.270 -20.263 -11.774 1.00 0.00 H new ATOM 0 HB2 PHE A 52 9.984 -18.035 -10.644 1.00 0.00 H new ATOM 0 HB3 PHE A 52 11.385 -18.358 -9.642 1.00 0.00 H new ATOM 0 HD1 PHE A 52 10.588 -18.418 -13.295 1.00 0.00 H new ATOM 0 HD2 PHE A 52 13.293 -17.246 -10.266 1.00 0.00 H new ATOM 0 HE1 PHE A 52 12.065 -17.371 -15.019 1.00 0.00 H new ATOM 0 HE2 PHE A 52 14.771 -16.201 -11.990 1.00 0.00 H new ATOM 0 HZ PHE A 52 14.136 -16.271 -14.346 1.00 0.00 H new ATOM 387 N GLY A 53 12.782 -20.591 -9.659 1.00 0.00 N ATOM 388 CA GLY A 53 14.089 -21.203 -9.489 1.00 0.00 C ATOM 389 C GLY A 53 15.116 -20.176 -9.007 1.00 0.00 C ATOM 390 O GLY A 53 15.552 -19.321 -9.776 1.00 0.00 O ATOM 0 H GLY A 53 12.451 -20.060 -8.853 1.00 0.00 H new ATOM 0 HA2 GLY A 53 14.021 -22.020 -8.771 1.00 0.00 H new ATOM 0 HA3 GLY A 53 14.418 -21.636 -10.434 1.00 0.00 H new ATOM 391 N ILE A 54 15.473 -20.295 -7.737 1.00 0.00 N ATOM 392 CA ILE A 54 16.441 -19.388 -7.144 1.00 0.00 C ATOM 393 C ILE A 54 17.642 -19.246 -8.081 1.00 0.00 C ATOM 394 O ILE A 54 18.191 -18.156 -8.232 1.00 0.00 O ATOM 395 CB ILE A 54 16.812 -19.848 -5.733 1.00 0.00 C ATOM 396 CG1 ILE A 54 15.613 -20.491 -5.033 1.00 0.00 C ATOM 397 CG2 ILE A 54 17.402 -18.696 -4.917 1.00 0.00 C ATOM 398 CD1 ILE A 54 15.738 -22.016 -5.021 1.00 0.00 C ATOM 0 H ILE A 54 15.109 -21.006 -7.102 1.00 0.00 H new ATOM 0 HA ILE A 54 16.009 -18.394 -7.027 1.00 0.00 H new ATOM 0 HB ILE A 54 17.585 -20.612 -5.816 1.00 0.00 H new ATOM 0 HG12 ILE A 54 15.543 -20.120 -4.010 1.00 0.00 H new ATOM 0 HG13 ILE A 54 14.693 -20.202 -5.541 1.00 0.00 H new ATOM 0 HG21 ILE A 54 17.657 -19.051 -3.918 1.00 0.00 H new ATOM 0 HG22 ILE A 54 18.300 -18.323 -5.410 1.00 0.00 H new ATOM 0 HG23 ILE A 54 16.670 -17.892 -4.841 1.00 0.00 H new ATOM 0 HD11 ILE A 54 14.873 -22.448 -4.518 1.00 0.00 H new ATOM 0 HD12 ILE A 54 15.784 -22.385 -6.045 1.00 0.00 H new ATOM 0 HD13 ILE A 54 16.647 -22.302 -4.491 1.00 0.00 H new ATOM 399 N ASP A 55 18.016 -20.365 -8.685 1.00 0.00 N ATOM 400 CA ASP A 55 19.142 -20.380 -9.603 1.00 0.00 C ATOM 401 C ASP A 55 18.803 -19.535 -10.834 1.00 0.00 C ATOM 402 O ASP A 55 19.669 -18.856 -11.383 1.00 0.00 O ATOM 403 CB ASP A 55 19.449 -21.802 -10.076 1.00 0.00 C ATOM 404 CG ASP A 55 20.501 -22.545 -9.251 1.00 0.00 C ATOM 405 OD1 ASP A 55 20.637 -22.196 -8.058 1.00 0.00 O ATOM 406 OD2 ASP A 55 21.145 -23.445 -9.831 1.00 0.00 O ATOM 0 H ASP A 55 17.559 -21.268 -8.556 1.00 0.00 H new ATOM 0 HA ASP A 55 20.009 -19.980 -9.078 1.00 0.00 H new ATOM 0 HB2 ASP A 55 18.525 -22.380 -10.064 1.00 0.00 H new ATOM 0 HB3 ASP A 55 19.785 -21.760 -11.112 1.00 0.00 H new ATOM 407 N LYS A 56 17.540 -19.604 -11.229 1.00 0.00 N ATOM 408 CA LYS A 56 17.076 -18.855 -12.384 1.00 0.00 C ATOM 409 C LYS A 56 17.257 -17.358 -12.121 1.00 0.00 C ATOM 410 O LYS A 56 17.893 -16.659 -12.908 1.00 0.00 O ATOM 411 CB LYS A 56 15.641 -19.249 -12.738 1.00 0.00 C ATOM 412 CG LYS A 56 15.504 -20.768 -12.861 1.00 0.00 C ATOM 413 CD LYS A 56 15.603 -21.210 -14.323 1.00 0.00 C ATOM 414 CE LYS A 56 16.570 -22.387 -14.474 1.00 0.00 C ATOM 415 NZ LYS A 56 15.897 -23.527 -15.138 1.00 0.00 N ATOM 0 H LYS A 56 16.824 -20.167 -10.770 1.00 0.00 H new ATOM 0 HA LYS A 56 17.674 -19.100 -13.262 1.00 0.00 H new ATOM 0 HB2 LYS A 56 14.959 -18.880 -11.972 1.00 0.00 H new ATOM 0 HB3 LYS A 56 15.352 -18.777 -13.677 1.00 0.00 H new ATOM 0 HG2 LYS A 56 16.284 -21.256 -12.276 1.00 0.00 H new ATOM 0 HG3 LYS A 56 14.548 -21.086 -12.445 1.00 0.00 H new ATOM 0 HD2 LYS A 56 14.617 -21.496 -14.688 1.00 0.00 H new ATOM 0 HD3 LYS A 56 15.941 -20.375 -14.937 1.00 0.00 H new ATOM 0 HE2 LYS A 56 17.438 -22.080 -15.057 1.00 0.00 H new ATOM 0 HE3 LYS A 56 16.936 -22.693 -13.494 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 16.566 -24.318 -15.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 15.082 -23.830 -14.567 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 15.569 -23.235 -16.081 1.00 0.00 H new ATOM 416 N LEU A 57 16.684 -16.911 -11.013 1.00 0.00 N ATOM 417 CA LEU A 57 16.774 -15.512 -10.637 1.00 0.00 C ATOM 418 C LEU A 57 18.217 -15.033 -10.806 1.00 0.00 C ATOM 419 O LEU A 57 18.455 -13.931 -11.298 1.00 0.00 O ATOM 420 CB LEU A 57 16.218 -15.298 -9.227 1.00 0.00 C ATOM 421 CG LEU A 57 14.726 -14.968 -9.138 1.00 0.00 C ATOM 422 CD1 LEU A 57 13.977 -16.029 -8.330 1.00 0.00 C ATOM 423 CD2 LEU A 57 14.510 -13.561 -8.576 1.00 0.00 C ATOM 0 H LEU A 57 16.156 -17.494 -10.364 1.00 0.00 H new ATOM 0 HA LEU A 57 16.156 -14.902 -11.296 1.00 0.00 H new ATOM 0 HB2 LEU A 57 16.406 -16.199 -8.643 1.00 0.00 H new ATOM 0 HB3 LEU A 57 16.778 -14.490 -8.756 1.00 0.00 H new ATOM 0 HG LEU A 57 14.312 -14.980 -10.146 1.00 0.00 H new ATOM 0 HD11 LEU A 57 12.919 -15.770 -8.282 1.00 0.00 H new ATOM 0 HD12 LEU A 57 14.092 -17.001 -8.811 1.00 0.00 H new ATOM 0 HD13 LEU A 57 14.386 -16.073 -7.320 1.00 0.00 H new ATOM 0 HD21 LEU A 57 13.442 -13.351 -8.523 1.00 0.00 H new ATOM 0 HD22 LEU A 57 14.943 -13.498 -7.578 1.00 0.00 H new ATOM 0 HD23 LEU A 57 14.992 -12.831 -9.227 1.00 0.00 H new ATOM 424 N ILE A 58 19.142 -15.886 -10.391 1.00 0.00 N ATOM 425 CA ILE A 58 20.555 -15.564 -10.491 1.00 0.00 C ATOM 426 C ILE A 58 20.979 -15.597 -11.961 1.00 0.00 C ATOM 427 O ILE A 58 21.825 -14.812 -12.385 1.00 0.00 O ATOM 428 CB ILE A 58 21.380 -16.488 -9.593 1.00 0.00 C ATOM 429 CG1 ILE A 58 21.034 -16.270 -8.119 1.00 0.00 C ATOM 430 CG2 ILE A 58 22.877 -16.320 -9.861 1.00 0.00 C ATOM 431 CD1 ILE A 58 21.397 -14.852 -7.673 1.00 0.00 C ATOM 0 H ILE A 58 18.940 -16.800 -9.985 1.00 0.00 H new ATOM 0 HA ILE A 58 20.742 -14.554 -10.127 1.00 0.00 H new ATOM 0 HB ILE A 58 21.123 -17.519 -9.836 1.00 0.00 H new ATOM 0 HG12 ILE A 58 19.969 -16.443 -7.963 1.00 0.00 H new ATOM 0 HG13 ILE A 58 21.568 -16.996 -7.506 1.00 0.00 H new ATOM 0 HG21 ILE A 58 23.440 -16.988 -9.210 1.00 0.00 H new ATOM 0 HG22 ILE A 58 23.090 -16.563 -10.902 1.00 0.00 H new ATOM 0 HG23 ILE A 58 23.169 -15.289 -9.663 1.00 0.00 H new ATOM 0 HD11 ILE A 58 21.140 -14.724 -6.621 1.00 0.00 H new ATOM 0 HD12 ILE A 58 22.467 -14.691 -7.808 1.00 0.00 H new ATOM 0 HD13 ILE A 58 20.843 -14.129 -8.272 1.00 0.00 H new ATOM 432 N GLN A 59 20.369 -16.514 -12.699 1.00 0.00 N ATOM 433 CA GLN A 59 20.672 -16.659 -14.112 1.00 0.00 C ATOM 434 C GLN A 59 20.293 -15.386 -14.871 1.00 0.00 C ATOM 435 O GLN A 59 20.982 -14.989 -15.809 1.00 0.00 O ATOM 436 CB GLN A 59 19.963 -17.880 -14.702 1.00 0.00 C ATOM 437 CG GLN A 59 20.857 -19.120 -14.633 1.00 0.00 C ATOM 438 CD GLN A 59 20.036 -20.399 -14.816 1.00 0.00 C ATOM 439 OE1 GLN A 59 19.115 -20.687 -14.071 1.00 0.00 O ATOM 440 NE2 GLN A 59 20.421 -21.145 -15.848 1.00 0.00 N ATOM 0 H GLN A 59 19.667 -17.163 -12.344 1.00 0.00 H new ATOM 0 HA GLN A 59 21.745 -16.815 -14.218 1.00 0.00 H new ATOM 0 HB2 GLN A 59 19.036 -18.065 -14.159 1.00 0.00 H new ATOM 0 HB3 GLN A 59 19.690 -17.681 -15.738 1.00 0.00 H new ATOM 0 HG2 GLN A 59 21.625 -19.063 -15.405 1.00 0.00 H new ATOM 0 HG3 GLN A 59 21.372 -19.148 -13.673 1.00 0.00 H new ATOM 0 HE21 GLN A 59 21.201 -20.844 -16.432 1.00 0.00 H new ATOM 0 HE22 GLN A 59 19.936 -22.018 -16.055 1.00 0.00 H new ATOM 441 N LEU A 60 19.199 -14.780 -14.435 1.00 0.00 N ATOM 442 CA LEU A 60 18.720 -13.558 -15.061 1.00 0.00 C ATOM 443 C LEU A 60 19.741 -12.441 -14.836 1.00 0.00 C ATOM 444 O LEU A 60 20.265 -11.873 -15.793 1.00 0.00 O ATOM 445 CB LEU A 60 17.314 -13.217 -14.563 1.00 0.00 C ATOM 446 CG LEU A 60 16.277 -14.337 -14.661 1.00 0.00 C ATOM 447 CD1 LEU A 60 14.856 -13.769 -14.666 1.00 0.00 C ATOM 448 CD2 LEU A 60 16.544 -15.227 -15.877 1.00 0.00 C ATOM 0 H LEU A 60 18.630 -15.112 -13.656 1.00 0.00 H new ATOM 0 HA LEU A 60 18.627 -13.692 -16.139 1.00 0.00 H new ATOM 0 HB2 LEU A 60 17.385 -12.905 -13.521 1.00 0.00 H new ATOM 0 HB3 LEU A 60 16.948 -12.360 -15.128 1.00 0.00 H new ATOM 0 HG LEU A 60 16.369 -14.967 -13.776 1.00 0.00 H new ATOM 0 HD11 LEU A 60 14.138 -14.586 -14.736 1.00 0.00 H new ATOM 0 HD12 LEU A 60 14.683 -13.213 -13.745 1.00 0.00 H new ATOM 0 HD13 LEU A 60 14.733 -13.103 -15.520 1.00 0.00 H new ATOM 0 HD21 LEU A 60 15.792 -16.015 -15.923 1.00 0.00 H new ATOM 0 HD22 LEU A 60 16.496 -14.626 -16.785 1.00 0.00 H new ATOM 0 HD23 LEU A 60 17.534 -15.675 -15.790 1.00 0.00 H new ATOM 449 N ILE A 61 19.992 -12.159 -13.567 1.00 0.00 N ATOM 450 CA ILE A 61 20.941 -11.121 -13.204 1.00 0.00 C ATOM 451 C ILE A 61 22.221 -11.295 -14.024 1.00 0.00 C ATOM 452 O ILE A 61 22.783 -10.320 -14.520 1.00 0.00 O ATOM 453 CB ILE A 61 21.175 -11.111 -11.693 1.00 0.00 C ATOM 454 CG1 ILE A 61 20.803 -9.757 -11.087 1.00 0.00 C ATOM 455 CG2 ILE A 61 22.613 -11.513 -11.357 1.00 0.00 C ATOM 456 CD1 ILE A 61 20.123 -9.932 -9.728 1.00 0.00 C ATOM 0 H ILE A 61 19.554 -12.632 -12.776 1.00 0.00 H new ATOM 0 HA ILE A 61 20.539 -10.137 -13.446 1.00 0.00 H new ATOM 0 HB ILE A 61 20.518 -11.856 -11.243 1.00 0.00 H new ATOM 0 HG12 ILE A 61 21.699 -9.147 -10.973 1.00 0.00 H new ATOM 0 HG13 ILE A 61 20.137 -9.222 -11.764 1.00 0.00 H new ATOM 0 HG21 ILE A 61 22.752 -11.498 -10.276 1.00 0.00 H new ATOM 0 HG22 ILE A 61 22.807 -12.517 -11.734 1.00 0.00 H new ATOM 0 HG23 ILE A 61 23.305 -10.811 -11.822 1.00 0.00 H new ATOM 0 HD11 ILE A 61 19.869 -8.954 -9.320 1.00 0.00 H new ATOM 0 HD12 ILE A 61 19.214 -10.522 -9.849 1.00 0.00 H new ATOM 0 HD13 ILE A 61 20.800 -10.445 -9.046 1.00 0.00 H new ATOM 457 N GLU A 62 22.644 -12.546 -14.140 1.00 0.00 N ATOM 458 CA GLU A 62 23.847 -12.862 -14.891 1.00 0.00 C ATOM 459 C GLU A 62 23.782 -12.237 -16.286 1.00 0.00 C ATOM 460 O GLU A 62 24.782 -11.727 -16.790 1.00 0.00 O ATOM 461 CB GLU A 62 24.058 -14.375 -14.977 1.00 0.00 C ATOM 462 CG GLU A 62 24.808 -14.894 -13.749 1.00 0.00 C ATOM 463 CD GLU A 62 26.228 -15.328 -14.116 1.00 0.00 C ATOM 464 OE1 GLU A 62 27.028 -14.428 -14.452 1.00 0.00 O ATOM 465 OE2 GLU A 62 26.484 -16.550 -14.053 1.00 0.00 O ATOM 0 H GLU A 62 22.175 -13.352 -13.727 1.00 0.00 H new ATOM 0 HA GLU A 62 24.702 -12.438 -14.364 1.00 0.00 H new ATOM 0 HB2 GLU A 62 23.094 -14.876 -15.057 1.00 0.00 H new ATOM 0 HB3 GLU A 62 24.619 -14.617 -15.880 1.00 0.00 H new ATOM 0 HG2 GLU A 62 24.847 -14.116 -12.987 1.00 0.00 H new ATOM 0 HG3 GLU A 62 24.267 -15.736 -13.317 1.00 0.00 H new ATOM 466 N ASP A 63 22.594 -12.296 -16.871 1.00 0.00 N ATOM 467 CA ASP A 63 22.386 -11.741 -18.197 1.00 0.00 C ATOM 468 C ASP A 63 22.298 -10.216 -18.101 1.00 0.00 C ATOM 469 O ASP A 63 23.149 -9.507 -18.634 1.00 0.00 O ATOM 470 CB ASP A 63 21.079 -12.252 -18.809 1.00 0.00 C ATOM 471 CG ASP A 63 21.114 -12.469 -20.322 1.00 0.00 C ATOM 472 OD1 ASP A 63 21.919 -13.323 -20.755 1.00 0.00 O ATOM 473 OD2 ASP A 63 20.336 -11.776 -21.013 1.00 0.00 O ATOM 0 H ASP A 63 21.767 -12.719 -16.451 1.00 0.00 H new ATOM 0 HA ASP A 63 23.223 -12.047 -18.825 1.00 0.00 H new ATOM 0 HB2 ASP A 63 20.814 -13.194 -18.328 1.00 0.00 H new ATOM 0 HB3 ASP A 63 20.285 -11.542 -18.577 1.00 0.00 H new ATOM 474 N LYS A 64 21.260 -9.758 -17.416 1.00 0.00 N ATOM 475 CA LYS A 64 21.050 -8.330 -17.243 1.00 0.00 C ATOM 476 C LYS A 64 19.586 -8.075 -16.881 1.00 0.00 C ATOM 477 O LYS A 64 18.839 -7.499 -17.670 1.00 0.00 O ATOM 478 CB LYS A 64 21.520 -7.566 -18.483 1.00 0.00 C ATOM 479 CG LYS A 64 20.837 -6.199 -18.574 1.00 0.00 C ATOM 480 CD LYS A 64 21.836 -5.115 -18.985 1.00 0.00 C ATOM 481 CE LYS A 64 22.463 -4.453 -17.756 1.00 0.00 C ATOM 482 NZ LYS A 64 21.815 -3.151 -17.480 1.00 0.00 N ATOM 0 H LYS A 64 20.556 -10.350 -16.975 1.00 0.00 H new ATOM 0 HA LYS A 64 21.653 -7.953 -16.417 1.00 0.00 H new ATOM 0 HB2 LYS A 64 22.601 -7.435 -18.446 1.00 0.00 H new ATOM 0 HB3 LYS A 64 21.300 -8.147 -19.378 1.00 0.00 H new ATOM 0 HG2 LYS A 64 20.023 -6.242 -19.298 1.00 0.00 H new ATOM 0 HG3 LYS A 64 20.394 -5.945 -17.611 1.00 0.00 H new ATOM 0 HD2 LYS A 64 22.618 -5.553 -19.606 1.00 0.00 H new ATOM 0 HD3 LYS A 64 21.332 -4.362 -19.591 1.00 0.00 H new ATOM 0 HE2 LYS A 64 22.360 -5.108 -16.891 1.00 0.00 H new ATOM 0 HE3 LYS A 64 23.531 -4.307 -17.919 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 22.253 -2.716 -16.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 21.935 -2.523 -18.300 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 20.801 -3.299 -17.303 1.00 0.00 H new ATOM 483 N VAL A 65 19.220 -8.516 -15.685 1.00 0.00 N ATOM 484 CA VAL A 65 17.858 -8.342 -15.209 1.00 0.00 C ATOM 485 C VAL A 65 17.883 -7.635 -13.852 1.00 0.00 C ATOM 486 O VAL A 65 18.283 -8.225 -12.849 1.00 0.00 O ATOM 487 CB VAL A 65 17.142 -9.693 -15.167 1.00 0.00 C ATOM 488 CG1 VAL A 65 15.650 -9.515 -14.885 1.00 0.00 C ATOM 489 CG2 VAL A 65 17.366 -10.474 -16.463 1.00 0.00 C ATOM 0 H VAL A 65 19.843 -8.993 -15.033 1.00 0.00 H new ATOM 0 HA VAL A 65 17.292 -7.711 -15.894 1.00 0.00 H new ATOM 0 HB VAL A 65 17.570 -10.273 -14.349 1.00 0.00 H new ATOM 0 HG11 VAL A 65 15.165 -10.491 -14.861 1.00 0.00 H new ATOM 0 HG12 VAL A 65 15.518 -9.020 -13.923 1.00 0.00 H new ATOM 0 HG13 VAL A 65 15.201 -8.907 -15.670 1.00 0.00 H new ATOM 0 HG21 VAL A 65 16.846 -11.430 -16.406 1.00 0.00 H new ATOM 0 HG22 VAL A 65 16.979 -9.900 -17.305 1.00 0.00 H new ATOM 0 HG23 VAL A 65 18.433 -10.649 -16.603 1.00 0.00 H new ATOM 490 N ASP A 66 17.453 -6.383 -13.865 1.00 0.00 N ATOM 491 CA ASP A 66 17.422 -5.590 -12.648 1.00 0.00 C ATOM 492 C ASP A 66 16.718 -6.384 -11.545 1.00 0.00 C ATOM 493 O ASP A 66 16.312 -7.525 -11.760 1.00 0.00 O ATOM 494 CB ASP A 66 16.648 -4.287 -12.860 1.00 0.00 C ATOM 495 CG ASP A 66 16.853 -3.627 -14.225 1.00 0.00 C ATOM 496 OD1 ASP A 66 16.185 -4.079 -15.180 1.00 0.00 O ATOM 497 OD2 ASP A 66 17.674 -2.685 -14.282 1.00 0.00 O ATOM 0 H ASP A 66 17.123 -5.897 -14.699 1.00 0.00 H new ATOM 0 HA ASP A 66 18.450 -5.358 -12.370 1.00 0.00 H new ATOM 0 HB2 ASP A 66 15.585 -4.488 -12.726 1.00 0.00 H new ATOM 0 HB3 ASP A 66 16.939 -3.579 -12.084 1.00 0.00 H new ATOM 498 N ALA A 67 16.595 -5.748 -10.390 1.00 0.00 N ATOM 499 CA ALA A 67 15.948 -6.381 -9.252 1.00 0.00 C ATOM 500 C ALA A 67 14.431 -6.346 -9.451 1.00 0.00 C ATOM 501 O ALA A 67 13.736 -7.306 -9.119 1.00 0.00 O ATOM 502 CB ALA A 67 16.383 -5.682 -7.963 1.00 0.00 C ATOM 0 H ALA A 67 16.932 -4.801 -10.217 1.00 0.00 H new ATOM 0 HA ALA A 67 16.247 -7.426 -9.172 1.00 0.00 H new ATOM 0 HB1 ALA A 67 15.898 -6.157 -7.110 1.00 0.00 H new ATOM 0 HB2 ALA A 67 17.465 -5.759 -7.854 1.00 0.00 H new ATOM 0 HB3 ALA A 67 16.097 -4.631 -8.005 1.00 0.00 H new ATOM 503 N ASN A 68 13.962 -5.232 -9.993 1.00 0.00 N ATOM 504 CA ASN A 68 12.540 -5.060 -10.239 1.00 0.00 C ATOM 505 C ASN A 68 12.141 -5.868 -11.475 1.00 0.00 C ATOM 506 O ASN A 68 11.068 -6.469 -11.509 1.00 0.00 O ATOM 507 CB ASN A 68 12.200 -3.593 -10.504 1.00 0.00 C ATOM 508 CG ASN A 68 11.315 -3.026 -9.392 1.00 0.00 C ATOM 509 OD1 ASN A 68 10.298 -3.591 -9.025 1.00 0.00 O ATOM 510 ND2 ASN A 68 11.756 -1.881 -8.879 1.00 0.00 N ATOM 0 H ASN A 68 14.541 -4.439 -10.269 1.00 0.00 H new ATOM 0 HA ASN A 68 12.001 -5.401 -9.355 1.00 0.00 H new ATOM 0 HB2 ASN A 68 13.118 -3.010 -10.576 1.00 0.00 H new ATOM 0 HB3 ASN A 68 11.689 -3.502 -11.463 1.00 0.00 H new ATOM 0 HD21 ASN A 68 11.234 -1.422 -8.132 1.00 0.00 H new ATOM 0 HD22 ASN A 68 12.616 -1.461 -9.233 1.00 0.00 H new ATOM 511 N ALA A 69 13.025 -5.857 -12.462 1.00 0.00 N ATOM 512 CA ALA A 69 12.778 -6.580 -13.697 1.00 0.00 C ATOM 513 C ALA A 69 12.635 -8.073 -13.389 1.00 0.00 C ATOM 514 O ALA A 69 11.860 -8.773 -14.038 1.00 0.00 O ATOM 515 CB ALA A 69 13.906 -6.297 -14.690 1.00 0.00 C ATOM 0 H ALA A 69 13.914 -5.358 -12.431 1.00 0.00 H new ATOM 0 HA ALA A 69 11.848 -6.246 -14.157 1.00 0.00 H new ATOM 0 HB1 ALA A 69 13.720 -6.840 -15.617 1.00 0.00 H new ATOM 0 HB2 ALA A 69 13.948 -5.228 -14.898 1.00 0.00 H new ATOM 0 HB3 ALA A 69 14.856 -6.621 -14.264 1.00 0.00 H new ATOM 516 N ILE A 70 13.395 -8.515 -12.397 1.00 0.00 N ATOM 517 CA ILE A 70 13.362 -9.911 -11.995 1.00 0.00 C ATOM 518 C ILE A 70 12.163 -10.144 -11.074 1.00 0.00 C ATOM 519 O ILE A 70 11.382 -11.070 -11.287 1.00 0.00 O ATOM 520 CB ILE A 70 14.701 -10.322 -11.379 1.00 0.00 C ATOM 521 CG1 ILE A 70 15.451 -11.292 -12.294 1.00 0.00 C ATOM 522 CG2 ILE A 70 14.505 -10.896 -9.974 1.00 0.00 C ATOM 523 CD1 ILE A 70 15.342 -12.728 -11.778 1.00 0.00 C ATOM 0 H ILE A 70 14.037 -7.931 -11.860 1.00 0.00 H new ATOM 0 HA ILE A 70 13.226 -10.555 -12.864 1.00 0.00 H new ATOM 0 HB ILE A 70 15.319 -9.430 -11.280 1.00 0.00 H new ATOM 0 HG12 ILE A 70 15.045 -11.233 -13.304 1.00 0.00 H new ATOM 0 HG13 ILE A 70 16.500 -11.002 -12.355 1.00 0.00 H new ATOM 0 HG21 ILE A 70 15.472 -11.180 -9.559 1.00 0.00 H new ATOM 0 HG22 ILE A 70 14.043 -10.144 -9.335 1.00 0.00 H new ATOM 0 HG23 ILE A 70 13.860 -11.773 -10.026 1.00 0.00 H new ATOM 0 HD11 ILE A 70 15.884 -13.397 -12.447 1.00 0.00 H new ATOM 0 HD12 ILE A 70 15.771 -12.789 -10.778 1.00 0.00 H new ATOM 0 HD13 ILE A 70 14.293 -13.023 -11.741 1.00 0.00 H new ATOM 524 N CYS A 71 12.055 -9.287 -10.068 1.00 0.00 N ATOM 525 CA CYS A 71 10.964 -9.389 -9.114 1.00 0.00 C ATOM 526 C CYS A 71 9.645 -9.270 -9.877 1.00 0.00 C ATOM 527 O CYS A 71 8.613 -9.761 -9.422 1.00 0.00 O ATOM 528 CB CYS A 71 11.081 -8.336 -8.009 1.00 0.00 C ATOM 529 SG CYS A 71 10.699 -8.946 -6.326 1.00 0.00 S ATOM 0 H CYS A 71 12.705 -8.520 -9.894 1.00 0.00 H new ATOM 0 HA CYS A 71 11.005 -10.356 -8.612 1.00 0.00 H new ATOM 0 HB2 CYS A 71 12.095 -7.935 -8.014 1.00 0.00 H new ATOM 0 HB3 CYS A 71 10.410 -7.509 -8.242 1.00 0.00 H new ATOM 530 N ALA A 72 9.719 -8.615 -11.027 1.00 0.00 N ATOM 531 CA ALA A 72 8.543 -8.426 -11.859 1.00 0.00 C ATOM 532 C ALA A 72 8.183 -9.751 -12.534 1.00 0.00 C ATOM 533 O ALA A 72 7.007 -10.093 -12.651 1.00 0.00 O ATOM 534 CB ALA A 72 8.807 -7.308 -12.871 1.00 0.00 C ATOM 0 H ALA A 72 10.576 -8.208 -11.402 1.00 0.00 H new ATOM 0 HA ALA A 72 7.689 -8.122 -11.253 1.00 0.00 H new ATOM 0 HB1 ALA A 72 7.925 -7.166 -13.495 1.00 0.00 H new ATOM 0 HB2 ALA A 72 9.029 -6.382 -12.341 1.00 0.00 H new ATOM 0 HB3 ALA A 72 9.656 -7.579 -13.499 1.00 0.00 H new ATOM 535 N LYS A 73 9.216 -10.459 -12.963 1.00 0.00 N ATOM 536 CA LYS A 73 9.025 -11.739 -13.625 1.00 0.00 C ATOM 537 C LYS A 73 8.118 -12.622 -12.764 1.00 0.00 C ATOM 538 O LYS A 73 6.955 -12.840 -13.103 1.00 0.00 O ATOM 539 CB LYS A 73 10.374 -12.380 -13.953 1.00 0.00 C ATOM 540 CG LYS A 73 10.257 -13.312 -15.162 1.00 0.00 C ATOM 541 CD LYS A 73 10.901 -14.670 -14.872 1.00 0.00 C ATOM 542 CE LYS A 73 11.889 -15.055 -15.975 1.00 0.00 C ATOM 543 NZ LYS A 73 11.225 -15.898 -16.994 1.00 0.00 N ATOM 0 H LYS A 73 10.190 -10.171 -12.865 1.00 0.00 H new ATOM 0 HA LYS A 73 8.523 -11.601 -14.583 1.00 0.00 H new ATOM 0 HB2 LYS A 73 11.110 -11.603 -14.158 1.00 0.00 H new ATOM 0 HB3 LYS A 73 10.734 -12.941 -13.090 1.00 0.00 H new ATOM 0 HG2 LYS A 73 9.207 -13.451 -15.418 1.00 0.00 H new ATOM 0 HG3 LYS A 73 10.738 -12.854 -16.026 1.00 0.00 H new ATOM 0 HD2 LYS A 73 11.417 -14.634 -13.913 1.00 0.00 H new ATOM 0 HD3 LYS A 73 10.127 -15.433 -14.789 1.00 0.00 H new ATOM 0 HE2 LYS A 73 12.289 -14.156 -16.443 1.00 0.00 H new ATOM 0 HE3 LYS A 73 12.733 -15.593 -15.544 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 11.909 -16.150 -17.735 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 10.864 -16.765 -16.546 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 10.434 -15.372 -17.418 1.00 0.00 H new ATOM 544 N ILE A 74 8.683 -13.104 -11.667 1.00 0.00 N ATOM 545 CA ILE A 74 7.940 -13.958 -10.756 1.00 0.00 C ATOM 546 C ILE A 74 6.682 -13.224 -10.289 1.00 0.00 C ATOM 547 O ILE A 74 5.807 -13.822 -9.663 1.00 0.00 O ATOM 548 CB ILE A 74 8.839 -14.429 -9.611 1.00 0.00 C ATOM 549 CG1 ILE A 74 9.929 -13.398 -9.310 1.00 0.00 C ATOM 550 CG2 ILE A 74 9.423 -15.813 -9.905 1.00 0.00 C ATOM 551 CD1 ILE A 74 11.253 -13.793 -9.968 1.00 0.00 C ATOM 0 H ILE A 74 9.647 -12.919 -11.388 1.00 0.00 H new ATOM 0 HA ILE A 74 7.610 -14.864 -11.265 1.00 0.00 H new ATOM 0 HB ILE A 74 8.228 -14.522 -8.713 1.00 0.00 H new ATOM 0 HG12 ILE A 74 9.617 -12.418 -9.671 1.00 0.00 H new ATOM 0 HG13 ILE A 74 10.066 -13.312 -8.232 1.00 0.00 H new ATOM 0 HG21 ILE A 74 10.058 -16.124 -9.075 1.00 0.00 H new ATOM 0 HG22 ILE A 74 8.612 -16.531 -10.030 1.00 0.00 H new ATOM 0 HG23 ILE A 74 10.015 -15.771 -10.819 1.00 0.00 H new ATOM 0 HD11 ILE A 74 12.011 -13.044 -9.739 1.00 0.00 H new ATOM 0 HD12 ILE A 74 11.574 -14.762 -9.587 1.00 0.00 H new ATOM 0 HD13 ILE A 74 11.119 -13.854 -11.048 1.00 0.00 H new ATOM 552 N HIS A 75 6.630 -11.940 -10.610 1.00 0.00 N ATOM 553 CA HIS A 75 5.494 -11.119 -10.231 1.00 0.00 C ATOM 554 C HIS A 75 5.456 -10.965 -8.709 1.00 0.00 C ATOM 555 O HIS A 75 4.583 -11.523 -8.046 1.00 0.00 O ATOM 556 CB HIS A 75 4.194 -11.692 -10.801 1.00 0.00 C ATOM 557 CG HIS A 75 2.959 -11.307 -10.022 1.00 0.00 C ATOM 558 ND1 HIS A 75 2.293 -10.110 -10.217 1.00 0.00 N ATOM 559 CD2 HIS A 75 2.276 -11.974 -9.047 1.00 0.00 C ATOM 560 CE1 HIS A 75 1.258 -10.068 -9.392 1.00 0.00 C ATOM 561 NE2 HIS A 75 1.250 -11.224 -8.666 1.00 0.00 N ATOM 0 H HIS A 75 7.357 -11.448 -11.129 1.00 0.00 H new ATOM 0 HA HIS A 75 5.603 -10.123 -10.660 1.00 0.00 H new ATOM 0 HB2 HIS A 75 4.081 -11.354 -11.831 1.00 0.00 H new ATOM 0 HB3 HIS A 75 4.269 -12.779 -10.828 1.00 0.00 H new ATOM 0 HD2 HIS A 75 2.528 -12.947 -8.652 1.00 0.00 H new ATOM 0 HE1 HIS A 75 0.545 -9.261 -9.308 1.00 0.00 H new ATOM 0 HE2 HIS A 75 0.568 -11.471 -7.949 1.00 0.00 H new ATOM 562 N ALA A 76 6.414 -10.206 -8.200 1.00 0.00 N ATOM 563 CA ALA A 76 6.502 -9.972 -6.768 1.00 0.00 C ATOM 564 C ALA A 76 5.946 -8.583 -6.448 1.00 0.00 C ATOM 565 O ALA A 76 4.753 -8.434 -6.184 1.00 0.00 O ATOM 566 CB ALA A 76 7.952 -10.137 -6.311 1.00 0.00 C ATOM 0 H ALA A 76 7.136 -9.745 -8.753 1.00 0.00 H new ATOM 0 HA ALA A 76 5.903 -10.702 -6.223 1.00 0.00 H new ATOM 0 HB1 ALA A 76 8.017 -9.961 -5.237 1.00 0.00 H new ATOM 0 HB2 ALA A 76 8.291 -11.149 -6.535 1.00 0.00 H new ATOM 0 HB3 ALA A 76 8.583 -9.419 -6.835 1.00 0.00 H new ATOM 567 N CYS A 77 6.834 -7.602 -6.482 1.00 0.00 N ATOM 568 CA CYS A 77 6.447 -6.230 -6.198 1.00 0.00 C ATOM 569 C CYS A 77 5.155 -5.929 -6.961 1.00 0.00 C ATOM 570 O CYS A 77 5.149 -5.901 -8.190 1.00 0.00 O ATOM 571 CB CYS A 77 7.561 -5.243 -6.549 1.00 0.00 C ATOM 572 SG CYS A 77 9.230 -5.733 -5.980 1.00 0.00 S ATOM 0 H CYS A 77 7.822 -7.729 -6.702 1.00 0.00 H new ATOM 0 HA CYS A 77 6.273 -6.112 -5.128 1.00 0.00 H new ATOM 0 HB2 CYS A 77 7.585 -5.114 -7.631 1.00 0.00 H new ATOM 0 HB3 CYS A 77 7.316 -4.272 -6.118 1.00 0.00 H new TER 573 CYS A 77