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+ 140:sc= 0.00253 (180deg=0) USER MOD Single : A 6 ASN : amide:sc= -0.152 X(o=-0.15,f=-0.2) USER MOD Single : A 9 THR OG1 : rot 110:sc= -2.01 USER MOD Single : A 13 ASN : amide:sc= -1.25 K(o=-1.2,f=-3.8!) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc=-0.00553 X(o=-0.0055,f=-0.018) USER MOD Single : A 20 THR OG1 : rot -64:sc= 1.16 USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 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= -2.33 USER MOD Single : A 32 SER OG : rot 98:sc= 0.0779 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 36 ASN : amide:sc= -0.0277 X(o=-0.028,f=-0.087) USER MOD Single : A 37 LYS NZ :NH3+ 154:sc= -0.0255 (180deg=-0.3) USER MOD Single : A 39 SER OG : rot -56:sc= 0.114 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 GLN : amide:sc= -0.446 X(o=-0.45,f=-0.048) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 ASN : amide:sc= -1.45 K(o=-1.4,f=-2.1!) USER MOD Single : A 73 LYS NZ :NH3+ 170:sc= 0.0277 (180deg=0.000842) USER MOD Single : A 75 HIS : no HD1:sc= -1.22! C(o=-1.2!,f=-1.3!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 1.325 0.000 0.000 1.00 0.00 N ATOM 2 CA GLY A 1 2.073 0.000 -1.245 1.00 0.00 C ATOM 3 C GLY A 1 3.536 -0.379 -1.006 1.00 0.00 C ATOM 4 O GLY A 1 4.174 0.142 -0.092 1.00 0.00 O ATOM 0 H1 GLY A 1 0.669 0.807 0.011 1.00 0.00 H new ATOM 0 H2 GLY A 1 0.786 -0.886 0.081 1.00 0.00 H new ATOM 0 H3 GLY A 1 1.984 0.079 0.801 1.00 0.00 H new ATOM 0 HA2 GLY A 1 1.621 -0.703 -1.945 1.00 0.00 H new ATOM 0 HA3 GLY A 1 2.020 0.987 -1.705 1.00 0.00 H new ATOM 5 N GLU A 2 4.025 -1.282 -1.843 1.00 0.00 N ATOM 6 CA GLU A 2 5.401 -1.736 -1.734 1.00 0.00 C ATOM 7 C GLU A 2 5.533 -2.763 -0.607 1.00 0.00 C ATOM 8 O GLU A 2 6.372 -2.612 0.280 1.00 0.00 O ATOM 9 CB GLU A 2 6.352 -0.558 -1.516 1.00 0.00 C ATOM 10 CG GLU A 2 7.767 -0.900 -1.987 1.00 0.00 C ATOM 11 CD GLU A 2 8.293 0.158 -2.958 1.00 0.00 C ATOM 12 OE1 GLU A 2 7.466 0.667 -3.745 1.00 0.00 O ATOM 13 OE2 GLU A 2 9.510 0.434 -2.892 1.00 0.00 O ATOM 0 H GLU A 2 3.493 -1.712 -2.600 1.00 0.00 H new ATOM 0 HA GLU A 2 5.680 -2.216 -2.672 1.00 0.00 H new ATOM 0 HB2 GLU A 2 5.986 0.314 -2.057 1.00 0.00 H new ATOM 0 HB3 GLU A 2 6.371 -0.292 -0.459 1.00 0.00 H new ATOM 0 HG2 GLU A 2 8.433 -0.972 -1.127 1.00 0.00 H new ATOM 0 HG3 GLU A 2 7.766 -1.876 -2.472 1.00 0.00 H new ATOM 14 N ILE A 3 4.692 -3.784 -0.678 1.00 0.00 N ATOM 15 CA ILE A 3 4.704 -4.835 0.325 1.00 0.00 C ATOM 16 C ILE A 3 6.153 -5.208 0.648 1.00 0.00 C ATOM 17 O ILE A 3 6.715 -4.731 1.632 1.00 0.00 O ATOM 18 CB ILE A 3 3.851 -6.021 -0.131 1.00 0.00 C ATOM 19 CG1 ILE A 3 2.367 -5.651 -0.153 1.00 0.00 C ATOM 20 CG2 ILE A 3 4.122 -7.255 0.732 1.00 0.00 C ATOM 21 CD1 ILE A 3 1.511 -6.844 -0.586 1.00 0.00 C ATOM 0 H ILE A 3 3.997 -3.906 -1.415 1.00 0.00 H new ATOM 0 HA ILE A 3 4.250 -4.483 1.251 1.00 0.00 H new ATOM 0 HB ILE A 3 4.135 -6.274 -1.152 1.00 0.00 H new ATOM 0 HG12 ILE A 3 2.057 -5.317 0.837 1.00 0.00 H new ATOM 0 HG13 ILE A 3 2.207 -4.817 -0.836 1.00 0.00 H new ATOM 0 HG21 ILE A 3 3.503 -8.083 0.387 1.00 0.00 H new ATOM 0 HG22 ILE A 3 5.174 -7.530 0.653 1.00 0.00 H new ATOM 0 HG23 ILE A 3 3.882 -7.032 1.772 1.00 0.00 H new ATOM 0 HD11 ILE A 3 0.460 -6.554 -0.593 1.00 0.00 H new ATOM 0 HD12 ILE A 3 1.807 -7.160 -1.586 1.00 0.00 H new ATOM 0 HD13 ILE A 3 1.655 -7.668 0.113 1.00 0.00 H new ATOM 22 N LEU A 4 6.714 -6.058 -0.198 1.00 0.00 N ATOM 23 CA LEU A 4 8.086 -6.501 -0.015 1.00 0.00 C ATOM 24 C LEU A 4 8.818 -6.450 -1.357 1.00 0.00 C ATOM 25 O LEU A 4 9.767 -7.200 -1.580 1.00 0.00 O ATOM 26 CB LEU A 4 8.120 -7.878 0.652 1.00 0.00 C ATOM 27 CG LEU A 4 7.674 -7.926 2.115 1.00 0.00 C ATOM 28 CD1 LEU A 4 7.836 -9.333 2.692 1.00 0.00 C ATOM 29 CD2 LEU A 4 8.412 -6.876 2.948 1.00 0.00 C ATOM 0 H LEU A 4 6.244 -6.452 -1.013 1.00 0.00 H new ATOM 0 HA LEU A 4 8.615 -5.831 0.662 1.00 0.00 H new ATOM 0 HB2 LEU A 4 7.487 -8.554 0.077 1.00 0.00 H new ATOM 0 HB3 LEU A 4 9.137 -8.265 0.590 1.00 0.00 H new ATOM 0 HG LEU A 4 6.613 -7.682 2.156 1.00 0.00 H new ATOM 0 HD11 LEU A 4 7.512 -9.339 3.733 1.00 0.00 H new ATOM 0 HD12 LEU A 4 7.229 -10.033 2.119 1.00 0.00 H new ATOM 0 HD13 LEU A 4 8.883 -9.631 2.636 1.00 0.00 H new ATOM 0 HD21 LEU A 4 8.076 -6.932 3.984 1.00 0.00 H new ATOM 0 HD22 LEU A 4 9.485 -7.064 2.904 1.00 0.00 H new ATOM 0 HD23 LEU A 4 8.201 -5.883 2.551 1.00 0.00 H new ATOM 30 N CYS A 5 8.349 -5.558 -2.217 1.00 0.00 N ATOM 31 CA CYS A 5 8.947 -5.399 -3.532 1.00 0.00 C ATOM 32 C CYS A 5 10.375 -4.879 -3.351 1.00 0.00 C ATOM 33 O CYS A 5 11.338 -5.620 -3.542 1.00 0.00 O ATOM 34 CB CYS A 5 8.114 -4.478 -4.425 1.00 0.00 C ATOM 35 SG CYS A 5 6.303 -4.629 -4.206 1.00 0.00 S ATOM 0 H CYS A 5 7.562 -4.938 -2.029 1.00 0.00 H new ATOM 0 HA CYS A 5 8.974 -6.363 -4.041 1.00 0.00 H new ATOM 0 HB2 CYS A 5 8.405 -3.446 -4.230 1.00 0.00 H new ATOM 0 HB3 CYS A 5 8.359 -4.687 -5.467 1.00 0.00 H new ATOM 36 N ASN A 6 10.466 -3.609 -2.983 1.00 0.00 N ATOM 37 CA ASN A 6 11.760 -2.982 -2.774 1.00 0.00 C ATOM 38 C ASN A 6 12.609 -3.868 -1.860 1.00 0.00 C ATOM 39 O ASN A 6 13.836 -3.777 -1.867 1.00 0.00 O ATOM 40 CB ASN A 6 11.608 -1.617 -2.101 1.00 0.00 C ATOM 41 CG ASN A 6 12.336 -0.530 -2.894 1.00 0.00 C ATOM 42 OD1 ASN A 6 12.071 -0.294 -4.061 1.00 0.00 O ATOM 43 ND2 ASN A 6 13.267 0.116 -2.198 1.00 0.00 N ATOM 0 H ASN A 6 9.665 -2.998 -2.824 1.00 0.00 H new ATOM 0 HA ASN A 6 12.234 -2.853 -3.747 1.00 0.00 H new ATOM 0 HB2 ASN A 6 10.551 -1.365 -2.017 1.00 0.00 H new ATOM 0 HB3 ASN A 6 12.006 -1.661 -1.087 1.00 0.00 H new ATOM 0 HD21 ASN A 6 13.809 0.859 -2.639 1.00 0.00 H new ATOM 0 HD22 ASN A 6 13.439 -0.132 -1.223 1.00 0.00 H new ATOM 44 N LEU A 7 11.923 -4.704 -1.095 1.00 0.00 N ATOM 45 CA LEU A 7 12.599 -5.605 -0.177 1.00 0.00 C ATOM 46 C LEU A 7 13.412 -6.625 -0.977 1.00 0.00 C ATOM 47 O LEU A 7 14.641 -6.609 -0.943 1.00 0.00 O ATOM 48 CB LEU A 7 11.595 -6.238 0.788 1.00 0.00 C ATOM 49 CG LEU A 7 12.193 -6.981 1.985 1.00 0.00 C ATOM 50 CD1 LEU A 7 12.079 -6.146 3.262 1.00 0.00 C ATOM 51 CD2 LEU A 7 11.557 -8.364 2.145 1.00 0.00 C ATOM 0 H LEU A 7 10.906 -4.777 -1.092 1.00 0.00 H new ATOM 0 HA LEU A 7 13.303 -5.056 0.448 1.00 0.00 H new ATOM 0 HB2 LEU A 7 10.938 -5.454 1.164 1.00 0.00 H new ATOM 0 HB3 LEU A 7 10.972 -6.935 0.227 1.00 0.00 H new ATOM 0 HG LEU A 7 13.255 -7.135 1.796 1.00 0.00 H new ATOM 0 HD11 LEU A 7 12.511 -6.697 4.097 1.00 0.00 H new ATOM 0 HD12 LEU A 7 12.615 -5.206 3.131 1.00 0.00 H new ATOM 0 HD13 LEU A 7 11.029 -5.939 3.469 1.00 0.00 H new ATOM 0 HD21 LEU A 7 12.000 -8.871 3.002 1.00 0.00 H new ATOM 0 HD22 LEU A 7 10.484 -8.255 2.302 1.00 0.00 H new ATOM 0 HD23 LEU A 7 11.734 -8.952 1.245 1.00 0.00 H new ATOM 52 N CYS A 8 12.692 -7.488 -1.678 1.00 0.00 N ATOM 53 CA CYS A 8 13.331 -8.514 -2.485 1.00 0.00 C ATOM 54 C CYS A 8 14.416 -7.850 -3.335 1.00 0.00 C ATOM 55 O CYS A 8 15.586 -8.221 -3.255 1.00 0.00 O ATOM 56 CB CYS A 8 12.316 -9.271 -3.345 1.00 0.00 C ATOM 57 SG CYS A 8 11.344 -8.223 -4.487 1.00 0.00 S ATOM 0 H CYS A 8 11.672 -7.498 -1.704 1.00 0.00 H new ATOM 0 HA CYS A 8 13.786 -9.261 -1.835 1.00 0.00 H new ATOM 0 HB2 CYS A 8 12.845 -10.025 -3.928 1.00 0.00 H new ATOM 0 HB3 CYS A 8 11.628 -9.802 -2.687 1.00 0.00 H new ATOM 58 N THR A 9 13.989 -6.879 -4.129 1.00 0.00 N ATOM 59 CA THR A 9 14.910 -6.160 -4.993 1.00 0.00 C ATOM 60 C THR A 9 16.137 -5.702 -4.201 1.00 0.00 C ATOM 61 O THR A 9 17.196 -5.459 -4.776 1.00 0.00 O ATOM 62 CB THR A 9 14.144 -5.008 -5.646 1.00 0.00 C ATOM 63 OG1 THR A 9 13.693 -4.222 -4.545 1.00 0.00 O ATOM 64 CG2 THR A 9 12.854 -5.473 -6.324 1.00 0.00 C ATOM 0 H THR A 9 13.018 -6.573 -4.192 1.00 0.00 H new ATOM 0 HA THR A 9 15.294 -6.804 -5.784 1.00 0.00 H new ATOM 0 HB THR A 9 14.784 -4.517 -6.380 1.00 0.00 H new ATOM 0 HG1 THR A 9 14.184 -3.374 -4.526 1.00 0.00 H new ATOM 0 HG21 THR A 9 12.349 -4.617 -6.771 1.00 0.00 H new ATOM 0 HG22 THR A 9 13.093 -6.200 -7.100 1.00 0.00 H new ATOM 0 HG23 THR A 9 12.200 -5.934 -5.584 1.00 0.00 H new ATOM 65 N GLY A 10 15.952 -5.597 -2.893 1.00 0.00 N ATOM 66 CA GLY A 10 17.030 -5.173 -2.016 1.00 0.00 C ATOM 67 C GLY A 10 18.012 -6.318 -1.761 1.00 0.00 C ATOM 68 O GLY A 10 19.217 -6.094 -1.655 1.00 0.00 O ATOM 0 H GLY A 10 15.071 -5.798 -2.419 1.00 0.00 H new ATOM 0 HA2 GLY A 10 17.557 -4.330 -2.463 1.00 0.00 H new ATOM 0 HA3 GLY A 10 16.618 -4.825 -1.069 1.00 0.00 H new ATOM 69 N LEU A 11 17.461 -7.519 -1.671 1.00 0.00 N ATOM 70 CA LEU A 11 18.273 -8.699 -1.430 1.00 0.00 C ATOM 71 C LEU A 11 18.870 -9.180 -2.754 1.00 0.00 C ATOM 72 O LEU A 11 20.026 -9.599 -2.802 1.00 0.00 O ATOM 73 CB LEU A 11 17.461 -9.769 -0.698 1.00 0.00 C ATOM 74 CG LEU A 11 16.907 -10.902 -1.564 1.00 0.00 C ATOM 75 CD1 LEU A 11 18.035 -11.640 -2.287 1.00 0.00 C ATOM 76 CD2 LEU A 11 16.038 -11.851 -0.737 1.00 0.00 C ATOM 0 H LEU A 11 16.461 -7.700 -1.761 1.00 0.00 H new ATOM 0 HA LEU A 11 19.107 -8.459 -0.771 1.00 0.00 H new ATOM 0 HB2 LEU A 11 18.090 -10.206 0.078 1.00 0.00 H new ATOM 0 HB3 LEU A 11 16.626 -9.282 -0.195 1.00 0.00 H new ATOM 0 HG LEU A 11 16.266 -10.465 -2.329 1.00 0.00 H new ATOM 0 HD11 LEU A 11 17.615 -12.440 -2.896 1.00 0.00 H new ATOM 0 HD12 LEU A 11 18.574 -10.942 -2.927 1.00 0.00 H new ATOM 0 HD13 LEU A 11 18.721 -12.064 -1.554 1.00 0.00 H new ATOM 0 HD21 LEU A 11 15.657 -12.647 -1.377 1.00 0.00 H new ATOM 0 HD22 LEU A 11 16.635 -12.285 0.065 1.00 0.00 H new ATOM 0 HD23 LEU A 11 15.202 -11.298 -0.309 1.00 0.00 H new ATOM 77 N ILE A 12 18.056 -9.105 -3.796 1.00 0.00 N ATOM 78 CA ILE A 12 18.489 -9.527 -5.117 1.00 0.00 C ATOM 79 C ILE A 12 19.839 -8.882 -5.437 1.00 0.00 C ATOM 80 O ILE A 12 20.795 -9.573 -5.784 1.00 0.00 O ATOM 81 CB ILE A 12 17.405 -9.234 -6.156 1.00 0.00 C ATOM 82 CG1 ILE A 12 16.161 -10.089 -5.907 1.00 0.00 C ATOM 83 CG2 ILE A 12 17.946 -9.409 -7.577 1.00 0.00 C ATOM 84 CD1 ILE A 12 16.487 -11.579 -6.026 1.00 0.00 C ATOM 0 H ILE A 12 17.098 -8.758 -3.752 1.00 0.00 H new ATOM 0 HA ILE A 12 18.637 -10.607 -5.142 1.00 0.00 H new ATOM 0 HB ILE A 12 17.105 -8.191 -6.052 1.00 0.00 H new ATOM 0 HG12 ILE A 12 15.763 -9.878 -4.914 1.00 0.00 H new ATOM 0 HG13 ILE A 12 15.384 -9.825 -6.624 1.00 0.00 H new ATOM 0 HG21 ILE A 12 17.155 -9.195 -8.296 1.00 0.00 H new ATOM 0 HG22 ILE A 12 18.778 -8.723 -7.737 1.00 0.00 H new ATOM 0 HG23 ILE A 12 18.291 -10.434 -7.711 1.00 0.00 H new ATOM 0 HD11 ILE A 12 15.586 -12.164 -5.844 1.00 0.00 H new ATOM 0 HD12 ILE A 12 16.862 -11.791 -7.028 1.00 0.00 H new ATOM 0 HD13 ILE A 12 17.247 -11.845 -5.291 1.00 0.00 H new ATOM 85 N ASN A 13 19.873 -7.563 -5.310 1.00 0.00 N ATOM 86 CA ASN A 13 21.090 -6.816 -5.581 1.00 0.00 C ATOM 87 C ASN A 13 22.226 -7.371 -4.719 1.00 0.00 C ATOM 88 O ASN A 13 23.380 -7.389 -5.145 1.00 0.00 O ATOM 89 CB ASN A 13 20.915 -5.336 -5.238 1.00 0.00 C ATOM 90 CG ASN A 13 20.484 -4.535 -6.468 1.00 0.00 C ATOM 91 OD1 ASN A 13 19.579 -4.907 -7.197 1.00 0.00 O ATOM 92 ND2 ASN A 13 21.180 -3.417 -6.657 1.00 0.00 N ATOM 0 H ASN A 13 19.077 -6.993 -5.023 1.00 0.00 H new ATOM 0 HA ASN A 13 21.318 -6.915 -6.642 1.00 0.00 H new ATOM 0 HB2 ASN A 13 20.170 -5.227 -4.450 1.00 0.00 H new ATOM 0 HB3 ASN A 13 21.851 -4.936 -4.849 1.00 0.00 H new ATOM 0 HD21 ASN A 13 20.968 -2.812 -7.451 1.00 0.00 H new ATOM 0 HD22 ASN A 13 21.925 -3.164 -6.008 1.00 0.00 H new ATOM 93 N THR A 14 21.860 -7.808 -3.524 1.00 0.00 N ATOM 94 CA THR A 14 22.834 -8.361 -2.599 1.00 0.00 C ATOM 95 C THR A 14 23.345 -9.711 -3.106 1.00 0.00 C ATOM 96 O THR A 14 24.466 -10.111 -2.796 1.00 0.00 O ATOM 97 CB THR A 14 22.183 -8.439 -1.216 1.00 0.00 C ATOM 98 OG1 THR A 14 22.680 -7.292 -0.533 1.00 0.00 O ATOM 99 CG2 THR A 14 22.702 -9.618 -0.390 1.00 0.00 C ATOM 0 H THR A 14 20.902 -7.790 -3.174 1.00 0.00 H new ATOM 0 HA THR A 14 23.714 -7.722 -2.524 1.00 0.00 H new ATOM 0 HB THR A 14 21.102 -8.522 -1.328 1.00 0.00 H new ATOM 0 HG1 THR A 14 22.307 -7.263 0.373 1.00 0.00 H new ATOM 0 HG21 THR A 14 22.208 -9.627 0.582 1.00 0.00 H new ATOM 0 HG22 THR A 14 22.490 -10.550 -0.913 1.00 0.00 H new ATOM 0 HG23 THR A 14 23.778 -9.518 -0.249 1.00 0.00 H new ATOM 100 N LEU A 15 22.498 -10.376 -3.878 1.00 0.00 N ATOM 101 CA LEU A 15 22.850 -11.673 -4.432 1.00 0.00 C ATOM 102 C LEU A 15 23.976 -11.498 -5.453 1.00 0.00 C ATOM 103 O LEU A 15 24.783 -12.404 -5.654 1.00 0.00 O ATOM 104 CB LEU A 15 21.610 -12.368 -4.997 1.00 0.00 C ATOM 105 CG LEU A 15 20.411 -12.472 -4.053 1.00 0.00 C ATOM 106 CD1 LEU A 15 19.225 -13.147 -4.745 1.00 0.00 C ATOM 107 CD2 LEU A 15 20.796 -13.182 -2.753 1.00 0.00 C ATOM 0 H LEU A 15 21.569 -10.041 -4.133 1.00 0.00 H new ATOM 0 HA LEU A 15 23.228 -12.332 -3.650 1.00 0.00 H new ATOM 0 HB2 LEU A 15 21.296 -11.834 -5.894 1.00 0.00 H new ATOM 0 HB3 LEU A 15 21.891 -13.374 -5.307 1.00 0.00 H new ATOM 0 HG LEU A 15 20.097 -11.462 -3.788 1.00 0.00 H new ATOM 0 HD11 LEU A 15 18.386 -13.208 -4.052 1.00 0.00 H new ATOM 0 HD12 LEU A 15 18.933 -12.563 -5.618 1.00 0.00 H new ATOM 0 HD13 LEU A 15 19.510 -14.151 -5.059 1.00 0.00 H new ATOM 0 HD21 LEU A 15 19.925 -13.243 -2.100 1.00 0.00 H new ATOM 0 HD22 LEU A 15 21.151 -14.188 -2.979 1.00 0.00 H new ATOM 0 HD23 LEU A 15 21.586 -12.622 -2.253 1.00 0.00 H new ATOM 108 N GLU A 16 23.994 -10.326 -6.071 1.00 0.00 N ATOM 109 CA GLU A 16 25.008 -10.021 -7.067 1.00 0.00 C ATOM 110 C GLU A 16 26.386 -9.926 -6.409 1.00 0.00 C ATOM 111 O GLU A 16 27.405 -10.157 -7.059 1.00 0.00 O ATOM 112 CB GLU A 16 24.668 -8.731 -7.817 1.00 0.00 C ATOM 113 CG GLU A 16 24.489 -8.999 -9.313 1.00 0.00 C ATOM 114 CD GLU A 16 24.614 -7.705 -10.120 1.00 0.00 C ATOM 115 OE1 GLU A 16 25.640 -7.016 -9.933 1.00 0.00 O ATOM 116 OE2 GLU A 16 23.681 -7.434 -10.906 1.00 0.00 O ATOM 0 H GLU A 16 23.323 -9.577 -5.902 1.00 0.00 H new ATOM 0 HA GLU A 16 25.030 -10.831 -7.796 1.00 0.00 H new ATOM 0 HB2 GLU A 16 23.754 -8.299 -7.409 1.00 0.00 H new ATOM 0 HB3 GLU A 16 25.461 -7.999 -7.667 1.00 0.00 H new ATOM 0 HG2 GLU A 16 25.238 -9.716 -9.650 1.00 0.00 H new ATOM 0 HG3 GLU A 16 23.513 -9.450 -9.491 1.00 0.00 H new ATOM 117 N ASN A 17 26.373 -9.585 -5.129 1.00 0.00 N ATOM 118 CA ASN A 17 27.609 -9.456 -4.376 1.00 0.00 C ATOM 119 C ASN A 17 27.707 -10.601 -3.366 1.00 0.00 C ATOM 120 O ASN A 17 28.784 -10.880 -2.841 1.00 0.00 O ATOM 121 CB ASN A 17 27.648 -8.137 -3.602 1.00 0.00 C ATOM 122 CG ASN A 17 29.083 -7.767 -3.221 1.00 0.00 C ATOM 123 OD1 ASN A 17 29.937 -7.539 -4.062 1.00 0.00 O ATOM 124 ND2 ASN A 17 29.300 -7.721 -1.910 1.00 0.00 N ATOM 0 H ASN A 17 25.526 -9.394 -4.594 1.00 0.00 H new ATOM 0 HA ASN A 17 28.439 -9.483 -5.082 1.00 0.00 H new ATOM 0 HB2 ASN A 17 27.213 -7.343 -4.208 1.00 0.00 H new ATOM 0 HB3 ASN A 17 27.039 -8.221 -2.702 1.00 0.00 H new ATOM 0 HD21 ASN A 17 30.226 -7.484 -1.554 1.00 0.00 H new ATOM 0 HD22 ASN A 17 28.540 -7.923 -1.260 1.00 0.00 H new ATOM 125 N LEU A 18 26.568 -11.232 -3.123 1.00 0.00 N ATOM 126 CA LEU A 18 26.512 -12.340 -2.184 1.00 0.00 C ATOM 127 C LEU A 18 27.657 -13.311 -2.479 1.00 0.00 C ATOM 128 O LEU A 18 28.721 -13.225 -1.870 1.00 0.00 O ATOM 129 CB LEU A 18 25.129 -12.993 -2.209 1.00 0.00 C ATOM 130 CG LEU A 18 24.804 -13.920 -1.035 1.00 0.00 C ATOM 131 CD1 LEU A 18 24.217 -13.134 0.138 1.00 0.00 C ATOM 132 CD2 LEU A 18 23.887 -15.063 -1.477 1.00 0.00 C ATOM 0 H LEU A 18 25.677 -10.997 -3.560 1.00 0.00 H new ATOM 0 HA LEU A 18 26.652 -11.983 -1.164 1.00 0.00 H new ATOM 0 HB2 LEU A 18 24.377 -12.204 -2.243 1.00 0.00 H new ATOM 0 HB3 LEU A 18 25.035 -13.563 -3.133 1.00 0.00 H new ATOM 0 HG LEU A 18 25.734 -14.370 -0.687 1.00 0.00 H new ATOM 0 HD11 LEU A 18 23.995 -13.816 0.959 1.00 0.00 H new ATOM 0 HD12 LEU A 18 24.937 -12.387 0.472 1.00 0.00 H new ATOM 0 HD13 LEU A 18 23.300 -12.638 -0.179 1.00 0.00 H new ATOM 0 HD21 LEU A 18 23.671 -15.707 -0.624 1.00 0.00 H new ATOM 0 HD22 LEU A 18 22.955 -14.652 -1.866 1.00 0.00 H new ATOM 0 HD23 LEU A 18 24.380 -15.645 -2.256 1.00 0.00 H new ATOM 133 N LEU A 19 27.398 -14.213 -3.415 1.00 0.00 N ATOM 134 CA LEU A 19 28.394 -15.200 -3.799 1.00 0.00 C ATOM 135 C LEU A 19 28.792 -14.975 -5.259 1.00 0.00 C ATOM 136 O LEU A 19 29.967 -14.780 -5.563 1.00 0.00 O ATOM 137 CB LEU A 19 27.885 -16.614 -3.510 1.00 0.00 C ATOM 138 CG LEU A 19 26.614 -16.710 -2.664 1.00 0.00 C ATOM 139 CD1 LEU A 19 25.366 -16.512 -3.525 1.00 0.00 C ATOM 140 CD2 LEU A 19 26.572 -18.027 -1.887 1.00 0.00 C ATOM 0 H LEU A 19 26.514 -14.281 -3.918 1.00 0.00 H new ATOM 0 HA LEU A 19 29.298 -15.083 -3.201 1.00 0.00 H new ATOM 0 HB2 LEU A 19 27.703 -17.115 -4.461 1.00 0.00 H new ATOM 0 HB3 LEU A 19 28.677 -17.167 -3.005 1.00 0.00 H new ATOM 0 HG LEU A 19 26.629 -15.904 -1.931 1.00 0.00 H new ATOM 0 HD11 LEU A 19 24.477 -16.585 -2.899 1.00 0.00 H new ATOM 0 HD12 LEU A 19 25.400 -15.529 -3.994 1.00 0.00 H new ATOM 0 HD13 LEU A 19 25.331 -17.281 -4.297 1.00 0.00 H new ATOM 0 HD21 LEU A 19 25.659 -18.070 -1.294 1.00 0.00 H new ATOM 0 HD22 LEU A 19 26.590 -18.863 -2.586 1.00 0.00 H new ATOM 0 HD23 LEU A 19 27.437 -18.088 -1.227 1.00 0.00 H new ATOM 141 N THR A 20 27.789 -15.010 -6.124 1.00 0.00 N ATOM 142 CA THR A 20 28.020 -14.813 -7.545 1.00 0.00 C ATOM 143 C THR A 20 29.370 -15.405 -7.954 1.00 0.00 C ATOM 144 O THR A 20 30.053 -14.862 -8.820 1.00 0.00 O ATOM 145 CB THR A 20 27.898 -13.317 -7.841 1.00 0.00 C ATOM 146 OG1 THR A 20 28.137 -13.219 -9.242 1.00 0.00 O ATOM 147 CG2 THR A 20 29.030 -12.502 -7.212 1.00 0.00 C ATOM 0 H THR A 20 26.815 -15.172 -5.868 1.00 0.00 H new ATOM 0 HA THR A 20 27.276 -15.339 -8.143 1.00 0.00 H new ATOM 0 HB THR A 20 26.939 -12.951 -7.473 1.00 0.00 H new ATOM 0 HG1 THR A 20 29.053 -13.508 -9.439 1.00 0.00 H new ATOM 0 HG21 THR A 20 28.896 -11.447 -7.452 1.00 0.00 H new ATOM 0 HG22 THR A 20 29.014 -12.632 -6.130 1.00 0.00 H new ATOM 0 HG23 THR A 20 29.987 -12.845 -7.605 1.00 0.00 H new ATOM 148 N THR A 21 29.714 -16.511 -7.310 1.00 0.00 N ATOM 149 CA THR A 21 30.970 -17.183 -7.595 1.00 0.00 C ATOM 150 C THR A 21 31.115 -18.434 -6.726 1.00 0.00 C ATOM 151 O THR A 21 31.576 -19.472 -7.199 1.00 0.00 O ATOM 152 CB THR A 21 32.102 -16.172 -7.399 1.00 0.00 C ATOM 153 OG1 THR A 21 33.064 -16.532 -8.386 1.00 0.00 O ATOM 154 CG2 THR A 21 32.839 -16.368 -6.072 1.00 0.00 C ATOM 0 H THR A 21 29.144 -16.958 -6.592 1.00 0.00 H new ATOM 0 HA THR A 21 31.005 -17.536 -8.626 1.00 0.00 H new ATOM 0 HB THR A 21 31.697 -15.161 -7.444 1.00 0.00 H new ATOM 0 HG1 THR A 21 33.832 -15.926 -8.331 1.00 0.00 H new ATOM 0 HG21 THR A 21 33.632 -15.625 -5.983 1.00 0.00 H new ATOM 0 HG22 THR A 21 32.138 -16.251 -5.246 1.00 0.00 H new ATOM 0 HG23 THR A 21 33.273 -17.367 -6.041 1.00 0.00 H new ATOM 155 N LYS A 22 30.714 -18.294 -5.472 1.00 0.00 N ATOM 156 CA LYS A 22 30.793 -19.400 -4.532 1.00 0.00 C ATOM 157 C LYS A 22 30.075 -20.615 -5.121 1.00 0.00 C ATOM 158 O LYS A 22 30.656 -21.695 -5.223 1.00 0.00 O ATOM 159 CB LYS A 22 30.263 -18.977 -3.161 1.00 0.00 C ATOM 160 CG LYS A 22 30.863 -19.843 -2.051 1.00 0.00 C ATOM 161 CD LYS A 22 30.985 -19.054 -0.746 1.00 0.00 C ATOM 162 CE LYS A 22 32.351 -19.281 -0.094 1.00 0.00 C ATOM 163 NZ LYS A 22 32.283 -19.007 1.359 1.00 0.00 N ATOM 0 H LYS A 22 30.333 -17.431 -5.084 1.00 0.00 H new ATOM 0 HA LYS A 22 31.831 -19.690 -4.370 1.00 0.00 H new ATOM 0 HB2 LYS A 22 30.505 -17.930 -2.981 1.00 0.00 H new ATOM 0 HB3 LYS A 22 29.176 -19.061 -3.145 1.00 0.00 H new ATOM 0 HG2 LYS A 22 30.238 -20.721 -1.892 1.00 0.00 H new ATOM 0 HG3 LYS A 22 31.846 -20.202 -2.356 1.00 0.00 H new ATOM 0 HD2 LYS A 22 30.845 -17.991 -0.945 1.00 0.00 H new ATOM 0 HD3 LYS A 22 30.195 -19.357 -0.059 1.00 0.00 H new ATOM 0 HE2 LYS A 22 32.675 -20.308 -0.262 1.00 0.00 H new ATOM 0 HE3 LYS A 22 33.094 -18.633 -0.558 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 33.218 -19.166 1.786 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 31.995 -18.020 1.513 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 31.588 -19.643 1.800 1.00 0.00 H new ATOM 164 N GLY A 23 28.821 -20.400 -5.493 1.00 0.00 N ATOM 165 CA GLY A 23 28.018 -21.464 -6.069 1.00 0.00 C ATOM 166 C GLY A 23 26.560 -21.027 -6.226 1.00 0.00 C ATOM 167 O GLY A 23 25.856 -21.508 -7.113 1.00 0.00 O ATOM 0 H GLY A 23 28.342 -19.504 -5.406 1.00 0.00 H new ATOM 0 HA2 GLY A 23 28.424 -21.745 -7.041 1.00 0.00 H new ATOM 0 HA3 GLY A 23 28.070 -22.348 -5.434 1.00 0.00 H new ATOM 168 N ALA A 24 26.150 -20.120 -5.351 1.00 0.00 N ATOM 169 CA ALA A 24 24.789 -19.613 -5.382 1.00 0.00 C ATOM 170 C ALA A 24 23.905 -20.481 -4.483 1.00 0.00 C ATOM 171 O ALA A 24 22.680 -20.372 -4.519 1.00 0.00 O ATOM 172 CB ALA A 24 24.290 -19.574 -6.828 1.00 0.00 C ATOM 0 H ALA A 24 26.736 -19.724 -4.617 1.00 0.00 H new ATOM 0 HA ALA A 24 24.751 -18.594 -4.997 1.00 0.00 H new ATOM 0 HB1 ALA A 24 23.269 -19.194 -6.850 1.00 0.00 H new ATOM 0 HB2 ALA A 24 24.934 -18.921 -7.417 1.00 0.00 H new ATOM 0 HB3 ALA A 24 24.312 -20.580 -7.248 1.00 0.00 H new ATOM 173 N ASP A 25 24.561 -21.323 -3.699 1.00 0.00 N ATOM 174 CA ASP A 25 23.850 -22.210 -2.793 1.00 0.00 C ATOM 175 C ASP A 25 23.488 -21.445 -1.518 1.00 0.00 C ATOM 176 O ASP A 25 22.368 -21.553 -1.022 1.00 0.00 O ATOM 177 CB ASP A 25 24.719 -23.405 -2.397 1.00 0.00 C ATOM 178 CG ASP A 25 25.158 -24.298 -3.558 1.00 0.00 C ATOM 179 OD1 ASP A 25 24.403 -24.348 -4.553 1.00 0.00 O ATOM 180 OD2 ASP A 25 26.239 -24.912 -3.425 1.00 0.00 O ATOM 0 H ASP A 25 25.577 -21.410 -3.672 1.00 0.00 H new ATOM 0 HA ASP A 25 22.956 -22.568 -3.304 1.00 0.00 H new ATOM 0 HB2 ASP A 25 25.608 -23.035 -1.887 1.00 0.00 H new ATOM 0 HB3 ASP A 25 24.169 -24.013 -1.679 1.00 0.00 H new ATOM 181 N LYS A 26 24.458 -20.689 -1.024 1.00 0.00 N ATOM 182 CA LYS A 26 24.256 -19.907 0.184 1.00 0.00 C ATOM 183 C LYS A 26 23.159 -18.869 -0.063 1.00 0.00 C ATOM 184 O LYS A 26 22.612 -18.302 0.881 1.00 0.00 O ATOM 185 CB LYS A 26 25.579 -19.303 0.659 1.00 0.00 C ATOM 186 CG LYS A 26 25.460 -17.786 0.824 1.00 0.00 C ATOM 187 CD LYS A 26 24.694 -17.432 2.100 1.00 0.00 C ATOM 188 CE LYS A 26 25.611 -16.757 3.121 1.00 0.00 C ATOM 189 NZ LYS A 26 25.265 -17.189 4.494 1.00 0.00 N ATOM 0 H LYS A 26 25.386 -20.602 -1.438 1.00 0.00 H new ATOM 0 HA LYS A 26 23.914 -20.545 0.998 1.00 0.00 H new ATOM 0 HB2 LYS A 26 25.869 -19.754 1.608 1.00 0.00 H new ATOM 0 HB3 LYS A 26 26.367 -19.534 -0.058 1.00 0.00 H new ATOM 0 HG2 LYS A 26 26.454 -17.341 0.857 1.00 0.00 H new ATOM 0 HG3 LYS A 26 24.950 -17.361 -0.040 1.00 0.00 H new ATOM 0 HD2 LYS A 26 23.864 -16.769 1.858 1.00 0.00 H new ATOM 0 HD3 LYS A 26 24.265 -18.335 2.533 1.00 0.00 H new ATOM 0 HE2 LYS A 26 26.650 -17.006 2.906 1.00 0.00 H new ATOM 0 HE3 LYS A 26 25.520 -15.674 3.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 25.897 -16.721 5.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 24.280 -16.929 4.702 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 25.375 -18.220 4.572 1.00 0.00 H new ATOM 190 N VAL A 27 22.871 -18.652 -1.338 1.00 0.00 N ATOM 191 CA VAL A 27 21.850 -17.693 -1.722 1.00 0.00 C ATOM 192 C VAL A 27 20.493 -18.157 -1.188 1.00 0.00 C ATOM 193 O VAL A 27 19.798 -17.403 -0.509 1.00 0.00 O ATOM 194 CB VAL A 27 21.859 -17.497 -3.239 1.00 0.00 C ATOM 195 CG1 VAL A 27 20.732 -18.291 -3.902 1.00 0.00 C ATOM 196 CG2 VAL A 27 21.771 -16.013 -3.601 1.00 0.00 C ATOM 0 H VAL A 27 23.327 -19.124 -2.118 1.00 0.00 H new ATOM 0 HA VAL A 27 22.058 -16.718 -1.280 1.00 0.00 H new ATOM 0 HB VAL A 27 22.806 -17.879 -3.620 1.00 0.00 H new ATOM 0 HG11 VAL A 27 20.762 -18.134 -4.980 1.00 0.00 H new ATOM 0 HG12 VAL A 27 20.859 -19.352 -3.686 1.00 0.00 H new ATOM 0 HG13 VAL A 27 19.771 -17.954 -3.512 1.00 0.00 H new ATOM 0 HG21 VAL A 27 21.779 -15.902 -4.685 1.00 0.00 H new ATOM 0 HG22 VAL A 27 20.848 -15.595 -3.200 1.00 0.00 H new ATOM 0 HG23 VAL A 27 22.623 -15.484 -3.176 1.00 0.00 H new ATOM 197 N LYS A 28 20.157 -19.397 -1.515 1.00 0.00 N ATOM 198 CA LYS A 28 18.896 -19.971 -1.077 1.00 0.00 C ATOM 199 C LYS A 28 18.917 -20.134 0.444 1.00 0.00 C ATOM 200 O LYS A 28 17.878 -20.363 1.062 1.00 0.00 O ATOM 201 CB LYS A 28 18.609 -21.271 -1.831 1.00 0.00 C ATOM 202 CG LYS A 28 19.534 -22.394 -1.359 1.00 0.00 C ATOM 203 CD LYS A 28 18.920 -23.766 -1.645 1.00 0.00 C ATOM 204 CE LYS A 28 19.027 -24.680 -0.422 1.00 0.00 C ATOM 205 NZ LYS A 28 20.263 -25.491 -0.487 1.00 0.00 N ATOM 0 H LYS A 28 20.736 -20.020 -2.078 1.00 0.00 H new ATOM 0 HA LYS A 28 18.069 -19.302 -1.315 1.00 0.00 H new ATOM 0 HB2 LYS A 28 17.570 -21.562 -1.678 1.00 0.00 H new ATOM 0 HB3 LYS A 28 18.741 -21.112 -2.901 1.00 0.00 H new ATOM 0 HG2 LYS A 28 20.498 -22.311 -1.861 1.00 0.00 H new ATOM 0 HG3 LYS A 28 19.721 -22.291 -0.290 1.00 0.00 H new ATOM 0 HD2 LYS A 28 17.873 -23.649 -1.925 1.00 0.00 H new ATOM 0 HD3 LYS A 28 19.428 -24.226 -2.493 1.00 0.00 H new ATOM 0 HE2 LYS A 28 19.026 -24.081 0.488 1.00 0.00 H new ATOM 0 HE3 LYS A 28 18.157 -25.335 -0.373 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 20.320 -26.105 0.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 20.249 -26.077 -1.346 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 21.090 -24.861 -0.511 1.00 0.00 H new ATOM 206 N ASP A 29 20.111 -20.009 1.005 1.00 0.00 N ATOM 207 CA ASP A 29 20.280 -20.140 2.442 1.00 0.00 C ATOM 208 C ASP A 29 19.934 -18.810 3.115 1.00 0.00 C ATOM 209 O ASP A 29 19.369 -18.791 4.208 1.00 0.00 O ATOM 210 CB ASP A 29 21.727 -20.487 2.797 1.00 0.00 C ATOM 211 CG ASP A 29 21.889 -21.471 3.958 1.00 0.00 C ATOM 212 OD1 ASP A 29 20.843 -21.932 4.462 1.00 0.00 O ATOM 213 OD2 ASP A 29 23.057 -21.740 4.314 1.00 0.00 O ATOM 0 H ASP A 29 20.971 -19.818 0.490 1.00 0.00 H new ATOM 0 HA ASP A 29 19.623 -20.938 2.788 1.00 0.00 H new ATOM 0 HB2 ASP A 29 22.211 -20.906 1.915 1.00 0.00 H new ATOM 0 HB3 ASP A 29 22.256 -19.566 3.044 1.00 0.00 H new ATOM 214 N TYR A 30 20.288 -17.729 2.435 1.00 0.00 N ATOM 215 CA TYR A 30 20.023 -16.398 2.953 1.00 0.00 C ATOM 216 C TYR A 30 18.662 -15.886 2.478 1.00 0.00 C ATOM 217 O TYR A 30 18.041 -15.056 3.140 1.00 0.00 O ATOM 218 CB TYR A 30 21.120 -15.497 2.383 1.00 0.00 C ATOM 219 CG TYR A 30 20.698 -14.037 2.208 1.00 0.00 C ATOM 220 CD1 TYR A 30 19.979 -13.656 1.093 1.00 0.00 C ATOM 221 CD2 TYR A 30 21.036 -13.101 3.164 1.00 0.00 C ATOM 222 CE1 TYR A 30 19.582 -12.281 0.928 1.00 0.00 C ATOM 223 CE2 TYR A 30 20.639 -11.727 2.999 1.00 0.00 C ATOM 224 CZ TYR A 30 19.931 -11.385 1.889 1.00 0.00 C ATOM 225 OH TYR A 30 19.556 -10.087 1.733 1.00 0.00 O ATOM 0 H TYR A 30 20.756 -17.748 1.529 1.00 0.00 H new ATOM 0 HA TYR A 30 20.013 -16.406 4.043 1.00 0.00 H new ATOM 0 HB2 TYR A 30 21.988 -15.537 3.042 1.00 0.00 H new ATOM 0 HB3 TYR A 30 21.435 -15.892 1.417 1.00 0.00 H new ATOM 0 HD1 TYR A 30 19.714 -14.388 0.345 1.00 0.00 H new ATOM 0 HD2 TYR A 30 21.599 -13.399 4.036 1.00 0.00 H new ATOM 0 HE1 TYR A 30 19.020 -11.969 0.060 1.00 0.00 H new ATOM 0 HE2 TYR A 30 20.897 -10.985 3.740 1.00 0.00 H new ATOM 0 HH TYR A 30 19.873 -9.561 2.497 1.00 0.00 H new ATOM 226 N ILE A 31 18.237 -16.402 1.334 1.00 0.00 N ATOM 227 CA ILE A 31 16.961 -16.008 0.762 1.00 0.00 C ATOM 228 C ILE A 31 15.827 -16.597 1.603 1.00 0.00 C ATOM 229 O ILE A 31 14.775 -15.978 1.754 1.00 0.00 O ATOM 230 CB ILE A 31 16.894 -16.393 -0.717 1.00 0.00 C ATOM 231 CG1 ILE A 31 17.913 -15.599 -1.537 1.00 0.00 C ATOM 232 CG2 ILE A 31 15.473 -16.236 -1.261 1.00 0.00 C ATOM 233 CD1 ILE A 31 18.204 -16.292 -2.870 1.00 0.00 C ATOM 0 H ILE A 31 18.755 -17.090 0.787 1.00 0.00 H new ATOM 0 HA ILE A 31 16.850 -14.924 0.790 1.00 0.00 H new ATOM 0 HB ILE A 31 17.158 -17.447 -0.808 1.00 0.00 H new ATOM 0 HG12 ILE A 31 17.533 -14.594 -1.721 1.00 0.00 H new ATOM 0 HG13 ILE A 31 18.837 -15.492 -0.969 1.00 0.00 H new ATOM 0 HG21 ILE A 31 15.454 -16.516 -2.314 1.00 0.00 H new ATOM 0 HG22 ILE A 31 14.796 -16.881 -0.701 1.00 0.00 H new ATOM 0 HG23 ILE A 31 15.156 -15.199 -1.156 1.00 0.00 H new ATOM 0 HD11 ILE A 31 18.931 -15.707 -3.433 1.00 0.00 H new ATOM 0 HD12 ILE A 31 18.606 -17.287 -2.682 1.00 0.00 H new ATOM 0 HD13 ILE A 31 17.282 -16.376 -3.445 1.00 0.00 H new ATOM 234 N SER A 32 16.079 -17.787 2.129 1.00 0.00 N ATOM 235 CA SER A 32 15.093 -18.467 2.950 1.00 0.00 C ATOM 236 C SER A 32 15.022 -17.813 4.332 1.00 0.00 C ATOM 237 O SER A 32 13.944 -17.698 4.914 1.00 0.00 O ATOM 238 CB SER A 32 15.419 -19.956 3.084 1.00 0.00 C ATOM 239 OG SER A 32 14.959 -20.706 1.963 1.00 0.00 O ATOM 0 H SER A 32 16.953 -18.297 2.002 1.00 0.00 H new ATOM 0 HA SER A 32 14.122 -18.378 2.462 1.00 0.00 H new ATOM 0 HB2 SER A 32 16.497 -20.083 3.188 1.00 0.00 H new ATOM 0 HB3 SER A 32 14.963 -20.347 3.994 1.00 0.00 H new ATOM 0 HG SER A 32 15.702 -20.852 1.340 1.00 0.00 H new ATOM 240 N SER A 33 16.184 -17.402 4.817 1.00 0.00 N ATOM 241 CA SER A 33 16.268 -16.762 6.119 1.00 0.00 C ATOM 242 C SER A 33 15.556 -15.408 6.084 1.00 0.00 C ATOM 243 O SER A 33 14.936 -15.004 7.066 1.00 0.00 O ATOM 244 CB SER A 33 17.724 -16.585 6.553 1.00 0.00 C ATOM 245 OG SER A 33 17.913 -16.902 7.930 1.00 0.00 O ATOM 0 H SER A 33 17.076 -17.500 4.332 1.00 0.00 H new ATOM 0 HA SER A 33 15.776 -17.405 6.848 1.00 0.00 H new ATOM 0 HB2 SER A 33 18.364 -17.222 5.943 1.00 0.00 H new ATOM 0 HB3 SER A 33 18.034 -15.556 6.372 1.00 0.00 H new ATOM 0 HG SER A 33 18.856 -16.778 8.168 1.00 0.00 H new ATOM 246 N LEU A 34 15.670 -14.746 4.942 1.00 0.00 N ATOM 247 CA LEU A 34 15.045 -13.446 4.766 1.00 0.00 C ATOM 248 C LEU A 34 13.564 -13.637 4.432 1.00 0.00 C ATOM 249 O LEU A 34 12.699 -13.018 5.049 1.00 0.00 O ATOM 250 CB LEU A 34 15.808 -12.621 3.728 1.00 0.00 C ATOM 251 CG LEU A 34 16.791 -11.588 4.283 1.00 0.00 C ATOM 252 CD1 LEU A 34 17.321 -10.682 3.170 1.00 0.00 C ATOM 253 CD2 LEU A 34 16.159 -10.786 5.422 1.00 0.00 C ATOM 0 H LEU A 34 16.186 -15.085 4.130 1.00 0.00 H new ATOM 0 HA LEU A 34 15.092 -12.873 5.692 1.00 0.00 H new ATOM 0 HB2 LEU A 34 16.357 -13.305 3.082 1.00 0.00 H new ATOM 0 HB3 LEU A 34 15.083 -12.103 3.101 1.00 0.00 H new ATOM 0 HG LEU A 34 17.646 -12.120 4.700 1.00 0.00 H new ATOM 0 HD11 LEU A 34 18.017 -9.957 3.592 1.00 0.00 H new ATOM 0 HD12 LEU A 34 17.835 -11.286 2.422 1.00 0.00 H new ATOM 0 HD13 LEU A 34 16.489 -10.156 2.702 1.00 0.00 H new ATOM 0 HD21 LEU A 34 16.879 -10.059 5.798 1.00 0.00 H new ATOM 0 HD22 LEU A 34 15.276 -10.265 5.053 1.00 0.00 H new ATOM 0 HD23 LEU A 34 15.871 -11.462 6.227 1.00 0.00 H new ATOM 254 N CYS A 35 13.318 -14.498 3.454 1.00 0.00 N ATOM 255 CA CYS A 35 11.957 -14.779 3.030 1.00 0.00 C ATOM 256 C CYS A 35 11.236 -15.497 4.173 1.00 0.00 C ATOM 257 O CYS A 35 10.011 -15.440 4.272 1.00 0.00 O ATOM 258 CB CYS A 35 11.924 -15.592 1.735 1.00 0.00 C ATOM 259 SG CYS A 35 10.457 -15.299 0.681 1.00 0.00 S ATOM 0 H CYS A 35 14.038 -15.009 2.944 1.00 0.00 H new ATOM 0 HA CYS A 35 11.443 -13.844 2.808 1.00 0.00 H new ATOM 0 HB2 CYS A 35 12.820 -15.365 1.157 1.00 0.00 H new ATOM 0 HB3 CYS A 35 11.967 -16.652 1.987 1.00 0.00 H new ATOM 260 N ASN A 36 12.027 -16.157 5.007 1.00 0.00 N ATOM 261 CA ASN A 36 11.480 -16.885 6.138 1.00 0.00 C ATOM 262 C ASN A 36 10.349 -16.069 6.767 1.00 0.00 C ATOM 263 O ASN A 36 9.411 -16.631 7.331 1.00 0.00 O ATOM 264 CB ASN A 36 12.546 -17.119 7.211 1.00 0.00 C ATOM 265 CG ASN A 36 11.904 -17.386 8.573 1.00 0.00 C ATOM 266 OD1 ASN A 36 11.185 -18.351 8.772 1.00 0.00 O ATOM 267 ND2 ASN A 36 12.203 -16.479 9.499 1.00 0.00 N ATOM 0 H ASN A 36 13.042 -16.202 4.921 1.00 0.00 H new ATOM 0 HA ASN A 36 11.116 -17.846 5.775 1.00 0.00 H new ATOM 0 HB2 ASN A 36 13.172 -17.965 6.928 1.00 0.00 H new ATOM 0 HB3 ASN A 36 13.198 -16.248 7.277 1.00 0.00 H new ATOM 0 HD21 ASN A 36 11.824 -16.568 10.442 1.00 0.00 H new ATOM 0 HD22 ASN A 36 12.812 -15.694 9.266 1.00 0.00 H new ATOM 268 N LYS A 37 10.474 -14.755 6.648 1.00 0.00 N ATOM 269 CA LYS A 37 9.474 -13.855 7.197 1.00 0.00 C ATOM 270 C LYS A 37 8.362 -13.645 6.167 1.00 0.00 C ATOM 271 O LYS A 37 8.011 -12.509 5.851 1.00 0.00 O ATOM 272 CB LYS A 37 10.126 -12.555 7.672 1.00 0.00 C ATOM 273 CG LYS A 37 9.624 -12.167 9.065 1.00 0.00 C ATOM 274 CD LYS A 37 8.487 -11.147 8.973 1.00 0.00 C ATOM 275 CE LYS A 37 7.203 -11.700 9.593 1.00 0.00 C ATOM 276 NZ LYS A 37 7.395 -11.961 11.037 1.00 0.00 N ATOM 0 H LYS A 37 11.253 -14.292 6.179 1.00 0.00 H new ATOM 0 HA LYS A 37 9.011 -14.294 8.081 1.00 0.00 H new ATOM 0 HB2 LYS A 37 11.209 -12.673 7.692 1.00 0.00 H new ATOM 0 HB3 LYS A 37 9.906 -11.754 6.966 1.00 0.00 H new ATOM 0 HG2 LYS A 37 9.278 -13.056 9.592 1.00 0.00 H new ATOM 0 HG3 LYS A 37 10.445 -11.750 9.648 1.00 0.00 H new ATOM 0 HD2 LYS A 37 8.775 -10.228 9.484 1.00 0.00 H new ATOM 0 HD3 LYS A 37 8.309 -10.889 7.929 1.00 0.00 H new ATOM 0 HE2 LYS A 37 6.388 -10.990 9.451 1.00 0.00 H new ATOM 0 HE3 LYS A 37 6.915 -12.621 9.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 6.478 -11.904 11.525 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 7.798 -12.911 11.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 8.043 -11.252 11.435 1.00 0.00 H new ATOM 277 N ALA A 38 7.840 -14.757 5.672 1.00 0.00 N ATOM 278 CA ALA A 38 6.775 -14.709 4.684 1.00 0.00 C ATOM 279 C ALA A 38 5.503 -15.313 5.282 1.00 0.00 C ATOM 280 O ALA A 38 4.827 -14.674 6.087 1.00 0.00 O ATOM 281 CB ALA A 38 7.224 -15.435 3.414 1.00 0.00 C ATOM 0 H ALA A 38 8.134 -15.697 5.936 1.00 0.00 H new ATOM 0 HA ALA A 38 6.553 -13.678 4.409 1.00 0.00 H new ATOM 0 HB1 ALA A 38 6.426 -15.399 2.673 1.00 0.00 H new ATOM 0 HB2 ALA A 38 8.114 -14.950 3.013 1.00 0.00 H new ATOM 0 HB3 ALA A 38 7.453 -16.474 3.651 1.00 0.00 H new ATOM 282 N SER A 39 5.215 -16.537 4.865 1.00 0.00 N ATOM 283 CA SER A 39 4.035 -17.234 5.349 1.00 0.00 C ATOM 284 C SER A 39 2.875 -16.250 5.509 1.00 0.00 C ATOM 285 O SER A 39 2.191 -16.252 6.531 1.00 0.00 O ATOM 286 CB SER A 39 4.319 -17.941 6.676 1.00 0.00 C ATOM 287 OG SER A 39 3.289 -18.862 7.021 1.00 0.00 O ATOM 0 H SER A 39 5.778 -17.064 4.198 1.00 0.00 H new ATOM 0 HA SER A 39 3.761 -17.992 4.616 1.00 0.00 H new ATOM 0 HB2 SER A 39 5.270 -18.469 6.609 1.00 0.00 H new ATOM 0 HB3 SER A 39 4.422 -17.199 7.468 1.00 0.00 H new ATOM 0 HG SER A 39 2.428 -18.395 7.049 1.00 0.00 H new ATOM 288 N GLY A 40 2.688 -15.433 4.483 1.00 0.00 N ATOM 289 CA GLY A 40 1.621 -14.446 4.497 1.00 0.00 C ATOM 290 C GLY A 40 1.227 -14.045 3.074 1.00 0.00 C ATOM 291 O GLY A 40 0.892 -14.898 2.254 1.00 0.00 O ATOM 0 H GLY A 40 3.257 -15.434 3.637 1.00 0.00 H new ATOM 0 HA2 GLY A 40 0.753 -14.850 5.018 1.00 0.00 H new ATOM 0 HA3 GLY A 40 1.943 -13.564 5.051 1.00 0.00 H new ATOM 292 N PHE A 41 1.281 -12.745 2.824 1.00 0.00 N ATOM 293 CA PHE A 41 0.933 -12.219 1.515 1.00 0.00 C ATOM 294 C PHE A 41 2.010 -12.562 0.483 1.00 0.00 C ATOM 295 O PHE A 41 1.706 -12.778 -0.689 1.00 0.00 O ATOM 296 CB PHE A 41 0.842 -10.698 1.653 1.00 0.00 C ATOM 297 CG PHE A 41 0.481 -9.976 0.353 1.00 0.00 C ATOM 298 CD1 PHE A 41 1.308 -10.060 -0.724 1.00 0.00 C ATOM 299 CD2 PHE A 41 -0.666 -9.250 0.274 1.00 0.00 C ATOM 300 CE1 PHE A 41 0.973 -9.390 -1.930 1.00 0.00 C ATOM 301 CE2 PHE A 41 -1.001 -8.579 -0.932 1.00 0.00 C ATOM 302 CZ PHE A 41 -0.174 -8.664 -2.009 1.00 0.00 C ATOM 0 H PHE A 41 1.561 -12.040 3.506 1.00 0.00 H new ATOM 0 HA PHE A 41 -0.008 -12.654 1.178 1.00 0.00 H new ATOM 0 HB2 PHE A 41 0.096 -10.456 2.410 1.00 0.00 H new ATOM 0 HB3 PHE A 41 1.798 -10.318 2.014 1.00 0.00 H new ATOM 0 HD1 PHE A 41 2.219 -10.636 -0.662 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -1.323 -9.184 1.129 1.00 0.00 H new ATOM 0 HE1 PHE A 41 1.629 -9.457 -2.785 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -1.912 -8.002 -0.994 1.00 0.00 H new ATOM 0 HZ PHE A 41 -0.429 -8.155 -2.927 1.00 0.00 H new ATOM 303 N ILE A 42 3.247 -12.600 0.957 1.00 0.00 N ATOM 304 CA ILE A 42 4.371 -12.913 0.091 1.00 0.00 C ATOM 305 C ILE A 42 4.537 -14.431 0.006 1.00 0.00 C ATOM 306 O ILE A 42 5.317 -14.930 -0.805 1.00 0.00 O ATOM 307 CB ILE A 42 5.630 -12.182 0.562 1.00 0.00 C ATOM 308 CG1 ILE A 42 5.291 -11.137 1.627 1.00 0.00 C ATOM 309 CG2 ILE A 42 6.384 -11.571 -0.621 1.00 0.00 C ATOM 310 CD1 ILE A 42 5.388 -11.736 3.032 1.00 0.00 C ATOM 0 H ILE A 42 3.495 -12.419 1.930 1.00 0.00 H new ATOM 0 HA ILE A 42 4.183 -12.556 -0.921 1.00 0.00 H new ATOM 0 HB ILE A 42 6.295 -12.911 1.026 1.00 0.00 H new ATOM 0 HG12 ILE A 42 5.972 -10.290 1.541 1.00 0.00 H new ATOM 0 HG13 ILE A 42 4.284 -10.755 1.459 1.00 0.00 H new ATOM 0 HG21 ILE A 42 7.275 -11.057 -0.259 1.00 0.00 H new ATOM 0 HG22 ILE A 42 6.677 -12.361 -1.313 1.00 0.00 H new ATOM 0 HG23 ILE A 42 5.738 -10.859 -1.135 1.00 0.00 H new ATOM 0 HD11 ILE A 42 5.142 -10.973 3.771 1.00 0.00 H new ATOM 0 HD12 ILE A 42 4.688 -12.567 3.122 1.00 0.00 H new ATOM 0 HD13 ILE A 42 6.402 -12.095 3.205 1.00 0.00 H new ATOM 311 N ALA A 43 3.791 -15.125 0.854 1.00 0.00 N ATOM 312 CA ALA A 43 3.846 -16.576 0.885 1.00 0.00 C ATOM 313 C ALA A 43 4.016 -17.106 -0.541 1.00 0.00 C ATOM 314 O ALA A 43 5.017 -17.748 -0.853 1.00 0.00 O ATOM 315 CB ALA A 43 2.588 -17.120 1.563 1.00 0.00 C ATOM 0 H ALA A 43 3.145 -14.708 1.525 1.00 0.00 H new ATOM 0 HA ALA A 43 4.703 -16.916 1.467 1.00 0.00 H new ATOM 0 HB1 ALA A 43 2.629 -18.209 1.586 1.00 0.00 H new ATOM 0 HB2 ALA A 43 2.529 -16.737 2.582 1.00 0.00 H new ATOM 0 HB3 ALA A 43 1.707 -16.802 1.005 1.00 0.00 H new ATOM 316 N THR A 44 3.021 -16.818 -1.367 1.00 0.00 N ATOM 317 CA THR A 44 3.047 -17.258 -2.752 1.00 0.00 C ATOM 318 C THR A 44 4.205 -16.594 -3.500 1.00 0.00 C ATOM 319 O THR A 44 4.701 -17.134 -4.488 1.00 0.00 O ATOM 320 CB THR A 44 1.678 -16.963 -3.367 1.00 0.00 C ATOM 321 OG1 THR A 44 1.794 -17.427 -4.710 1.00 0.00 O ATOM 322 CG2 THR A 44 1.411 -15.464 -3.512 1.00 0.00 C ATOM 0 H THR A 44 2.192 -16.285 -1.104 1.00 0.00 H new ATOM 0 HA THR A 44 3.227 -18.331 -2.824 1.00 0.00 H new ATOM 0 HB THR A 44 0.899 -17.412 -2.750 1.00 0.00 H new ATOM 0 HG1 THR A 44 0.949 -17.276 -5.182 1.00 0.00 H new ATOM 0 HG21 THR A 44 0.426 -15.311 -3.953 1.00 0.00 H new ATOM 0 HG22 THR A 44 1.446 -14.992 -2.530 1.00 0.00 H new ATOM 0 HG23 THR A 44 2.170 -15.020 -4.156 1.00 0.00 H new ATOM 323 N LEU A 45 4.602 -15.433 -3.001 1.00 0.00 N ATOM 324 CA LEU A 45 5.692 -14.690 -3.610 1.00 0.00 C ATOM 325 C LEU A 45 7.003 -15.451 -3.397 1.00 0.00 C ATOM 326 O LEU A 45 7.858 -15.481 -4.282 1.00 0.00 O ATOM 327 CB LEU A 45 5.722 -13.254 -3.083 1.00 0.00 C ATOM 328 CG LEU A 45 4.593 -12.340 -3.564 1.00 0.00 C ATOM 329 CD1 LEU A 45 5.118 -10.936 -3.871 1.00 0.00 C ATOM 330 CD2 LEU A 45 3.863 -12.953 -4.760 1.00 0.00 C ATOM 0 H LEU A 45 4.188 -14.988 -2.182 1.00 0.00 H new ATOM 0 HA LEU A 45 5.542 -14.607 -4.686 1.00 0.00 H new ATOM 0 HB2 LEU A 45 5.697 -13.287 -1.994 1.00 0.00 H new ATOM 0 HB3 LEU A 45 6.673 -12.804 -3.367 1.00 0.00 H new ATOM 0 HG LEU A 45 3.865 -12.243 -2.758 1.00 0.00 H new ATOM 0 HD11 LEU A 45 4.296 -10.306 -4.211 1.00 0.00 H new ATOM 0 HD12 LEU A 45 5.556 -10.506 -2.970 1.00 0.00 H new ATOM 0 HD13 LEU A 45 5.877 -10.994 -4.651 1.00 0.00 H new ATOM 0 HD21 LEU A 45 3.066 -12.283 -5.082 1.00 0.00 H new ATOM 0 HD22 LEU A 45 4.567 -13.100 -5.579 1.00 0.00 H new ATOM 0 HD23 LEU A 45 3.436 -13.914 -4.472 1.00 0.00 H new ATOM 331 N CYS A 46 7.121 -16.045 -2.219 1.00 0.00 N ATOM 332 CA CYS A 46 8.313 -16.803 -1.879 1.00 0.00 C ATOM 333 C CYS A 46 8.328 -18.079 -2.724 1.00 0.00 C ATOM 334 O CYS A 46 9.307 -18.359 -3.414 1.00 0.00 O ATOM 335 CB CYS A 46 8.380 -17.110 -0.382 1.00 0.00 C ATOM 336 SG CYS A 46 10.066 -17.412 0.264 1.00 0.00 S ATOM 0 H CYS A 46 6.411 -16.017 -1.488 1.00 0.00 H new ATOM 0 HA CYS A 46 9.200 -16.210 -2.102 1.00 0.00 H new ATOM 0 HB2 CYS A 46 7.940 -16.277 0.166 1.00 0.00 H new ATOM 0 HB3 CYS A 46 7.765 -17.986 -0.177 1.00 0.00 H new ATOM 337 N THR A 47 7.232 -18.818 -2.641 1.00 0.00 N ATOM 338 CA THR A 47 7.107 -20.058 -3.390 1.00 0.00 C ATOM 339 C THR A 47 7.293 -19.798 -4.886 1.00 0.00 C ATOM 340 O THR A 47 7.643 -20.706 -5.638 1.00 0.00 O ATOM 341 CB THR A 47 5.754 -20.684 -3.045 1.00 0.00 C ATOM 342 OG1 THR A 47 5.991 -22.087 -3.121 1.00 0.00 O ATOM 343 CG2 THR A 47 4.698 -20.426 -4.122 1.00 0.00 C ATOM 0 H THR A 47 6.422 -18.583 -2.067 1.00 0.00 H new ATOM 0 HA THR A 47 7.888 -20.767 -3.116 1.00 0.00 H new ATOM 0 HB THR A 47 5.404 -20.289 -2.091 1.00 0.00 H new ATOM 0 HG1 THR A 47 5.165 -22.570 -2.910 1.00 0.00 H new ATOM 0 HG21 THR A 47 3.757 -20.891 -3.828 1.00 0.00 H new ATOM 0 HG22 THR A 47 4.551 -19.352 -4.238 1.00 0.00 H new ATOM 0 HG23 THR A 47 5.032 -20.851 -5.069 1.00 0.00 H new ATOM 344 N LYS A 48 7.051 -18.555 -5.273 1.00 0.00 N ATOM 345 CA LYS A 48 7.187 -18.164 -6.666 1.00 0.00 C ATOM 346 C LYS A 48 8.645 -18.335 -7.098 1.00 0.00 C ATOM 347 O LYS A 48 8.932 -19.051 -8.057 1.00 0.00 O ATOM 348 CB LYS A 48 6.643 -16.751 -6.882 1.00 0.00 C ATOM 349 CG LYS A 48 5.134 -16.775 -7.128 1.00 0.00 C ATOM 350 CD LYS A 48 4.822 -16.765 -8.626 1.00 0.00 C ATOM 351 CE LYS A 48 3.349 -17.091 -8.882 1.00 0.00 C ATOM 352 NZ LYS A 48 2.984 -16.775 -10.281 1.00 0.00 N ATOM 0 H LYS A 48 6.761 -17.804 -4.646 1.00 0.00 H new ATOM 0 HA LYS A 48 6.586 -18.812 -7.304 1.00 0.00 H new ATOM 0 HB2 LYS A 48 6.863 -16.136 -6.009 1.00 0.00 H new ATOM 0 HB3 LYS A 48 7.146 -16.290 -7.732 1.00 0.00 H new ATOM 0 HG2 LYS A 48 4.701 -17.664 -6.669 1.00 0.00 H new ATOM 0 HG3 LYS A 48 4.670 -15.912 -6.651 1.00 0.00 H new ATOM 0 HD2 LYS A 48 5.060 -15.787 -9.044 1.00 0.00 H new ATOM 0 HD3 LYS A 48 5.453 -17.492 -9.137 1.00 0.00 H new ATOM 0 HE2 LYS A 48 3.164 -18.146 -8.681 1.00 0.00 H new ATOM 0 HE3 LYS A 48 2.720 -16.521 -8.198 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 1.981 -17.002 -10.438 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 3.142 -15.763 -10.461 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 3.572 -17.338 -10.929 1.00 0.00 H new ATOM 353 N VAL A 49 9.527 -17.666 -6.371 1.00 0.00 N ATOM 354 CA VAL A 49 10.948 -17.735 -6.668 1.00 0.00 C ATOM 355 C VAL A 49 11.361 -19.200 -6.825 1.00 0.00 C ATOM 356 O VAL A 49 12.113 -19.542 -7.736 1.00 0.00 O ATOM 357 CB VAL A 49 11.744 -17.002 -5.586 1.00 0.00 C ATOM 358 CG1 VAL A 49 13.164 -17.562 -5.477 1.00 0.00 C ATOM 359 CG2 VAL A 49 11.768 -15.495 -5.850 1.00 0.00 C ATOM 0 H VAL A 49 9.286 -17.073 -5.577 1.00 0.00 H new ATOM 0 HA VAL A 49 11.167 -17.233 -7.610 1.00 0.00 H new ATOM 0 HB VAL A 49 11.244 -17.167 -4.632 1.00 0.00 H new ATOM 0 HG11 VAL A 49 13.709 -17.024 -4.701 1.00 0.00 H new ATOM 0 HG12 VAL A 49 13.119 -18.621 -5.221 1.00 0.00 H new ATOM 0 HG13 VAL A 49 13.677 -17.441 -6.431 1.00 0.00 H new ATOM 0 HG21 VAL A 49 12.340 -14.997 -5.067 1.00 0.00 H new ATOM 0 HG22 VAL A 49 12.233 -15.302 -6.817 1.00 0.00 H new ATOM 0 HG23 VAL A 49 10.748 -15.110 -5.855 1.00 0.00 H new ATOM 360 N LEU A 50 10.851 -20.025 -5.922 1.00 0.00 N ATOM 361 CA LEU A 50 11.158 -21.445 -5.949 1.00 0.00 C ATOM 362 C LEU A 50 10.638 -22.050 -7.254 1.00 0.00 C ATOM 363 O LEU A 50 11.365 -22.761 -7.947 1.00 0.00 O ATOM 364 CB LEU A 50 10.618 -22.134 -4.694 1.00 0.00 C ATOM 365 CG LEU A 50 10.511 -21.259 -3.443 1.00 0.00 C ATOM 366 CD1 LEU A 50 9.994 -22.068 -2.251 1.00 0.00 C ATOM 367 CD2 LEU A 50 11.845 -20.576 -3.136 1.00 0.00 C ATOM 0 H LEU A 50 10.228 -19.737 -5.168 1.00 0.00 H new ATOM 0 HA LEU A 50 12.237 -21.602 -5.932 1.00 0.00 H new ATOM 0 HB2 LEU A 50 9.629 -22.534 -4.920 1.00 0.00 H new ATOM 0 HB3 LEU A 50 11.261 -22.984 -4.465 1.00 0.00 H new ATOM 0 HG LEU A 50 9.783 -20.471 -3.638 1.00 0.00 H new ATOM 0 HD11 LEU A 50 9.927 -21.423 -1.375 1.00 0.00 H new ATOM 0 HD12 LEU A 50 9.007 -22.468 -2.483 1.00 0.00 H new ATOM 0 HD13 LEU A 50 10.679 -22.890 -2.045 1.00 0.00 H new ATOM 0 HD21 LEU A 50 11.741 -19.960 -2.242 1.00 0.00 H new ATOM 0 HD22 LEU A 50 12.611 -21.333 -2.968 1.00 0.00 H new ATOM 0 HD23 LEU A 50 12.134 -19.947 -3.978 1.00 0.00 H new ATOM 368 N ASP A 51 9.382 -21.747 -7.551 1.00 0.00 N ATOM 369 CA ASP A 51 8.756 -22.252 -8.761 1.00 0.00 C ATOM 370 C ASP A 51 9.574 -21.810 -9.976 1.00 0.00 C ATOM 371 O ASP A 51 9.700 -22.553 -10.948 1.00 0.00 O ATOM 372 CB ASP A 51 7.338 -21.700 -8.919 1.00 0.00 C ATOM 373 CG ASP A 51 6.246 -22.760 -9.083 1.00 0.00 C ATOM 374 OD1 ASP A 51 6.383 -23.575 -10.021 1.00 0.00 O ATOM 375 OD2 ASP A 51 5.300 -22.731 -8.267 1.00 0.00 O ATOM 0 H ASP A 51 8.781 -21.158 -6.974 1.00 0.00 H new ATOM 0 HA ASP A 51 8.714 -23.339 -8.691 1.00 0.00 H new ATOM 0 HB2 ASP A 51 7.103 -21.089 -8.047 1.00 0.00 H new ATOM 0 HB3 ASP A 51 7.316 -21.040 -9.786 1.00 0.00 H new ATOM 376 N PHE A 52 10.108 -20.601 -9.881 1.00 0.00 N ATOM 377 CA PHE A 52 10.910 -20.051 -10.961 1.00 0.00 C ATOM 378 C PHE A 52 12.304 -20.681 -10.984 1.00 0.00 C ATOM 379 O PHE A 52 12.748 -21.177 -12.018 1.00 0.00 O ATOM 380 CB PHE A 52 11.046 -18.550 -10.697 1.00 0.00 C ATOM 381 CG PHE A 52 11.874 -17.806 -11.746 1.00 0.00 C ATOM 382 CD1 PHE A 52 11.447 -17.751 -13.036 1.00 0.00 C ATOM 383 CD2 PHE A 52 13.038 -17.199 -11.389 1.00 0.00 C ATOM 384 CE1 PHE A 52 12.216 -17.061 -14.010 1.00 0.00 C ATOM 385 CE2 PHE A 52 13.807 -16.509 -12.363 1.00 0.00 C ATOM 386 CZ PHE A 52 13.380 -16.454 -13.653 1.00 0.00 C ATOM 0 H PHE A 52 10.001 -19.987 -9.073 1.00 0.00 H new ATOM 0 HA PHE A 52 10.433 -20.254 -11.920 1.00 0.00 H new ATOM 0 HB2 PHE A 52 10.051 -18.108 -10.654 1.00 0.00 H new ATOM 0 HB3 PHE A 52 11.503 -18.404 -9.718 1.00 0.00 H new ATOM 0 HD1 PHE A 52 10.523 -18.232 -13.320 1.00 0.00 H new ATOM 0 HD2 PHE A 52 13.377 -17.242 -10.365 1.00 0.00 H new ATOM 0 HE1 PHE A 52 11.877 -17.018 -15.034 1.00 0.00 H new ATOM 0 HE2 PHE A 52 14.731 -16.028 -12.079 1.00 0.00 H new ATOM 0 HZ PHE A 52 13.965 -15.929 -14.394 1.00 0.00 H new ATOM 387 N GLY A 53 12.957 -20.640 -9.831 1.00 0.00 N ATOM 388 CA GLY A 53 14.291 -21.200 -9.707 1.00 0.00 C ATOM 389 C GLY A 53 15.297 -20.131 -9.274 1.00 0.00 C ATOM 390 O GLY A 53 15.682 -19.278 -10.071 1.00 0.00 O ATOM 0 H GLY A 53 12.586 -20.227 -8.975 1.00 0.00 H new ATOM 0 HA2 GLY A 53 14.282 -22.012 -8.980 1.00 0.00 H new ATOM 0 HA3 GLY A 53 14.599 -21.629 -10.660 1.00 0.00 H new ATOM 391 N ILE A 54 15.693 -20.213 -8.012 1.00 0.00 N ATOM 392 CA ILE A 54 16.646 -19.263 -7.464 1.00 0.00 C ATOM 393 C ILE A 54 17.807 -19.089 -8.445 1.00 0.00 C ATOM 394 O ILE A 54 18.320 -17.984 -8.613 1.00 0.00 O ATOM 395 CB ILE A 54 17.084 -19.693 -6.062 1.00 0.00 C ATOM 396 CG1 ILE A 54 15.940 -20.385 -5.318 1.00 0.00 C ATOM 397 CG2 ILE A 54 17.645 -18.507 -5.276 1.00 0.00 C ATOM 398 CD1 ILE A 54 16.089 -21.907 -5.377 1.00 0.00 C ATOM 0 H ILE A 54 15.371 -20.923 -7.354 1.00 0.00 H new ATOM 0 HA ILE A 54 16.182 -18.284 -7.342 1.00 0.00 H new ATOM 0 HB ILE A 54 17.888 -20.422 -6.163 1.00 0.00 H new ATOM 0 HG12 ILE A 54 15.927 -20.057 -4.279 1.00 0.00 H new ATOM 0 HG13 ILE A 54 14.986 -20.092 -5.757 1.00 0.00 H new ATOM 0 HG21 ILE A 54 17.949 -18.839 -4.283 1.00 0.00 H new ATOM 0 HG22 ILE A 54 18.508 -18.098 -5.802 1.00 0.00 H new ATOM 0 HG23 ILE A 54 16.879 -17.738 -5.182 1.00 0.00 H new ATOM 0 HD11 ILE A 54 15.263 -22.374 -4.841 1.00 0.00 H new ATOM 0 HD12 ILE A 54 16.078 -22.234 -6.417 1.00 0.00 H new ATOM 0 HD13 ILE A 54 17.033 -22.198 -4.916 1.00 0.00 H new ATOM 399 N ASP A 55 18.186 -20.196 -9.066 1.00 0.00 N ATOM 400 CA ASP A 55 19.277 -20.178 -10.026 1.00 0.00 C ATOM 401 C ASP A 55 18.893 -19.293 -11.213 1.00 0.00 C ATOM 402 O ASP A 55 19.723 -18.549 -11.732 1.00 0.00 O ATOM 403 CB ASP A 55 19.565 -21.584 -10.558 1.00 0.00 C ATOM 404 CG ASP A 55 20.707 -22.320 -9.855 1.00 0.00 C ATOM 405 OD1 ASP A 55 20.773 -22.210 -8.611 1.00 0.00 O ATOM 406 OD2 ASP A 55 21.489 -22.975 -10.577 1.00 0.00 O ATOM 0 H ASP A 55 17.758 -21.111 -8.923 1.00 0.00 H new ATOM 0 HA ASP A 55 20.164 -19.794 -9.521 1.00 0.00 H new ATOM 0 HB2 ASP A 55 18.658 -22.182 -10.469 1.00 0.00 H new ATOM 0 HB3 ASP A 55 19.798 -21.513 -11.620 1.00 0.00 H new ATOM 407 N LYS A 56 17.633 -19.403 -11.608 1.00 0.00 N ATOM 408 CA LYS A 56 17.128 -18.622 -12.724 1.00 0.00 C ATOM 409 C LYS A 56 17.294 -17.132 -12.415 1.00 0.00 C ATOM 410 O LYS A 56 17.903 -16.398 -13.191 1.00 0.00 O ATOM 411 CB LYS A 56 15.689 -19.025 -13.053 1.00 0.00 C ATOM 412 CG LYS A 56 15.587 -20.528 -13.316 1.00 0.00 C ATOM 413 CD LYS A 56 16.078 -20.873 -14.724 1.00 0.00 C ATOM 414 CE LYS A 56 15.841 -22.351 -15.041 1.00 0.00 C ATOM 415 NZ LYS A 56 15.958 -22.594 -16.496 1.00 0.00 N ATOM 0 H LYS A 56 16.947 -20.021 -11.175 1.00 0.00 H new ATOM 0 HA LYS A 56 17.706 -18.828 -13.625 1.00 0.00 H new ATOM 0 HB2 LYS A 56 15.033 -18.752 -12.227 1.00 0.00 H new ATOM 0 HB3 LYS A 56 15.345 -18.475 -13.929 1.00 0.00 H new ATOM 0 HG2 LYS A 56 16.177 -21.071 -12.578 1.00 0.00 H new ATOM 0 HG3 LYS A 56 14.553 -20.852 -13.198 1.00 0.00 H new ATOM 0 HD2 LYS A 56 15.560 -20.253 -15.456 1.00 0.00 H new ATOM 0 HD3 LYS A 56 17.141 -20.645 -14.808 1.00 0.00 H new ATOM 0 HE2 LYS A 56 16.565 -22.965 -14.504 1.00 0.00 H new ATOM 0 HE3 LYS A 56 14.851 -22.649 -14.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 15.794 -23.602 -16.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 15.251 -22.023 -17.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 16.911 -22.329 -16.817 1.00 0.00 H new ATOM 416 N LEU A 57 16.741 -16.731 -11.280 1.00 0.00 N ATOM 417 CA LEU A 57 16.820 -15.342 -10.859 1.00 0.00 C ATOM 418 C LEU A 57 18.245 -14.828 -11.077 1.00 0.00 C ATOM 419 O LEU A 57 18.439 -13.700 -11.528 1.00 0.00 O ATOM 420 CB LEU A 57 16.325 -15.190 -9.419 1.00 0.00 C ATOM 421 CG LEU A 57 14.835 -14.886 -9.251 1.00 0.00 C ATOM 422 CD1 LEU A 57 14.137 -15.990 -8.454 1.00 0.00 C ATOM 423 CD2 LEU A 57 14.624 -13.506 -8.625 1.00 0.00 C ATOM 0 H LEU A 57 16.236 -17.343 -10.639 1.00 0.00 H new ATOM 0 HA LEU A 57 16.160 -14.722 -11.466 1.00 0.00 H new ATOM 0 HB2 LEU A 57 16.551 -16.109 -8.879 1.00 0.00 H new ATOM 0 HB3 LEU A 57 16.894 -14.392 -8.942 1.00 0.00 H new ATOM 0 HG LEU A 57 14.377 -14.864 -10.240 1.00 0.00 H new ATOM 0 HD11 LEU A 57 13.079 -15.750 -8.349 1.00 0.00 H new ATOM 0 HD12 LEU A 57 14.243 -16.940 -8.978 1.00 0.00 H new ATOM 0 HD13 LEU A 57 14.591 -16.068 -7.466 1.00 0.00 H new ATOM 0 HD21 LEU A 57 13.556 -13.315 -8.517 1.00 0.00 H new ATOM 0 HD22 LEU A 57 15.100 -13.475 -7.645 1.00 0.00 H new ATOM 0 HD23 LEU A 57 15.066 -12.744 -9.267 1.00 0.00 H new ATOM 424 N ILE A 58 19.204 -15.680 -10.747 1.00 0.00 N ATOM 425 CA ILE A 58 20.605 -15.326 -10.902 1.00 0.00 C ATOM 426 C ILE A 58 20.953 -15.276 -12.391 1.00 0.00 C ATOM 427 O ILE A 58 21.630 -14.354 -12.843 1.00 0.00 O ATOM 428 CB ILE A 58 21.490 -16.279 -10.095 1.00 0.00 C ATOM 429 CG1 ILE A 58 21.570 -15.845 -8.630 1.00 0.00 C ATOM 430 CG2 ILE A 58 22.876 -16.410 -10.731 1.00 0.00 C ATOM 431 CD1 ILE A 58 20.303 -16.243 -7.871 1.00 0.00 C ATOM 0 H ILE A 58 19.039 -16.614 -10.373 1.00 0.00 H new ATOM 0 HA ILE A 58 20.794 -14.332 -10.497 1.00 0.00 H new ATOM 0 HB ILE A 58 21.032 -17.268 -10.113 1.00 0.00 H new ATOM 0 HG12 ILE A 58 22.440 -16.302 -8.158 1.00 0.00 H new ATOM 0 HG13 ILE A 58 21.708 -14.765 -8.574 1.00 0.00 H new ATOM 0 HG21 ILE A 58 23.485 -17.093 -10.138 1.00 0.00 H new ATOM 0 HG22 ILE A 58 22.776 -16.799 -11.744 1.00 0.00 H new ATOM 0 HG23 ILE A 58 23.355 -15.432 -10.764 1.00 0.00 H new ATOM 0 HD11 ILE A 58 20.385 -15.923 -6.832 1.00 0.00 H new ATOM 0 HD12 ILE A 58 19.438 -15.764 -8.331 1.00 0.00 H new ATOM 0 HD13 ILE A 58 20.181 -17.326 -7.909 1.00 0.00 H new ATOM 432 N GLN A 59 20.474 -16.278 -13.112 1.00 0.00 N ATOM 433 CA GLN A 59 20.725 -16.360 -14.541 1.00 0.00 C ATOM 434 C GLN A 59 20.286 -15.067 -15.231 1.00 0.00 C ATOM 435 O GLN A 59 20.974 -14.571 -16.123 1.00 0.00 O ATOM 436 CB GLN A 59 20.024 -17.574 -15.153 1.00 0.00 C ATOM 437 CG GLN A 59 20.965 -18.779 -15.211 1.00 0.00 C ATOM 438 CD GLN A 59 20.354 -19.912 -16.038 1.00 0.00 C ATOM 439 OE1 GLN A 59 20.567 -20.028 -17.233 1.00 0.00 O ATOM 440 NE2 GLN A 59 19.584 -20.739 -15.335 1.00 0.00 N ATOM 0 H GLN A 59 19.913 -17.041 -12.733 1.00 0.00 H new ATOM 0 HA GLN A 59 21.797 -16.486 -14.695 1.00 0.00 H new ATOM 0 HB2 GLN A 59 19.142 -17.825 -14.563 1.00 0.00 H new ATOM 0 HB3 GLN A 59 19.677 -17.330 -16.157 1.00 0.00 H new ATOM 0 HG2 GLN A 59 21.919 -18.480 -15.646 1.00 0.00 H new ATOM 0 HG3 GLN A 59 21.172 -19.132 -14.201 1.00 0.00 H new ATOM 0 HE21 GLN A 59 19.448 -20.584 -14.336 1.00 0.00 H new ATOM 0 HE22 GLN A 59 19.130 -21.528 -15.795 1.00 0.00 H new ATOM 441 N LEU A 60 19.144 -14.559 -14.794 1.00 0.00 N ATOM 442 CA LEU A 60 18.605 -13.333 -15.359 1.00 0.00 C ATOM 443 C LEU A 60 19.594 -12.190 -15.123 1.00 0.00 C ATOM 444 O LEU A 60 20.078 -11.577 -16.073 1.00 0.00 O ATOM 445 CB LEU A 60 17.205 -13.059 -14.807 1.00 0.00 C ATOM 446 CG LEU A 60 16.170 -14.165 -15.024 1.00 0.00 C ATOM 447 CD1 LEU A 60 14.749 -13.630 -14.836 1.00 0.00 C ATOM 448 CD2 LEU A 60 16.356 -14.830 -16.390 1.00 0.00 C ATOM 0 H LEU A 60 18.576 -14.974 -14.055 1.00 0.00 H new ATOM 0 HA LEU A 60 18.483 -13.432 -16.438 1.00 0.00 H new ATOM 0 HB2 LEU A 60 17.288 -12.872 -13.736 1.00 0.00 H new ATOM 0 HB3 LEU A 60 16.829 -12.143 -15.263 1.00 0.00 H new ATOM 0 HG LEU A 60 16.328 -14.934 -14.268 1.00 0.00 H new ATOM 0 HD11 LEU A 60 14.033 -14.436 -14.996 1.00 0.00 H new ATOM 0 HD12 LEU A 60 14.638 -13.241 -13.824 1.00 0.00 H new ATOM 0 HD13 LEU A 60 14.563 -12.831 -15.554 1.00 0.00 H new ATOM 0 HD21 LEU A 60 15.608 -15.612 -16.519 1.00 0.00 H new ATOM 0 HD22 LEU A 60 16.240 -14.084 -17.176 1.00 0.00 H new ATOM 0 HD23 LEU A 60 17.352 -15.268 -16.449 1.00 0.00 H new ATOM 449 N ILE A 61 19.864 -11.937 -13.851 1.00 0.00 N ATOM 450 CA ILE A 61 20.787 -10.878 -13.478 1.00 0.00 C ATOM 451 C ILE A 61 22.059 -10.997 -14.319 1.00 0.00 C ATOM 452 O ILE A 61 22.593 -9.992 -14.788 1.00 0.00 O ATOM 453 CB ILE A 61 21.043 -10.897 -11.969 1.00 0.00 C ATOM 454 CG1 ILE A 61 20.625 -9.574 -11.326 1.00 0.00 C ATOM 455 CG2 ILE A 61 22.500 -11.248 -11.665 1.00 0.00 C ATOM 456 CD1 ILE A 61 19.910 -9.813 -9.994 1.00 0.00 C ATOM 0 H ILE A 61 19.460 -12.447 -13.065 1.00 0.00 H new ATOM 0 HA ILE A 61 20.353 -9.901 -13.692 1.00 0.00 H new ATOM 0 HB ILE A 61 20.425 -11.679 -11.527 1.00 0.00 H new ATOM 0 HG12 ILE A 61 21.504 -8.951 -11.164 1.00 0.00 H new ATOM 0 HG13 ILE A 61 19.968 -9.028 -12.003 1.00 0.00 H new ATOM 0 HG21 ILE A 61 22.655 -11.255 -10.586 1.00 0.00 H new ATOM 0 HG22 ILE A 61 22.729 -12.233 -12.071 1.00 0.00 H new ATOM 0 HG23 ILE A 61 23.156 -10.506 -12.121 1.00 0.00 H new ATOM 0 HD11 ILE A 61 19.624 -8.856 -9.558 1.00 0.00 H new ATOM 0 HD12 ILE A 61 19.018 -10.416 -10.163 1.00 0.00 H new ATOM 0 HD13 ILE A 61 20.579 -10.337 -9.311 1.00 0.00 H new ATOM 457 N GLU A 62 22.508 -12.232 -14.485 1.00 0.00 N ATOM 458 CA GLU A 62 23.708 -12.494 -15.261 1.00 0.00 C ATOM 459 C GLU A 62 23.574 -11.897 -16.663 1.00 0.00 C ATOM 460 O GLU A 62 24.528 -11.329 -17.193 1.00 0.00 O ATOM 461 CB GLU A 62 23.999 -13.995 -15.330 1.00 0.00 C ATOM 462 CG GLU A 62 24.775 -14.460 -14.097 1.00 0.00 C ATOM 463 CD GLU A 62 26.222 -14.805 -14.458 1.00 0.00 C ATOM 464 OE1 GLU A 62 26.396 -15.724 -15.288 1.00 0.00 O ATOM 465 OE2 GLU A 62 27.120 -14.143 -13.895 1.00 0.00 O ATOM 0 H GLU A 62 22.062 -13.063 -14.095 1.00 0.00 H new ATOM 0 HA GLU A 62 24.551 -12.016 -14.763 1.00 0.00 H new ATOM 0 HB2 GLU A 62 23.062 -14.548 -15.404 1.00 0.00 H new ATOM 0 HB3 GLU A 62 24.572 -14.217 -16.230 1.00 0.00 H new ATOM 0 HG2 GLU A 62 24.762 -13.677 -13.338 1.00 0.00 H new ATOM 0 HG3 GLU A 62 24.287 -15.333 -13.663 1.00 0.00 H new ATOM 466 N ASP A 63 22.382 -12.044 -17.223 1.00 0.00 N ATOM 467 CA ASP A 63 22.112 -11.525 -18.553 1.00 0.00 C ATOM 468 C ASP A 63 21.970 -10.004 -18.484 1.00 0.00 C ATOM 469 O ASP A 63 22.747 -9.275 -19.099 1.00 0.00 O ATOM 470 CB ASP A 63 20.807 -12.097 -19.112 1.00 0.00 C ATOM 471 CG ASP A 63 20.837 -12.438 -20.603 1.00 0.00 C ATOM 472 OD1 ASP A 63 21.818 -12.026 -21.260 1.00 0.00 O ATOM 473 OD2 ASP A 63 19.878 -13.101 -21.053 1.00 0.00 O ATOM 0 H ASP A 63 21.593 -12.515 -16.780 1.00 0.00 H new ATOM 0 HA ASP A 63 22.940 -11.812 -19.202 1.00 0.00 H new ATOM 0 HB2 ASP A 63 20.554 -12.998 -18.554 1.00 0.00 H new ATOM 0 HB3 ASP A 63 20.007 -11.378 -18.935 1.00 0.00 H new ATOM 474 N LYS A 64 20.971 -9.568 -17.729 1.00 0.00 N ATOM 475 CA LYS A 64 20.718 -8.146 -17.571 1.00 0.00 C ATOM 476 C LYS A 64 19.267 -7.937 -17.133 1.00 0.00 C ATOM 477 O LYS A 64 18.442 -7.459 -17.911 1.00 0.00 O ATOM 478 CB LYS A 64 21.090 -7.391 -18.848 1.00 0.00 C ATOM 479 CG LYS A 64 20.366 -6.044 -18.919 1.00 0.00 C ATOM 480 CD LYS A 64 19.277 -6.063 -19.993 1.00 0.00 C ATOM 481 CE LYS A 64 18.042 -5.284 -19.536 1.00 0.00 C ATOM 482 NZ LYS A 64 16.837 -5.751 -20.257 1.00 0.00 N ATOM 0 H LYS A 64 20.328 -10.175 -17.220 1.00 0.00 H new ATOM 0 HA LYS A 64 21.351 -7.731 -16.787 1.00 0.00 H new ATOM 0 HB2 LYS A 64 22.168 -7.231 -18.879 1.00 0.00 H new ATOM 0 HB3 LYS A 64 20.832 -7.993 -19.719 1.00 0.00 H new ATOM 0 HG2 LYS A 64 19.922 -5.814 -17.950 1.00 0.00 H new ATOM 0 HG3 LYS A 64 21.083 -5.253 -19.137 1.00 0.00 H new ATOM 0 HD2 LYS A 64 19.664 -5.630 -20.916 1.00 0.00 H new ATOM 0 HD3 LYS A 64 18.999 -7.093 -20.216 1.00 0.00 H new ATOM 0 HE2 LYS A 64 17.902 -5.410 -18.462 1.00 0.00 H new ATOM 0 HE3 LYS A 64 18.190 -4.219 -19.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 16.009 -5.211 -19.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 16.967 -5.608 -21.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 16.688 -6.762 -20.065 1.00 0.00 H new ATOM 483 N VAL A 65 18.998 -8.306 -15.889 1.00 0.00 N ATOM 484 CA VAL A 65 17.661 -8.164 -15.338 1.00 0.00 C ATOM 485 C VAL A 65 17.750 -7.516 -13.955 1.00 0.00 C ATOM 486 O VAL A 65 18.247 -8.126 -13.010 1.00 0.00 O ATOM 487 CB VAL A 65 16.958 -9.523 -15.317 1.00 0.00 C ATOM 488 CG1 VAL A 65 15.473 -9.366 -14.984 1.00 0.00 C ATOM 489 CG2 VAL A 65 17.147 -10.259 -16.645 1.00 0.00 C ATOM 0 H VAL A 65 19.684 -8.703 -15.247 1.00 0.00 H new ATOM 0 HA VAL A 65 17.056 -7.509 -15.965 1.00 0.00 H new ATOM 0 HB VAL A 65 17.416 -10.125 -14.532 1.00 0.00 H new ATOM 0 HG11 VAL A 65 14.996 -10.346 -14.975 1.00 0.00 H new ATOM 0 HG12 VAL A 65 15.367 -8.902 -14.003 1.00 0.00 H new ATOM 0 HG13 VAL A 65 14.996 -8.737 -15.736 1.00 0.00 H new ATOM 0 HG21 VAL A 65 16.638 -11.222 -16.603 1.00 0.00 H new ATOM 0 HG22 VAL A 65 16.728 -9.662 -17.455 1.00 0.00 H new ATOM 0 HG23 VAL A 65 18.210 -10.419 -16.824 1.00 0.00 H new ATOM 490 N ASP A 66 17.260 -6.287 -13.881 1.00 0.00 N ATOM 491 CA ASP A 66 17.277 -5.549 -12.630 1.00 0.00 C ATOM 492 C ASP A 66 16.724 -6.435 -11.512 1.00 0.00 C ATOM 493 O ASP A 66 16.320 -7.571 -11.758 1.00 0.00 O ATOM 494 CB ASP A 66 16.403 -4.296 -12.717 1.00 0.00 C ATOM 495 CG ASP A 66 16.411 -3.595 -14.077 1.00 0.00 C ATOM 496 OD1 ASP A 66 17.284 -2.720 -14.259 1.00 0.00 O ATOM 497 OD2 ASP A 66 15.543 -3.951 -14.903 1.00 0.00 O ATOM 0 H ASP A 66 16.849 -5.784 -14.667 1.00 0.00 H new ATOM 0 HA ASP A 66 18.307 -5.256 -12.426 1.00 0.00 H new ATOM 0 HB2 ASP A 66 15.377 -4.570 -12.472 1.00 0.00 H new ATOM 0 HB3 ASP A 66 16.734 -3.587 -11.958 1.00 0.00 H new ATOM 498 N ALA A 67 16.723 -5.882 -10.308 1.00 0.00 N ATOM 499 CA ALA A 67 16.225 -6.608 -9.152 1.00 0.00 C ATOM 500 C ALA A 67 14.699 -6.507 -9.109 1.00 0.00 C ATOM 501 O ALA A 67 14.029 -7.391 -8.577 1.00 0.00 O ATOM 502 CB ALA A 67 16.881 -6.060 -7.883 1.00 0.00 C ATOM 0 H ALA A 67 17.059 -4.940 -10.108 1.00 0.00 H new ATOM 0 HA ALA A 67 16.483 -7.665 -9.223 1.00 0.00 H new ATOM 0 HB1 ALA A 67 16.507 -6.605 -7.016 1.00 0.00 H new ATOM 0 HB2 ALA A 67 17.962 -6.182 -7.950 1.00 0.00 H new ATOM 0 HB3 ALA A 67 16.642 -5.002 -7.778 1.00 0.00 H new ATOM 503 N ASN A 68 14.194 -5.422 -9.677 1.00 0.00 N ATOM 504 CA ASN A 68 12.759 -5.194 -9.710 1.00 0.00 C ATOM 505 C ASN A 68 12.154 -5.950 -10.895 1.00 0.00 C ATOM 506 O ASN A 68 11.173 -6.675 -10.737 1.00 0.00 O ATOM 507 CB ASN A 68 12.442 -3.707 -9.886 1.00 0.00 C ATOM 508 CG ASN A 68 11.565 -3.195 -8.743 1.00 0.00 C ATOM 509 OD1 ASN A 68 12.033 -2.608 -7.781 1.00 0.00 O ATOM 510 ND2 ASN A 68 10.268 -3.448 -8.900 1.00 0.00 N ATOM 0 H ASN A 68 14.752 -4.691 -10.118 1.00 0.00 H new ATOM 0 HA ASN A 68 12.340 -5.543 -8.766 1.00 0.00 H new ATOM 0 HB2 ASN A 68 13.369 -3.135 -9.922 1.00 0.00 H new ATOM 0 HB3 ASN A 68 11.934 -3.550 -10.837 1.00 0.00 H new ATOM 0 HD21 ASN A 68 9.600 -3.146 -8.191 1.00 0.00 H new ATOM 0 HD22 ASN A 68 9.942 -3.944 -9.729 1.00 0.00 H new ATOM 511 N ALA A 69 12.765 -5.755 -12.054 1.00 0.00 N ATOM 512 CA ALA A 69 12.299 -6.409 -13.265 1.00 0.00 C ATOM 513 C ALA A 69 12.208 -7.917 -13.022 1.00 0.00 C ATOM 514 O ALA A 69 11.310 -8.580 -13.539 1.00 0.00 O ATOM 515 CB ALA A 69 13.234 -6.062 -14.426 1.00 0.00 C ATOM 0 H ALA A 69 13.579 -5.153 -12.180 1.00 0.00 H new ATOM 0 HA ALA A 69 11.303 -6.056 -13.532 1.00 0.00 H new ATOM 0 HB1 ALA A 69 12.884 -6.553 -15.334 1.00 0.00 H new ATOM 0 HB2 ALA A 69 13.242 -4.983 -14.577 1.00 0.00 H new ATOM 0 HB3 ALA A 69 14.243 -6.403 -14.195 1.00 0.00 H new ATOM 516 N ILE A 70 13.149 -8.415 -12.234 1.00 0.00 N ATOM 517 CA ILE A 70 13.186 -9.832 -11.916 1.00 0.00 C ATOM 518 C ILE A 70 12.078 -10.154 -10.911 1.00 0.00 C ATOM 519 O ILE A 70 11.369 -11.148 -11.060 1.00 0.00 O ATOM 520 CB ILE A 70 14.583 -10.239 -11.441 1.00 0.00 C ATOM 521 CG1 ILE A 70 15.251 -11.179 -12.447 1.00 0.00 C ATOM 522 CG2 ILE A 70 14.531 -10.844 -10.037 1.00 0.00 C ATOM 523 CD1 ILE A 70 15.185 -12.631 -11.968 1.00 0.00 C ATOM 0 H ILE A 70 13.892 -7.862 -11.806 1.00 0.00 H new ATOM 0 HA ILE A 70 12.992 -10.427 -12.808 1.00 0.00 H new ATOM 0 HB ILE A 70 15.199 -9.341 -11.381 1.00 0.00 H new ATOM 0 HG12 ILE A 70 14.760 -11.089 -13.416 1.00 0.00 H new ATOM 0 HG13 ILE A 70 16.291 -10.886 -12.589 1.00 0.00 H new ATOM 0 HG21 ILE A 70 15.537 -11.124 -9.724 1.00 0.00 H new ATOM 0 HG22 ILE A 70 14.125 -10.111 -9.340 1.00 0.00 H new ATOM 0 HG23 ILE A 70 13.894 -11.728 -10.045 1.00 0.00 H new ATOM 0 HD11 ILE A 70 15.667 -13.278 -12.701 1.00 0.00 H new ATOM 0 HD12 ILE A 70 15.698 -12.722 -11.011 1.00 0.00 H new ATOM 0 HD13 ILE A 70 14.143 -12.928 -11.851 1.00 0.00 H new ATOM 524 N CYS A 71 11.963 -9.294 -9.909 1.00 0.00 N ATOM 525 CA CYS A 71 10.953 -9.474 -8.880 1.00 0.00 C ATOM 526 C CYS A 71 9.576 -9.289 -9.521 1.00 0.00 C ATOM 527 O CYS A 71 8.555 -9.581 -8.901 1.00 0.00 O ATOM 528 CB CYS A 71 11.168 -8.521 -7.704 1.00 0.00 C ATOM 529 SG CYS A 71 10.751 -9.218 -6.064 1.00 0.00 S ATOM 0 H CYS A 71 12.553 -8.471 -9.788 1.00 0.00 H new ATOM 0 HA CYS A 71 11.027 -10.479 -8.466 1.00 0.00 H new ATOM 0 HB2 CYS A 71 12.212 -8.207 -7.695 1.00 0.00 H new ATOM 0 HB3 CYS A 71 10.568 -7.626 -7.866 1.00 0.00 H new ATOM 530 N ALA A 72 9.593 -8.804 -10.754 1.00 0.00 N ATOM 531 CA ALA A 72 8.358 -8.576 -11.485 1.00 0.00 C ATOM 532 C ALA A 72 7.918 -9.880 -12.153 1.00 0.00 C ATOM 533 O ALA A 72 6.729 -10.193 -12.188 1.00 0.00 O ATOM 534 CB ALA A 72 8.564 -7.444 -12.494 1.00 0.00 C ATOM 0 H ALA A 72 10.442 -8.563 -11.265 1.00 0.00 H new ATOM 0 HA ALA A 72 7.562 -8.268 -10.807 1.00 0.00 H new ATOM 0 HB1 ALA A 72 7.638 -7.273 -13.043 1.00 0.00 H new ATOM 0 HB2 ALA A 72 8.847 -6.533 -11.966 1.00 0.00 H new ATOM 0 HB3 ALA A 72 9.354 -7.719 -13.193 1.00 0.00 H new ATOM 535 N LYS A 73 8.901 -10.605 -12.668 1.00 0.00 N ATOM 536 CA LYS A 73 8.630 -11.868 -13.333 1.00 0.00 C ATOM 537 C LYS A 73 7.849 -12.781 -12.386 1.00 0.00 C ATOM 538 O LYS A 73 6.691 -13.107 -12.646 1.00 0.00 O ATOM 539 CB LYS A 73 9.927 -12.488 -13.854 1.00 0.00 C ATOM 540 CG LYS A 73 9.648 -13.786 -14.616 1.00 0.00 C ATOM 541 CD LYS A 73 9.710 -14.995 -13.681 1.00 0.00 C ATOM 542 CE LYS A 73 9.128 -16.239 -14.354 1.00 0.00 C ATOM 543 NZ LYS A 73 8.249 -16.973 -13.416 1.00 0.00 N ATOM 0 H LYS A 73 9.886 -10.341 -12.638 1.00 0.00 H new ATOM 0 HA LYS A 73 8.004 -11.709 -14.211 1.00 0.00 H new ATOM 0 HB2 LYS A 73 10.435 -11.780 -14.509 1.00 0.00 H new ATOM 0 HB3 LYS A 73 10.599 -12.689 -13.020 1.00 0.00 H new ATOM 0 HG2 LYS A 73 8.665 -13.733 -15.083 1.00 0.00 H new ATOM 0 HG3 LYS A 73 10.376 -13.905 -15.418 1.00 0.00 H new ATOM 0 HD2 LYS A 73 10.744 -15.183 -13.393 1.00 0.00 H new ATOM 0 HD3 LYS A 73 9.158 -14.780 -12.766 1.00 0.00 H new ATOM 0 HE2 LYS A 73 8.563 -15.950 -15.240 1.00 0.00 H new ATOM 0 HE3 LYS A 73 9.936 -16.890 -14.689 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 7.732 -17.713 -13.932 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 8.826 -17.410 -12.669 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 7.571 -16.312 -12.987 1.00 0.00 H new ATOM 544 N ILE A 74 8.513 -13.168 -11.307 1.00 0.00 N ATOM 545 CA ILE A 74 7.896 -14.037 -10.320 1.00 0.00 C ATOM 546 C ILE A 74 6.762 -13.284 -9.621 1.00 0.00 C ATOM 547 O ILE A 74 6.060 -13.849 -8.784 1.00 0.00 O ATOM 548 CB ILE A 74 8.950 -14.591 -9.359 1.00 0.00 C ATOM 549 CG1 ILE A 74 10.068 -13.573 -9.127 1.00 0.00 C ATOM 550 CG2 ILE A 74 9.491 -15.934 -9.853 1.00 0.00 C ATOM 551 CD1 ILE A 74 11.280 -13.879 -10.010 1.00 0.00 C ATOM 0 H ILE A 74 9.473 -12.895 -11.095 1.00 0.00 H new ATOM 0 HA ILE A 74 7.451 -14.907 -10.804 1.00 0.00 H new ATOM 0 HB ILE A 74 8.473 -14.771 -8.396 1.00 0.00 H new ATOM 0 HG12 ILE A 74 9.701 -12.569 -9.342 1.00 0.00 H new ATOM 0 HG13 ILE A 74 10.365 -13.586 -8.078 1.00 0.00 H new ATOM 0 HG21 ILE A 74 10.238 -16.305 -9.152 1.00 0.00 H new ATOM 0 HG22 ILE A 74 8.673 -16.651 -9.926 1.00 0.00 H new ATOM 0 HG23 ILE A 74 9.947 -15.804 -10.834 1.00 0.00 H new ATOM 0 HD11 ILE A 74 12.060 -13.141 -9.826 1.00 0.00 H new ATOM 0 HD12 ILE A 74 11.659 -14.874 -9.776 1.00 0.00 H new ATOM 0 HD13 ILE A 74 10.985 -13.841 -11.059 1.00 0.00 H new ATOM 552 N HIS A 75 6.619 -12.020 -9.990 1.00 0.00 N ATOM 553 CA HIS A 75 5.583 -11.183 -9.410 1.00 0.00 C ATOM 554 C HIS A 75 5.781 -11.098 -7.895 1.00 0.00 C ATOM 555 O HIS A 75 4.811 -11.080 -7.138 1.00 0.00 O ATOM 556 CB HIS A 75 4.193 -11.691 -9.798 1.00 0.00 C ATOM 557 CG HIS A 75 3.064 -11.025 -9.049 1.00 0.00 C ATOM 558 ND1 HIS A 75 2.140 -11.734 -8.301 1.00 0.00 N ATOM 559 CD2 HIS A 75 2.721 -9.709 -8.939 1.00 0.00 C ATOM 560 CE1 HIS A 75 1.283 -10.873 -7.770 1.00 0.00 C ATOM 561 NE2 HIS A 75 1.645 -9.619 -8.167 1.00 0.00 N ATOM 0 H HIS A 75 7.204 -11.555 -10.684 1.00 0.00 H new ATOM 0 HA HIS A 75 5.661 -10.172 -9.810 1.00 0.00 H new ATOM 0 HB2 HIS A 75 4.047 -11.537 -10.867 1.00 0.00 H new ATOM 0 HB3 HIS A 75 4.148 -12.766 -9.622 1.00 0.00 H new ATOM 0 HD2 HIS A 75 3.237 -8.881 -9.402 1.00 0.00 H new ATOM 0 HE1 HIS A 75 0.445 -11.121 -7.135 1.00 0.00 H new ATOM 0 HE2 HIS A 75 1.167 -8.754 -7.912 1.00 0.00 H new ATOM 562 N ALA A 76 7.044 -11.047 -7.497 1.00 0.00 N ATOM 563 CA ALA A 76 7.382 -10.964 -6.087 1.00 0.00 C ATOM 564 C ALA A 76 7.244 -9.514 -5.618 1.00 0.00 C ATOM 565 O ALA A 76 8.180 -8.949 -5.054 1.00 0.00 O ATOM 566 CB ALA A 76 8.791 -11.518 -5.866 1.00 0.00 C ATOM 0 H ALA A 76 7.846 -11.062 -8.127 1.00 0.00 H new ATOM 0 HA ALA A 76 6.698 -11.569 -5.492 1.00 0.00 H new ATOM 0 HB1 ALA A 76 9.045 -11.456 -4.808 1.00 0.00 H new ATOM 0 HB2 ALA A 76 8.827 -12.559 -6.187 1.00 0.00 H new ATOM 0 HB3 ALA A 76 9.506 -10.935 -6.446 1.00 0.00 H new ATOM 567 N CYS A 77 6.070 -8.954 -5.869 1.00 0.00 N ATOM 568 CA CYS A 77 5.799 -7.580 -5.480 1.00 0.00 C ATOM 569 C CYS A 77 4.345 -7.493 -5.009 1.00 0.00 C ATOM 570 O CYS A 77 3.775 -8.485 -4.556 1.00 0.00 O ATOM 571 CB CYS A 77 6.089 -6.601 -6.619 1.00 0.00 C ATOM 572 SG CYS A 77 5.713 -4.851 -6.241 1.00 0.00 S ATOM 0 H CYS A 77 5.296 -9.426 -6.337 1.00 0.00 H new ATOM 0 HA CYS A 77 6.463 -7.292 -4.665 1.00 0.00 H new ATOM 0 HB2 CYS A 77 7.142 -6.682 -6.889 1.00 0.00 H new ATOM 0 HB3 CYS A 77 5.512 -6.901 -7.493 1.00 0.00 H new TER 573 CYS A 77