USER MOD reduce.3.24.130724 H: found=0, std=0, add=1036, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 1065 hydrogens (21 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 19 SER OG : rot 38:sc= 0.219 USER MOD Single : A 20 ASN : amide:sc= -0.0488 K(o=-0.049,f=-1.8!) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 15:sc= -0.0648 USER MOD Single : A 31 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 37 HIS : no HD1:sc= -9.29! C(o=-9.3!,f=-11!) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 SER OG : rot 27:sc= 0.196 USER MOD Single : B 20 ASN : amide:sc= -0.0476 K(o=-0.048,f=-1.7!) USER MOD Single : B 22 SER OG : rot 180:sc= 0 USER MOD Single : B 23 SER OG : rot 11:sc= 0.0604 USER MOD Single : B 31 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : B 37 HIS : no HD1:sc= -9.94! C(o=-9.9!,f=-12!) USER MOD Single : B 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 19 SER OG : rot 33:sc= 0.18 USER MOD Single : C 20 ASN : amide:sc= -0.0133 K(o=-0.013,f=-1.7!) USER MOD Single : C 22 SER OG : rot 180:sc= 0 USER MOD Single : C 23 SER OG : rot 15:sc= -0.116 USER MOD Single : C 31 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : C 37 HIS : no HD1:sc= -9.41! C(o=-9.4!,f=-11!) USER MOD Single : C 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 19 SER OG : rot 27:sc= 0.201 USER MOD Single : D 20 ASN : amide:sc= -0.0541 K(o=-0.054,f=-1.7!) USER MOD Single : D 22 SER OG : rot 180:sc= 0 USER MOD Single : D 23 SER OG : rot 20:sc= -0.166 USER MOD Single : D 31 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : D 37 HIS : no HD1:sc= -9.66! C(o=-9.7!,f=-12!) USER MOD Single : D 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 19 -1.717 26.365 5.197 1.00 0.00 N ATOM 2 CA SER A 19 -3.000 26.413 5.953 1.00 0.00 C ATOM 3 C SER A 19 -3.955 25.362 5.396 1.00 0.00 C ATOM 4 O SER A 19 -5.174 25.515 5.481 1.00 0.00 O ATOM 5 CB SER A 19 -3.617 27.805 5.816 1.00 0.00 C ATOM 6 OG SER A 19 -2.663 28.781 6.211 1.00 0.00 O ATOM 0 HA SER A 19 -2.815 26.206 7.007 1.00 0.00 H new ATOM 0 HB2 SER A 19 -3.927 27.978 4.785 1.00 0.00 H new ATOM 0 HB3 SER A 19 -4.511 27.882 6.435 1.00 0.00 H new ATOM 0 HG SER A 19 -1.771 28.505 5.915 1.00 0.00 H new ATOM 14 N ASN A 20 -3.394 24.301 4.826 1.00 0.00 N ATOM 15 CA ASN A 20 -4.201 23.228 4.256 1.00 0.00 C ATOM 16 C ASN A 20 -5.175 23.784 3.221 1.00 0.00 C ATOM 17 O ASN A 20 -6.288 23.279 3.068 1.00 0.00 O ATOM 18 CB ASN A 20 -4.979 22.516 5.366 1.00 0.00 C ATOM 19 CG ASN A 20 -4.022 21.719 6.245 1.00 0.00 C ATOM 20 OD1 ASN A 20 -2.932 21.351 5.803 1.00 0.00 O ATOM 21 ND2 ASN A 20 -4.359 21.439 7.473 1.00 0.00 N ATOM 0 H ASN A 20 -2.387 24.161 4.746 1.00 0.00 H new ATOM 0 HA ASN A 20 -3.536 22.517 3.766 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -5.518 23.246 5.970 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -5.724 21.851 4.930 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -3.720 20.914 8.070 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -5.262 21.745 7.836 1.00 0.00 H new ATOM 28 N ASP A 21 -4.744 24.821 2.511 1.00 0.00 N ATOM 29 CA ASP A 21 -5.580 25.439 1.488 1.00 0.00 C ATOM 30 C ASP A 21 -5.817 24.473 0.333 1.00 0.00 C ATOM 31 O ASP A 21 -6.886 24.470 -0.279 1.00 0.00 O ATOM 32 CB ASP A 21 -4.914 26.715 0.972 1.00 0.00 C ATOM 33 CG ASP A 21 -3.512 26.405 0.459 1.00 0.00 C ATOM 34 OD1 ASP A 21 -3.087 25.270 0.607 1.00 0.00 O ATOM 35 OD2 ASP A 21 -2.883 27.305 -0.069 1.00 0.00 O ATOM 0 H ASP A 21 -3.825 25.250 2.624 1.00 0.00 H new ATOM 0 HA ASP A 21 -6.543 25.691 1.932 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -5.514 27.150 0.173 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -4.862 27.455 1.770 1.00 0.00 H new ATOM 40 N SER A 22 -4.814 23.653 0.041 1.00 0.00 N ATOM 41 CA SER A 22 -4.921 22.682 -1.040 1.00 0.00 C ATOM 42 C SER A 22 -6.076 21.723 -0.783 1.00 0.00 C ATOM 43 O SER A 22 -6.798 21.348 -1.706 1.00 0.00 O ATOM 44 CB SER A 22 -3.620 21.890 -1.161 1.00 0.00 C ATOM 45 OG SER A 22 -2.531 22.790 -1.300 1.00 0.00 O ATOM 0 H SER A 22 -3.922 23.641 0.535 1.00 0.00 H new ATOM 0 HA SER A 22 -5.107 23.220 -1.969 1.00 0.00 H new ATOM 0 HB2 SER A 22 -3.479 21.265 -0.280 1.00 0.00 H new ATOM 0 HB3 SER A 22 -3.666 21.222 -2.021 1.00 0.00 H new ATOM 0 HG SER A 22 -1.696 22.283 -1.376 1.00 0.00 H new ATOM 51 N SER A 23 -6.239 21.321 0.473 1.00 0.00 N ATOM 52 CA SER A 23 -7.306 20.396 0.828 1.00 0.00 C ATOM 53 C SER A 23 -7.294 19.195 -0.111 1.00 0.00 C ATOM 54 O SER A 23 -8.305 18.511 -0.273 1.00 0.00 O ATOM 55 CB SER A 23 -8.663 21.094 0.734 1.00 0.00 C ATOM 56 OG SER A 23 -8.890 21.505 -0.607 1.00 0.00 O ATOM 0 H SER A 23 -5.653 21.618 1.253 1.00 0.00 H new ATOM 0 HA SER A 23 -7.143 20.058 1.851 1.00 0.00 H new ATOM 0 HB2 SER A 23 -9.455 20.419 1.058 1.00 0.00 H new ATOM 0 HB3 SER A 23 -8.687 21.957 1.400 1.00 0.00 H new ATOM 0 HG SER A 23 -8.253 21.054 -1.200 1.00 0.00 H new ATOM 62 N ASP A 24 -6.143 18.949 -0.734 1.00 0.00 N ATOM 63 CA ASP A 24 -6.016 17.830 -1.665 1.00 0.00 C ATOM 64 C ASP A 24 -6.660 16.564 -1.077 1.00 0.00 C ATOM 65 O ASP A 24 -6.108 15.973 -0.148 1.00 0.00 O ATOM 66 CB ASP A 24 -4.529 17.565 -1.952 1.00 0.00 C ATOM 67 CG ASP A 24 -3.725 17.545 -0.656 1.00 0.00 C ATOM 68 OD1 ASP A 24 -4.296 17.835 0.381 1.00 0.00 O ATOM 69 OD2 ASP A 24 -2.544 17.239 -0.723 1.00 0.00 O ATOM 0 H ASP A 24 -5.295 19.502 -0.613 1.00 0.00 H new ATOM 0 HA ASP A 24 -6.529 18.086 -2.592 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -4.418 16.612 -2.470 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -4.139 18.336 -2.616 1.00 0.00 H new ATOM 74 N PRO A 25 -7.816 16.134 -1.564 1.00 0.00 N ATOM 75 CA PRO A 25 -8.496 14.923 -1.015 1.00 0.00 C ATOM 76 C PRO A 25 -7.819 13.625 -1.456 1.00 0.00 C ATOM 77 O PRO A 25 -8.047 12.567 -0.867 1.00 0.00 O ATOM 78 CB PRO A 25 -9.932 15.029 -1.556 1.00 0.00 C ATOM 79 CG PRO A 25 -9.819 15.813 -2.827 1.00 0.00 C ATOM 80 CD PRO A 25 -8.593 16.729 -2.677 1.00 0.00 C ATOM 0 HA PRO A 25 -8.458 14.890 0.074 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -10.357 14.042 -1.739 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -10.585 15.530 -0.842 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -9.702 15.148 -3.682 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -10.721 16.400 -3.001 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -8.008 16.762 -3.596 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -8.889 17.753 -2.451 1.00 0.00 H new ATOM 88 N LEU A 26 -6.995 13.711 -2.494 1.00 0.00 N ATOM 89 CA LEU A 26 -6.297 12.534 -3.003 1.00 0.00 C ATOM 90 C LEU A 26 -5.360 11.965 -1.940 1.00 0.00 C ATOM 91 O LEU A 26 -5.282 10.751 -1.755 1.00 0.00 O ATOM 92 CB LEU A 26 -5.499 12.917 -4.259 1.00 0.00 C ATOM 93 CG LEU A 26 -6.428 12.949 -5.477 1.00 0.00 C ATOM 94 CD1 LEU A 26 -7.582 13.922 -5.218 1.00 0.00 C ATOM 95 CD2 LEU A 26 -5.639 13.409 -6.705 1.00 0.00 C ATOM 0 H LEU A 26 -6.794 14.575 -2.997 1.00 0.00 H new ATOM 0 HA LEU A 26 -7.031 11.769 -3.258 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -5.032 13.892 -4.121 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -4.695 12.199 -4.423 1.00 0.00 H new ATOM 0 HG LEU A 26 -6.830 11.951 -5.653 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -8.242 13.943 -6.086 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -8.144 13.595 -4.343 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -7.183 14.921 -5.041 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -6.298 13.433 -7.573 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -5.238 14.407 -6.527 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -4.819 12.716 -6.891 1.00 0.00 H new ATOM 107 N VAL A 27 -4.649 12.847 -1.244 1.00 0.00 N ATOM 108 CA VAL A 27 -3.723 12.414 -0.204 1.00 0.00 C ATOM 109 C VAL A 27 -4.477 11.730 0.935 1.00 0.00 C ATOM 110 O VAL A 27 -4.072 10.671 1.414 1.00 0.00 O ATOM 111 CB VAL A 27 -2.948 13.617 0.339 1.00 0.00 C ATOM 112 CG1 VAL A 27 -2.075 13.180 1.517 1.00 0.00 C ATOM 113 CG2 VAL A 27 -2.058 14.186 -0.771 1.00 0.00 C ATOM 0 H VAL A 27 -4.695 13.857 -1.380 1.00 0.00 H new ATOM 0 HA VAL A 27 -3.024 11.700 -0.639 1.00 0.00 H new ATOM 0 HB VAL A 27 -3.650 14.379 0.676 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -1.525 14.039 1.901 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -2.706 12.772 2.306 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -1.371 12.417 1.185 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -1.504 15.043 -0.389 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -1.358 13.420 -1.104 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -2.679 14.500 -1.610 1.00 0.00 H new ATOM 123 N VAL A 28 -5.575 12.348 1.364 1.00 0.00 N ATOM 124 CA VAL A 28 -6.377 11.791 2.448 1.00 0.00 C ATOM 125 C VAL A 28 -6.980 10.455 2.030 1.00 0.00 C ATOM 126 O VAL A 28 -6.969 9.490 2.796 1.00 0.00 O ATOM 127 CB VAL A 28 -7.494 12.768 2.827 1.00 0.00 C ATOM 128 CG1 VAL A 28 -8.398 12.128 3.883 1.00 0.00 C ATOM 129 CG2 VAL A 28 -6.875 14.046 3.396 1.00 0.00 C ATOM 0 H VAL A 28 -5.926 13.226 0.982 1.00 0.00 H new ATOM 0 HA VAL A 28 -5.732 11.630 3.312 1.00 0.00 H new ATOM 0 HB VAL A 28 -8.084 13.008 1.942 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -9.192 12.824 4.152 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -8.836 11.215 3.481 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -7.810 11.889 4.769 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -7.667 14.744 3.667 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -6.287 13.803 4.281 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -6.229 14.503 2.646 1.00 0.00 H new ATOM 139 N ALA A 29 -7.506 10.405 0.811 1.00 0.00 N ATOM 140 CA ALA A 29 -8.109 9.180 0.300 1.00 0.00 C ATOM 141 C ALA A 29 -7.082 8.052 0.278 1.00 0.00 C ATOM 142 O ALA A 29 -7.421 6.883 0.432 1.00 0.00 O ATOM 143 CB ALA A 29 -8.652 9.411 -1.110 1.00 0.00 C ATOM 0 H ALA A 29 -7.527 11.192 0.163 1.00 0.00 H new ATOM 0 HA ALA A 29 -8.930 8.897 0.958 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -9.100 8.490 -1.483 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -9.406 10.198 -1.085 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -7.837 9.710 -1.769 1.00 0.00 H new ATOM 149 N ALA A 30 -5.820 8.407 0.079 1.00 0.00 N ATOM 150 CA ALA A 30 -4.766 7.403 0.050 1.00 0.00 C ATOM 151 C ALA A 30 -4.492 6.874 1.459 1.00 0.00 C ATOM 152 O ALA A 30 -4.269 5.680 1.652 1.00 0.00 O ATOM 153 CB ALA A 30 -3.488 7.998 -0.545 1.00 0.00 C ATOM 0 H ALA A 30 -5.504 9.367 -0.063 1.00 0.00 H new ATOM 0 HA ALA A 30 -5.095 6.573 -0.575 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -2.707 7.238 -0.562 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -3.684 8.339 -1.561 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -3.161 8.841 0.064 1.00 0.00 H new ATOM 159 N ASN A 31 -4.497 7.780 2.437 1.00 0.00 N ATOM 160 CA ASN A 31 -4.236 7.402 3.824 1.00 0.00 C ATOM 161 C ASN A 31 -5.363 6.552 4.413 1.00 0.00 C ATOM 162 O ASN A 31 -5.106 5.533 5.052 1.00 0.00 O ATOM 163 CB ASN A 31 -4.056 8.659 4.677 1.00 0.00 C ATOM 164 CG ASN A 31 -3.787 8.269 6.127 1.00 0.00 C ATOM 165 OD1 ASN A 31 -3.099 7.283 6.387 1.00 0.00 O ATOM 166 ND2 ASN A 31 -4.294 8.989 7.090 1.00 0.00 N ATOM 0 H ASN A 31 -4.678 8.774 2.295 1.00 0.00 H new ATOM 0 HA ASN A 31 -3.325 6.803 3.832 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -3.228 9.255 4.292 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -4.950 9.280 4.618 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -4.120 8.735 8.062 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -4.864 9.806 6.870 1.00 0.00 H new ATOM 173 N ILE A 32 -6.607 6.976 4.207 1.00 0.00 N ATOM 174 CA ILE A 32 -7.748 6.240 4.742 1.00 0.00 C ATOM 175 C ILE A 32 -7.867 4.871 4.072 1.00 0.00 C ATOM 176 O ILE A 32 -8.101 3.864 4.738 1.00 0.00 O ATOM 177 CB ILE A 32 -9.022 7.057 4.513 1.00 0.00 C ATOM 178 CG1 ILE A 32 -10.184 6.458 5.310 1.00 0.00 C ATOM 179 CG2 ILE A 32 -9.377 7.053 3.026 1.00 0.00 C ATOM 180 CD1 ILE A 32 -11.369 7.428 5.278 1.00 0.00 C ATOM 0 H ILE A 32 -6.849 7.815 3.680 1.00 0.00 H new ATOM 0 HA ILE A 32 -7.604 6.080 5.811 1.00 0.00 H new ATOM 0 HB ILE A 32 -8.847 8.080 4.847 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -10.474 5.497 4.886 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -9.878 6.273 6.340 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -10.284 7.636 2.867 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -8.559 7.493 2.455 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -9.541 6.028 2.694 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -12.200 7.006 5.844 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -11.073 8.379 5.721 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -11.679 7.590 4.246 1.00 0.00 H new ATOM 192 N ILE A 33 -7.692 4.842 2.751 1.00 0.00 N ATOM 193 CA ILE A 33 -7.772 3.589 2.005 1.00 0.00 C ATOM 194 C ILE A 33 -6.653 2.639 2.437 1.00 0.00 C ATOM 195 O ILE A 33 -6.884 1.445 2.629 1.00 0.00 O ATOM 196 CB ILE A 33 -7.679 3.858 0.495 1.00 0.00 C ATOM 197 CG1 ILE A 33 -8.956 4.566 0.019 1.00 0.00 C ATOM 198 CG2 ILE A 33 -7.530 2.535 -0.263 1.00 0.00 C ATOM 199 CD1 ILE A 33 -8.765 5.081 -1.411 1.00 0.00 C ATOM 0 H ILE A 33 -7.496 5.665 2.181 1.00 0.00 H new ATOM 0 HA ILE A 33 -8.733 3.121 2.220 1.00 0.00 H new ATOM 0 HB ILE A 33 -6.811 4.489 0.301 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -9.800 3.877 0.057 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -9.192 5.396 0.685 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -7.465 2.734 -1.333 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -6.624 2.026 0.067 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -8.395 1.902 -0.064 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -9.675 5.582 -1.742 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -7.933 5.785 -1.436 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -8.551 4.243 -2.074 1.00 0.00 H new ATOM 211 N GLY A 34 -5.445 3.174 2.583 1.00 0.00 N ATOM 212 CA GLY A 34 -4.304 2.354 2.985 1.00 0.00 C ATOM 213 C GLY A 34 -4.538 1.731 4.358 1.00 0.00 C ATOM 214 O GLY A 34 -4.297 0.540 4.559 1.00 0.00 O ATOM 0 H GLY A 34 -5.230 4.160 2.431 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -4.138 1.568 2.248 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -3.402 2.965 3.008 1.00 0.00 H new ATOM 218 N ILE A 35 -5.015 2.540 5.297 1.00 0.00 N ATOM 219 CA ILE A 35 -5.284 2.053 6.645 1.00 0.00 C ATOM 220 C ILE A 35 -6.391 1.001 6.614 1.00 0.00 C ATOM 221 O ILE A 35 -6.304 -0.027 7.288 1.00 0.00 O ATOM 222 CB ILE A 35 -5.696 3.217 7.552 1.00 0.00 C ATOM 223 CG1 ILE A 35 -4.497 4.148 7.753 1.00 0.00 C ATOM 224 CG2 ILE A 35 -6.148 2.675 8.913 1.00 0.00 C ATOM 225 CD1 ILE A 35 -4.966 5.448 8.403 1.00 0.00 C ATOM 0 H ILE A 35 -5.222 3.528 5.152 1.00 0.00 H new ATOM 0 HA ILE A 35 -4.376 1.598 7.041 1.00 0.00 H new ATOM 0 HB ILE A 35 -6.517 3.765 7.089 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -3.749 3.664 8.381 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -4.022 4.359 6.795 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -6.440 3.505 9.556 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -6.998 2.006 8.774 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -5.328 2.128 9.377 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -4.113 6.111 8.547 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -5.699 5.933 7.758 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -5.421 5.228 9.369 1.00 0.00 H new ATOM 237 N LEU A 36 -7.433 1.268 5.831 1.00 0.00 N ATOM 238 CA LEU A 36 -8.553 0.341 5.725 1.00 0.00 C ATOM 239 C LEU A 36 -8.076 -1.001 5.185 1.00 0.00 C ATOM 240 O LEU A 36 -8.501 -2.058 5.655 1.00 0.00 O ATOM 241 CB LEU A 36 -9.631 0.915 4.798 1.00 0.00 C ATOM 242 CG LEU A 36 -10.807 -0.068 4.665 1.00 0.00 C ATOM 243 CD1 LEU A 36 -11.413 -0.370 6.046 1.00 0.00 C ATOM 244 CD2 LEU A 36 -11.874 0.556 3.759 1.00 0.00 C ATOM 0 H LEU A 36 -7.524 2.112 5.265 1.00 0.00 H new ATOM 0 HA LEU A 36 -8.977 0.196 6.719 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -9.988 1.867 5.191 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -9.204 1.116 3.815 1.00 0.00 H new ATOM 0 HG LEU A 36 -10.449 -1.002 4.233 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -12.244 -1.067 5.934 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -10.652 -0.813 6.688 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -11.774 0.555 6.495 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -12.713 -0.132 3.657 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -12.223 1.491 4.198 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -11.446 0.754 2.776 1.00 0.00 H new ATOM 256 N HIS A 37 -7.189 -0.957 4.197 1.00 0.00 N ATOM 257 CA HIS A 37 -6.670 -2.183 3.608 1.00 0.00 C ATOM 258 C HIS A 37 -5.996 -3.034 4.678 1.00 0.00 C ATOM 259 O HIS A 37 -6.161 -4.255 4.705 1.00 0.00 O ATOM 260 CB HIS A 37 -5.655 -1.853 2.515 1.00 0.00 C ATOM 261 CG HIS A 37 -5.174 -3.133 1.888 1.00 0.00 C ATOM 262 ND1 HIS A 37 -5.383 -3.425 0.553 1.00 0.00 N ATOM 263 CD2 HIS A 37 -4.505 -4.211 2.406 1.00 0.00 C ATOM 264 CE1 HIS A 37 -4.849 -4.637 0.318 1.00 0.00 C ATOM 265 NE2 HIS A 37 -4.302 -5.158 1.414 1.00 0.00 N ATOM 0 H HIS A 37 -6.819 -0.097 3.792 1.00 0.00 H new ATOM 0 HA HIS A 37 -7.502 -2.738 3.174 1.00 0.00 H new ATOM 0 HB2 HIS A 37 -6.110 -1.212 1.760 1.00 0.00 H new ATOM 0 HB3 HIS A 37 -4.815 -1.301 2.936 1.00 0.00 H new ATOM 0 HD2 HIS A 37 -4.184 -4.308 3.433 1.00 0.00 H new ATOM 0 HE1 HIS A 37 -4.862 -5.128 -0.644 1.00 0.00 H new ATOM 0 HE2 HIS A 37 -3.834 -6.060 1.505 1.00 0.00 H new ATOM 273 N LEU A 38 -5.239 -2.387 5.557 1.00 0.00 N ATOM 274 CA LEU A 38 -4.541 -3.099 6.626 1.00 0.00 C ATOM 275 C LEU A 38 -5.522 -3.815 7.543 1.00 0.00 C ATOM 276 O LEU A 38 -5.261 -4.932 7.975 1.00 0.00 O ATOM 277 CB LEU A 38 -3.673 -2.111 7.441 1.00 0.00 C ATOM 278 CG LEU A 38 -2.249 -2.030 6.849 1.00 0.00 C ATOM 279 CD1 LEU A 38 -1.583 -0.717 7.258 1.00 0.00 C ATOM 280 CD2 LEU A 38 -1.401 -3.205 7.370 1.00 0.00 C ATOM 0 H LEU A 38 -5.092 -1.378 5.553 1.00 0.00 H new ATOM 0 HA LEU A 38 -3.897 -3.851 6.169 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -4.133 -1.123 7.435 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -3.623 -2.433 8.481 1.00 0.00 H new ATOM 0 HG LEU A 38 -2.320 -2.078 5.762 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -0.579 -0.671 6.835 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -2.172 0.121 6.886 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -1.521 -0.663 8.345 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -0.397 -3.144 6.950 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -1.343 -3.158 8.457 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -1.862 -4.147 7.072 1.00 0.00 H new ATOM 292 N ILE A 39 -6.640 -3.173 7.848 1.00 0.00 N ATOM 293 CA ILE A 39 -7.623 -3.786 8.730 1.00 0.00 C ATOM 294 C ILE A 39 -8.167 -5.074 8.114 1.00 0.00 C ATOM 295 O ILE A 39 -8.297 -6.092 8.790 1.00 0.00 O ATOM 296 CB ILE A 39 -8.771 -2.803 8.972 1.00 0.00 C ATOM 297 CG1 ILE A 39 -8.245 -1.608 9.775 1.00 0.00 C ATOM 298 CG2 ILE A 39 -9.887 -3.497 9.759 1.00 0.00 C ATOM 299 CD1 ILE A 39 -9.305 -0.504 9.824 1.00 0.00 C ATOM 0 H ILE A 39 -6.887 -2.245 7.505 1.00 0.00 H new ATOM 0 HA ILE A 39 -7.143 -4.031 9.677 1.00 0.00 H new ATOM 0 HB ILE A 39 -9.167 -2.460 8.016 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -7.989 -1.923 10.787 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -7.331 -1.227 9.319 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -10.703 -2.795 9.930 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -10.256 -4.351 9.191 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -9.497 -3.840 10.717 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -8.924 0.342 10.396 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -9.540 -0.180 8.810 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -10.207 -0.887 10.300 1.00 0.00 H new ATOM 311 N LEU A 40 -8.490 -5.025 6.828 1.00 0.00 N ATOM 312 CA LEU A 40 -9.013 -6.201 6.145 1.00 0.00 C ATOM 313 C LEU A 40 -7.914 -7.240 5.905 1.00 0.00 C ATOM 314 O LEU A 40 -8.125 -8.436 6.100 1.00 0.00 O ATOM 315 CB LEU A 40 -9.635 -5.784 4.816 1.00 0.00 C ATOM 316 CG LEU A 40 -10.627 -4.639 5.054 1.00 0.00 C ATOM 317 CD1 LEU A 40 -11.201 -4.181 3.712 1.00 0.00 C ATOM 318 CD2 LEU A 40 -11.767 -5.113 5.970 1.00 0.00 C ATOM 0 H LEU A 40 -8.401 -4.194 6.243 1.00 0.00 H new ATOM 0 HA LEU A 40 -9.772 -6.657 6.780 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -8.857 -5.467 4.121 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -10.145 -6.632 4.359 1.00 0.00 H new ATOM 0 HG LEU A 40 -10.110 -3.808 5.534 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -11.907 -3.367 3.877 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -10.392 -3.835 3.069 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -11.714 -5.014 3.232 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -12.467 -4.294 6.134 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -12.288 -5.947 5.500 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -11.355 -5.435 6.926 1.00 0.00 H new ATOM 330 N TRP A 41 -6.744 -6.774 5.470 1.00 0.00 N ATOM 331 CA TRP A 41 -5.622 -7.671 5.194 1.00 0.00 C ATOM 332 C TRP A 41 -5.088 -8.314 6.471 1.00 0.00 C ATOM 333 O TRP A 41 -4.861 -9.523 6.517 1.00 0.00 O ATOM 334 CB TRP A 41 -4.502 -6.896 4.485 1.00 0.00 C ATOM 335 CG TRP A 41 -3.269 -7.741 4.392 1.00 0.00 C ATOM 336 CD1 TRP A 41 -3.014 -8.655 3.430 1.00 0.00 C ATOM 337 CD2 TRP A 41 -2.106 -7.737 5.268 1.00 0.00 C ATOM 338 NE1 TRP A 41 -1.779 -9.228 3.673 1.00 0.00 N ATOM 339 CE2 TRP A 41 -1.179 -8.689 4.791 1.00 0.00 C ATOM 340 CE3 TRP A 41 -1.772 -7.007 6.420 1.00 0.00 C ATOM 341 CZ2 TRP A 41 0.035 -8.908 5.437 1.00 0.00 C ATOM 342 CZ3 TRP A 41 -0.545 -7.223 7.067 1.00 0.00 C ATOM 343 CH2 TRP A 41 0.353 -8.171 6.575 1.00 0.00 C ATOM 0 H TRP A 41 -6.549 -5.787 5.302 1.00 0.00 H new ATOM 0 HA TRP A 41 -5.981 -8.471 4.547 1.00 0.00 H new ATOM 0 HB2 TRP A 41 -4.828 -6.603 3.487 1.00 0.00 H new ATOM 0 HB3 TRP A 41 -4.283 -5.978 5.031 1.00 0.00 H new ATOM 0 HD1 TRP A 41 -3.668 -8.898 2.606 1.00 0.00 H new ATOM 0 HE1 TRP A 41 -1.363 -9.959 3.096 1.00 0.00 H new ATOM 0 HE3 TRP A 41 -2.463 -6.275 6.811 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 0.726 -9.646 5.057 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 -0.295 -6.653 7.950 1.00 0.00 H new ATOM 0 HH2 TRP A 41 1.295 -8.333 7.077 1.00 0.00 H new ATOM 354 N ILE A 42 -4.875 -7.504 7.499 1.00 0.00 N ATOM 355 CA ILE A 42 -4.351 -8.018 8.758 1.00 0.00 C ATOM 356 C ILE A 42 -5.345 -8.990 9.381 1.00 0.00 C ATOM 357 O ILE A 42 -4.958 -9.987 9.988 1.00 0.00 O ATOM 358 CB ILE A 42 -4.065 -6.858 9.728 1.00 0.00 C ATOM 359 CG1 ILE A 42 -3.167 -7.348 10.869 1.00 0.00 C ATOM 360 CG2 ILE A 42 -5.379 -6.318 10.318 1.00 0.00 C ATOM 361 CD1 ILE A 42 -2.715 -6.144 11.696 1.00 0.00 C ATOM 0 H ILE A 42 -5.054 -6.500 7.488 1.00 0.00 H new ATOM 0 HA ILE A 42 -3.419 -8.547 8.560 1.00 0.00 H new ATOM 0 HB ILE A 42 -3.564 -6.061 9.179 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -3.708 -8.055 11.498 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -2.302 -7.876 10.468 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -5.161 -5.498 11.002 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -6.019 -5.958 9.512 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -5.890 -7.115 10.858 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -2.075 -6.482 12.511 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -2.160 -5.454 11.061 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -3.588 -5.636 12.107 1.00 0.00 H new ATOM 373 N LEU A 43 -6.632 -8.690 9.230 1.00 0.00 N ATOM 374 CA LEU A 43 -7.670 -9.544 9.787 1.00 0.00 C ATOM 375 C LEU A 43 -7.597 -10.936 9.172 1.00 0.00 C ATOM 376 O LEU A 43 -7.711 -11.940 9.871 1.00 0.00 O ATOM 377 CB LEU A 43 -9.052 -8.932 9.518 1.00 0.00 C ATOM 378 CG LEU A 43 -10.162 -9.831 10.090 1.00 0.00 C ATOM 379 CD1 LEU A 43 -9.962 -10.031 11.602 1.00 0.00 C ATOM 380 CD2 LEU A 43 -11.521 -9.173 9.833 1.00 0.00 C ATOM 0 H LEU A 43 -6.976 -7.870 8.731 1.00 0.00 H new ATOM 0 HA LEU A 43 -7.515 -9.624 10.863 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -9.111 -7.941 9.968 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -9.197 -8.804 8.445 1.00 0.00 H new ATOM 0 HG LEU A 43 -10.122 -10.805 9.602 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -10.755 -10.669 11.993 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -8.996 -10.502 11.782 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -9.994 -9.064 12.104 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -12.313 -9.804 10.236 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -11.551 -8.198 10.320 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -11.667 -9.047 8.760 1.00 0.00 H new ATOM 392 N ASP A 44 -7.410 -10.996 7.860 1.00 0.00 N ATOM 393 CA ASP A 44 -7.330 -12.281 7.181 1.00 0.00 C ATOM 394 C ASP A 44 -6.089 -13.045 7.634 1.00 0.00 C ATOM 395 O ASP A 44 -6.151 -14.244 7.900 1.00 0.00 O ATOM 396 CB ASP A 44 -7.281 -12.073 5.670 1.00 0.00 C ATOM 397 CG ASP A 44 -7.485 -13.407 4.958 1.00 0.00 C ATOM 398 OD1 ASP A 44 -7.380 -14.428 5.617 1.00 0.00 O ATOM 399 OD2 ASP A 44 -7.744 -13.386 3.767 1.00 0.00 O ATOM 0 H ASP A 44 -7.312 -10.182 7.253 1.00 0.00 H new ATOM 0 HA ASP A 44 -8.216 -12.862 7.435 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -8.053 -11.366 5.366 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -6.322 -11.641 5.384 1.00 0.00 H new ATOM 404 N ARG A 45 -4.966 -12.343 7.719 1.00 0.00 N ATOM 405 CA ARG A 45 -3.715 -12.965 8.139 1.00 0.00 C ATOM 406 C ARG A 45 -3.765 -13.334 9.621 1.00 0.00 C ATOM 407 O ARG A 45 -2.969 -14.141 10.098 1.00 0.00 O ATOM 408 CB ARG A 45 -2.544 -12.010 7.874 1.00 0.00 C ATOM 409 CG ARG A 45 -1.222 -12.703 8.214 1.00 0.00 C ATOM 410 CD ARG A 45 -0.053 -11.795 7.827 1.00 0.00 C ATOM 411 NE ARG A 45 1.214 -12.499 8.012 1.00 0.00 N ATOM 412 CZ ARG A 45 1.851 -12.489 9.181 1.00 0.00 C ATOM 413 NH1 ARG A 45 1.350 -11.837 10.195 1.00 0.00 N ATOM 414 NH2 ARG A 45 2.978 -13.132 9.316 1.00 0.00 N ATOM 0 H ARG A 45 -4.895 -11.348 7.504 1.00 0.00 H new ATOM 0 HA ARG A 45 -3.571 -13.879 7.563 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -2.545 -11.701 6.829 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -2.656 -11.107 8.474 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -1.182 -12.930 9.279 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -1.150 -13.652 7.683 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -0.155 -11.481 6.788 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -0.068 -10.891 8.436 1.00 0.00 H new ATOM 0 HE ARG A 45 1.620 -13.010 7.228 1.00 0.00 H new ATOM 0 HH11 ARG A 45 0.469 -11.334 10.093 1.00 0.00 H new ATOM 0 HH12 ARG A 45 1.840 -11.831 11.090 1.00 0.00 H new ATOM 0 HH21 ARG A 45 3.372 -13.643 8.526 1.00 0.00 H new ATOM 0 HH22 ARG A 45 3.466 -13.124 10.212 1.00 0.00 H new ATOM 428 N LEU A 46 -4.700 -12.737 10.350 1.00 0.00 N ATOM 429 CA LEU A 46 -4.821 -13.021 11.777 1.00 0.00 C ATOM 430 C LEU A 46 -5.159 -14.493 12.005 1.00 0.00 C ATOM 431 O LEU A 46 -4.600 -15.135 12.893 1.00 0.00 O ATOM 432 CB LEU A 46 -5.916 -12.144 12.395 1.00 0.00 C ATOM 433 CG LEU A 46 -5.950 -12.325 13.919 1.00 0.00 C ATOM 434 CD1 LEU A 46 -4.640 -11.815 14.550 1.00 0.00 C ATOM 435 CD2 LEU A 46 -7.139 -11.535 14.479 1.00 0.00 C ATOM 0 H LEU A 46 -5.375 -12.065 9.986 1.00 0.00 H new ATOM 0 HA LEU A 46 -3.866 -12.800 12.253 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -5.734 -11.097 12.151 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -6.885 -12.407 11.969 1.00 0.00 H new ATOM 0 HG LEU A 46 -6.056 -13.383 14.158 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -4.680 -11.950 15.631 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -3.798 -12.377 14.145 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -4.514 -10.757 14.321 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -7.177 -11.654 15.562 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -7.023 -10.479 14.233 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -8.064 -11.910 14.040 1.00 0.00 H new ATOM 447 N PHE A 47 -6.085 -15.022 11.202 1.00 0.00 N ATOM 448 CA PHE A 47 -6.502 -16.421 11.330 1.00 0.00 C ATOM 449 C PHE A 47 -5.825 -17.298 10.278 1.00 0.00 C ATOM 450 O PHE A 47 -5.983 -18.518 10.285 1.00 0.00 O ATOM 451 CB PHE A 47 -8.021 -16.517 11.171 1.00 0.00 C ATOM 452 CG PHE A 47 -8.691 -15.742 12.282 1.00 0.00 C ATOM 453 CD1 PHE A 47 -8.843 -16.322 13.548 1.00 0.00 C ATOM 454 CD2 PHE A 47 -9.157 -14.443 12.048 1.00 0.00 C ATOM 455 CE1 PHE A 47 -9.460 -15.603 14.578 1.00 0.00 C ATOM 456 CE2 PHE A 47 -9.775 -13.723 13.078 1.00 0.00 C ATOM 457 CZ PHE A 47 -9.927 -14.304 14.343 1.00 0.00 C ATOM 0 H PHE A 47 -6.558 -14.506 10.460 1.00 0.00 H new ATOM 0 HA PHE A 47 -6.205 -16.777 12.316 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -8.322 -16.119 10.202 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -8.336 -17.560 11.199 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -8.484 -17.324 13.729 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -9.040 -13.996 11.072 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -9.576 -16.050 15.554 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -10.134 -12.721 12.897 1.00 0.00 H new ATOM 0 HZ PHE A 47 -10.405 -13.750 15.138 1.00 0.00 H new ATOM 467 N PHE A 48 -5.070 -16.671 9.377 1.00 0.00 N ATOM 468 CA PHE A 48 -4.368 -17.404 8.319 1.00 0.00 C ATOM 469 C PHE A 48 -2.913 -16.957 8.229 1.00 0.00 C ATOM 470 O PHE A 48 -2.595 -15.796 8.482 1.00 0.00 O ATOM 471 CB PHE A 48 -5.063 -17.165 6.977 1.00 0.00 C ATOM 472 CG PHE A 48 -6.405 -17.855 6.980 1.00 0.00 C ATOM 473 CD1 PHE A 48 -7.528 -17.204 7.509 1.00 0.00 C ATOM 474 CD2 PHE A 48 -6.527 -19.147 6.459 1.00 0.00 C ATOM 475 CE1 PHE A 48 -8.771 -17.846 7.514 1.00 0.00 C ATOM 476 CE2 PHE A 48 -7.771 -19.790 6.464 1.00 0.00 C ATOM 477 CZ PHE A 48 -8.892 -19.140 6.990 1.00 0.00 C ATOM 0 H PHE A 48 -4.928 -15.661 9.356 1.00 0.00 H new ATOM 0 HA PHE A 48 -4.392 -18.467 8.559 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -5.191 -16.096 6.806 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -4.447 -17.546 6.163 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -7.434 -16.207 7.913 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -5.661 -19.649 6.053 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -9.637 -17.345 7.921 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -7.865 -20.788 6.062 1.00 0.00 H new ATOM 0 HZ PHE A 48 -9.852 -19.636 6.992 1.00 0.00 H new ATOM 487 N LYS A 49 -2.034 -17.881 7.864 1.00 0.00 N ATOM 488 CA LYS A 49 -0.615 -17.565 7.745 1.00 0.00 C ATOM 489 C LYS A 49 0.115 -18.657 6.970 1.00 0.00 C ATOM 490 O LYS A 49 -0.528 -19.626 6.605 1.00 0.00 O ATOM 491 CB LYS A 49 0.001 -17.417 9.138 1.00 0.00 C ATOM 492 CG LYS A 49 -0.183 -18.719 9.920 1.00 0.00 C ATOM 493 CD LYS A 49 0.373 -18.550 11.335 1.00 0.00 C ATOM 494 CE LYS A 49 0.177 -19.850 12.118 1.00 0.00 C ATOM 495 NZ LYS A 49 0.726 -19.691 13.493 1.00 0.00 N ATOM 496 OXT LYS A 49 1.305 -18.505 6.752 1.00 0.00 O ATOM 0 H LYS A 49 -2.275 -18.848 7.647 1.00 0.00 H new ATOM 0 HA LYS A 49 -0.512 -16.626 7.202 1.00 0.00 H new ATOM 0 HB2 LYS A 49 1.061 -17.178 9.055 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -0.471 -16.591 9.670 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -1.240 -18.983 9.963 1.00 0.00 H new ATOM 0 HG3 LYS A 49 0.330 -19.536 9.412 1.00 0.00 H new ATOM 0 HD2 LYS A 49 1.432 -18.294 11.293 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -0.134 -17.728 11.841 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -0.882 -20.102 12.165 1.00 0.00 H new ATOM 0 HE3 LYS A 49 0.678 -20.673 11.608 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 0.592 -20.575 14.024 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 1.741 -19.470 13.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 0.229 -18.917 13.978 1.00 0.00 H new TER 510 LYS A 49 ATOM 511 N SER B 19 -2.719 26.132 -6.129 1.00 0.00 N ATOM 512 CA SER B 19 -3.482 26.036 -7.406 1.00 0.00 C ATOM 513 C SER B 19 -3.037 24.794 -8.172 1.00 0.00 C ATOM 514 O SER B 19 -3.120 24.749 -9.399 1.00 0.00 O ATOM 515 CB SER B 19 -3.223 27.287 -8.245 1.00 0.00 C ATOM 516 OG SER B 19 -3.520 28.442 -7.472 1.00 0.00 O ATOM 0 HA SER B 19 -4.548 25.961 -7.193 1.00 0.00 H new ATOM 0 HB2 SER B 19 -2.183 27.311 -8.571 1.00 0.00 H new ATOM 0 HB3 SER B 19 -3.839 27.269 -9.144 1.00 0.00 H new ATOM 0 HG SER B 19 -3.408 28.236 -6.520 1.00 0.00 H new ATOM 524 N ASN B 20 -2.562 23.793 -7.437 1.00 0.00 N ATOM 525 CA ASN B 20 -2.105 22.551 -8.053 1.00 0.00 C ATOM 526 C ASN B 20 -1.033 22.837 -9.100 1.00 0.00 C ATOM 527 O ASN B 20 -0.941 22.143 -10.114 1.00 0.00 O ATOM 528 CB ASN B 20 -3.285 21.827 -8.706 1.00 0.00 C ATOM 529 CG ASN B 20 -4.224 21.290 -7.632 1.00 0.00 C ATOM 530 OD1 ASN B 20 -3.806 21.068 -6.496 1.00 0.00 O ATOM 531 ND2 ASN B 20 -5.477 21.074 -7.925 1.00 0.00 N ATOM 0 H ASN B 20 -2.484 23.816 -6.420 1.00 0.00 H new ATOM 0 HA ASN B 20 -1.677 21.916 -7.277 1.00 0.00 H new ATOM 0 HB2 ASN B 20 -3.823 22.510 -9.363 1.00 0.00 H new ATOM 0 HB3 ASN B 20 -2.922 21.008 -9.326 1.00 0.00 H new ATOM 0 HD21 ASN B 20 -6.114 20.720 -7.211 1.00 0.00 H new ATOM 0 HD22 ASN B 20 -5.820 21.259 -8.868 1.00 0.00 H new ATOM 538 N ASP B 21 -0.225 23.861 -8.846 1.00 0.00 N ATOM 539 CA ASP B 21 0.841 24.232 -9.771 1.00 0.00 C ATOM 540 C ASP B 21 1.898 23.134 -9.839 1.00 0.00 C ATOM 541 O ASP B 21 2.493 22.895 -10.890 1.00 0.00 O ATOM 542 CB ASP B 21 1.485 25.545 -9.323 1.00 0.00 C ATOM 543 CG ASP B 21 1.985 25.422 -7.889 1.00 0.00 C ATOM 544 OD1 ASP B 21 1.740 24.392 -7.283 1.00 0.00 O ATOM 545 OD2 ASP B 21 2.607 26.360 -7.417 1.00 0.00 O ATOM 0 H ASP B 21 -0.287 24.446 -8.013 1.00 0.00 H new ATOM 0 HA ASP B 21 0.410 24.362 -10.764 1.00 0.00 H new ATOM 0 HB2 ASP B 21 2.314 25.797 -9.985 1.00 0.00 H new ATOM 0 HB3 ASP B 21 0.761 26.357 -9.395 1.00 0.00 H new ATOM 550 N SER B 22 2.122 22.469 -8.712 1.00 0.00 N ATOM 551 CA SER B 22 3.107 21.395 -8.652 1.00 0.00 C ATOM 552 C SER B 22 2.746 20.286 -9.634 1.00 0.00 C ATOM 553 O SER B 22 3.620 19.711 -10.281 1.00 0.00 O ATOM 554 CB SER B 22 3.167 20.821 -7.237 1.00 0.00 C ATOM 555 OG SER B 22 3.408 21.872 -6.312 1.00 0.00 O ATOM 0 H SER B 22 1.639 22.652 -7.833 1.00 0.00 H new ATOM 0 HA SER B 22 4.081 21.804 -8.921 1.00 0.00 H new ATOM 0 HB2 SER B 22 2.230 20.318 -6.997 1.00 0.00 H new ATOM 0 HB3 SER B 22 3.957 20.073 -7.169 1.00 0.00 H new ATOM 0 HG SER B 22 3.445 21.506 -5.404 1.00 0.00 H new ATOM 561 N SER B 23 1.456 19.984 -9.731 1.00 0.00 N ATOM 562 CA SER B 23 1.002 18.932 -10.632 1.00 0.00 C ATOM 563 C SER B 23 1.825 17.667 -10.416 1.00 0.00 C ATOM 564 O SER B 23 1.907 16.812 -11.298 1.00 0.00 O ATOM 565 CB SER B 23 1.145 19.385 -12.086 1.00 0.00 C ATOM 566 OG SER B 23 2.518 19.623 -12.373 1.00 0.00 O ATOM 0 H SER B 23 0.715 20.446 -9.204 1.00 0.00 H new ATOM 0 HA SER B 23 -0.047 18.723 -10.420 1.00 0.00 H new ATOM 0 HB2 SER B 23 0.749 18.623 -12.757 1.00 0.00 H new ATOM 0 HB3 SER B 23 0.564 20.292 -12.255 1.00 0.00 H new ATOM 0 HG SER B 23 3.069 19.286 -11.636 1.00 0.00 H new ATOM 572 N ASP B 24 2.437 17.557 -9.239 1.00 0.00 N ATOM 573 CA ASP B 24 3.259 16.393 -8.924 1.00 0.00 C ATOM 574 C ASP B 24 2.547 15.098 -9.353 1.00 0.00 C ATOM 575 O ASP B 24 1.574 14.698 -8.714 1.00 0.00 O ATOM 576 CB ASP B 24 3.538 16.351 -7.415 1.00 0.00 C ATOM 577 CG ASP B 24 2.254 16.587 -6.621 1.00 0.00 C ATOM 578 OD1 ASP B 24 1.242 16.873 -7.237 1.00 0.00 O ATOM 579 OD2 ASP B 24 2.308 16.480 -5.407 1.00 0.00 O ATOM 0 H ASP B 24 2.380 18.252 -8.495 1.00 0.00 H new ATOM 0 HA ASP B 24 4.200 16.472 -9.468 1.00 0.00 H new ATOM 0 HB2 ASP B 24 3.965 15.385 -7.146 1.00 0.00 H new ATOM 0 HB3 ASP B 24 4.276 17.110 -7.156 1.00 0.00 H new ATOM 584 N PRO B 25 2.976 14.439 -10.420 1.00 0.00 N ATOM 585 CA PRO B 25 2.307 13.189 -10.891 1.00 0.00 C ATOM 586 C PRO B 25 2.632 11.984 -10.006 1.00 0.00 C ATOM 587 O PRO B 25 1.944 10.965 -10.057 1.00 0.00 O ATOM 588 CB PRO B 25 2.837 13.004 -12.322 1.00 0.00 C ATOM 589 CG PRO B 25 4.178 13.672 -12.337 1.00 0.00 C ATOM 590 CD PRO B 25 4.132 14.789 -11.281 1.00 0.00 C ATOM 0 HA PRO B 25 1.220 13.266 -10.851 1.00 0.00 H new ATOM 0 HB2 PRO B 25 2.921 11.948 -12.577 1.00 0.00 H new ATOM 0 HB3 PRO B 25 2.165 13.455 -13.052 1.00 0.00 H new ATOM 0 HG2 PRO B 25 4.968 12.957 -12.109 1.00 0.00 H new ATOM 0 HG3 PRO B 25 4.394 14.082 -13.324 1.00 0.00 H new ATOM 0 HD2 PRO B 25 5.057 14.830 -10.706 1.00 0.00 H new ATOM 0 HD3 PRO B 25 4.001 15.767 -11.743 1.00 0.00 H new ATOM 598 N LEU B 26 3.683 12.108 -9.204 1.00 0.00 N ATOM 599 CA LEU B 26 4.090 11.021 -8.320 1.00 0.00 C ATOM 600 C LEU B 26 2.989 10.718 -7.303 1.00 0.00 C ATOM 601 O LEU B 26 2.691 9.556 -7.025 1.00 0.00 O ATOM 602 CB LEU B 26 5.385 11.409 -7.591 1.00 0.00 C ATOM 603 CG LEU B 26 6.589 11.170 -8.508 1.00 0.00 C ATOM 604 CD1 LEU B 26 6.409 11.960 -9.808 1.00 0.00 C ATOM 605 CD2 LEU B 26 7.866 11.635 -7.803 1.00 0.00 C ATOM 0 H LEU B 26 4.265 12.943 -9.147 1.00 0.00 H new ATOM 0 HA LEU B 26 4.264 10.126 -8.917 1.00 0.00 H new ATOM 0 HB2 LEU B 26 5.345 12.457 -7.293 1.00 0.00 H new ATOM 0 HB3 LEU B 26 5.489 10.822 -6.678 1.00 0.00 H new ATOM 0 HG LEU B 26 6.664 10.107 -8.737 1.00 0.00 H new ATOM 0 HD11 LEU B 26 7.266 11.789 -10.459 1.00 0.00 H new ATOM 0 HD12 LEU B 26 5.500 11.631 -10.311 1.00 0.00 H new ATOM 0 HD13 LEU B 26 6.333 13.023 -9.580 1.00 0.00 H new ATOM 0 HD21 LEU B 26 8.723 11.466 -8.454 1.00 0.00 H new ATOM 0 HD22 LEU B 26 7.789 12.698 -7.574 1.00 0.00 H new ATOM 0 HD23 LEU B 26 7.996 11.073 -6.878 1.00 0.00 H new ATOM 617 N VAL B 27 2.387 11.768 -6.752 1.00 0.00 N ATOM 618 CA VAL B 27 1.323 11.595 -5.770 1.00 0.00 C ATOM 619 C VAL B 27 0.117 10.906 -6.405 1.00 0.00 C ATOM 620 O VAL B 27 -0.453 9.976 -5.833 1.00 0.00 O ATOM 621 CB VAL B 27 0.904 12.954 -5.210 1.00 0.00 C ATOM 622 CG1 VAL B 27 -0.298 12.780 -4.278 1.00 0.00 C ATOM 623 CG2 VAL B 27 2.073 13.563 -4.427 1.00 0.00 C ATOM 0 H VAL B 27 2.615 12.739 -6.966 1.00 0.00 H new ATOM 0 HA VAL B 27 1.698 10.971 -4.959 1.00 0.00 H new ATOM 0 HB VAL B 27 0.630 13.615 -6.032 1.00 0.00 H new ATOM 0 HG11 VAL B 27 -0.594 13.751 -3.881 1.00 0.00 H new ATOM 0 HG12 VAL B 27 -1.130 12.347 -4.834 1.00 0.00 H new ATOM 0 HG13 VAL B 27 -0.028 12.118 -3.455 1.00 0.00 H new ATOM 0 HG21 VAL B 27 1.777 14.533 -4.026 1.00 0.00 H new ATOM 0 HG22 VAL B 27 2.346 12.900 -3.607 1.00 0.00 H new ATOM 0 HG23 VAL B 27 2.928 13.691 -5.091 1.00 0.00 H new ATOM 633 N VAL B 28 -0.267 11.369 -7.591 1.00 0.00 N ATOM 634 CA VAL B 28 -1.408 10.792 -8.295 1.00 0.00 C ATOM 635 C VAL B 28 -1.125 9.340 -8.666 1.00 0.00 C ATOM 636 O VAL B 28 -1.977 8.469 -8.496 1.00 0.00 O ATOM 637 CB VAL B 28 -1.709 11.601 -9.558 1.00 0.00 C ATOM 638 CG1 VAL B 28 -2.829 10.925 -10.349 1.00 0.00 C ATOM 639 CG2 VAL B 28 -2.145 13.014 -9.163 1.00 0.00 C ATOM 0 H VAL B 28 0.191 12.137 -8.082 1.00 0.00 H new ATOM 0 HA VAL B 28 -2.275 10.823 -7.635 1.00 0.00 H new ATOM 0 HB VAL B 28 -0.813 11.653 -10.176 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -3.040 11.504 -11.248 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -2.519 9.919 -10.630 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -3.727 10.870 -9.733 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -2.360 13.593 -10.061 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -3.040 12.959 -8.544 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -1.345 13.498 -8.602 1.00 0.00 H new ATOM 649 N ALA B 29 0.078 9.089 -9.171 1.00 0.00 N ATOM 650 CA ALA B 29 0.463 7.738 -9.561 1.00 0.00 C ATOM 651 C ALA B 29 0.392 6.800 -8.361 1.00 0.00 C ATOM 652 O ALA B 29 0.123 5.610 -8.502 1.00 0.00 O ATOM 653 CB ALA B 29 1.882 7.741 -10.131 1.00 0.00 C ATOM 0 H ALA B 29 0.798 9.797 -9.319 1.00 0.00 H new ATOM 0 HA ALA B 29 -0.229 7.386 -10.326 1.00 0.00 H new ATOM 0 HB1 ALA B 29 2.160 6.727 -10.419 1.00 0.00 H new ATOM 0 HB2 ALA B 29 1.922 8.391 -11.005 1.00 0.00 H new ATOM 0 HB3 ALA B 29 2.577 8.107 -9.375 1.00 0.00 H new ATOM 659 N ALA B 30 0.639 7.337 -7.175 1.00 0.00 N ATOM 660 CA ALA B 30 0.587 6.523 -5.970 1.00 0.00 C ATOM 661 C ALA B 30 -0.862 6.184 -5.616 1.00 0.00 C ATOM 662 O ALA B 30 -1.164 5.065 -5.198 1.00 0.00 O ATOM 663 CB ALA B 30 1.250 7.263 -4.806 1.00 0.00 C ATOM 0 H ALA B 30 0.874 8.318 -7.022 1.00 0.00 H new ATOM 0 HA ALA B 30 1.128 5.595 -6.155 1.00 0.00 H new ATOM 0 HB1 ALA B 30 1.205 6.645 -3.909 1.00 0.00 H new ATOM 0 HB2 ALA B 30 2.291 7.470 -5.053 1.00 0.00 H new ATOM 0 HB3 ALA B 30 0.726 8.202 -4.626 1.00 0.00 H new ATOM 669 N ASN B 31 -1.751 7.163 -5.774 1.00 0.00 N ATOM 670 CA ASN B 31 -3.165 6.969 -5.459 1.00 0.00 C ATOM 671 C ASN B 31 -3.845 6.003 -6.431 1.00 0.00 C ATOM 672 O ASN B 31 -4.575 5.107 -6.011 1.00 0.00 O ATOM 673 CB ASN B 31 -3.893 8.313 -5.493 1.00 0.00 C ATOM 674 CG ASN B 31 -5.370 8.112 -5.170 1.00 0.00 C ATOM 675 OD1 ASN B 31 -5.712 7.278 -4.332 1.00 0.00 O ATOM 676 ND2 ASN B 31 -6.267 8.829 -5.788 1.00 0.00 N ATOM 0 H ASN B 31 -1.518 8.095 -6.117 1.00 0.00 H new ATOM 0 HA ASN B 31 -3.218 6.534 -4.461 1.00 0.00 H new ATOM 0 HB2 ASN B 31 -3.444 8.998 -4.773 1.00 0.00 H new ATOM 0 HB3 ASN B 31 -3.786 8.770 -6.477 1.00 0.00 H new ATOM 0 HD21 ASN B 31 -7.257 8.700 -5.578 1.00 0.00 H new ATOM 0 HD22 ASN B 31 -5.979 9.519 -6.482 1.00 0.00 H new ATOM 683 N ILE B 32 -3.615 6.195 -7.729 1.00 0.00 N ATOM 684 CA ILE B 32 -4.231 5.334 -8.731 1.00 0.00 C ATOM 685 C ILE B 32 -3.694 3.907 -8.620 1.00 0.00 C ATOM 686 O ILE B 32 -4.455 2.944 -8.686 1.00 0.00 O ATOM 687 CB ILE B 32 -3.942 5.904 -10.125 1.00 0.00 C ATOM 688 CG1 ILE B 32 -4.807 5.199 -11.174 1.00 0.00 C ATOM 689 CG2 ILE B 32 -2.466 5.698 -10.468 1.00 0.00 C ATOM 690 CD1 ILE B 32 -4.697 5.950 -12.502 1.00 0.00 C ATOM 0 H ILE B 32 -3.015 6.929 -8.106 1.00 0.00 H new ATOM 0 HA ILE B 32 -5.308 5.302 -8.564 1.00 0.00 H new ATOM 0 HB ILE B 32 -4.175 6.969 -10.125 1.00 0.00 H new ATOM 0 HG12 ILE B 32 -4.480 4.166 -11.298 1.00 0.00 H new ATOM 0 HG13 ILE B 32 -5.846 5.167 -10.845 1.00 0.00 H new ATOM 0 HG21 ILE B 32 -2.263 6.104 -11.459 1.00 0.00 H new ATOM 0 HG22 ILE B 32 -1.846 6.210 -9.732 1.00 0.00 H new ATOM 0 HG23 ILE B 32 -2.235 4.633 -10.458 1.00 0.00 H new ATOM 0 HD11 ILE B 32 -5.311 5.453 -13.253 1.00 0.00 H new ATOM 0 HD12 ILE B 32 -5.044 6.975 -12.370 1.00 0.00 H new ATOM 0 HD13 ILE B 32 -3.658 5.958 -12.830 1.00 0.00 H new ATOM 702 N ILE B 33 -2.381 3.783 -8.438 1.00 0.00 N ATOM 703 CA ILE B 33 -1.759 2.468 -8.306 1.00 0.00 C ATOM 704 C ILE B 33 -2.264 1.763 -7.048 1.00 0.00 C ATOM 705 O ILE B 33 -2.570 0.570 -7.079 1.00 0.00 O ATOM 706 CB ILE B 33 -0.227 2.605 -8.256 1.00 0.00 C ATOM 707 CG1 ILE B 33 0.298 3.042 -9.631 1.00 0.00 C ATOM 708 CG2 ILE B 33 0.404 1.260 -7.883 1.00 0.00 C ATOM 709 CD1 ILE B 33 1.772 3.445 -9.522 1.00 0.00 C ATOM 0 H ILE B 33 -1.733 4.569 -8.379 1.00 0.00 H new ATOM 0 HA ILE B 33 -2.031 1.869 -9.175 1.00 0.00 H new ATOM 0 HB ILE B 33 0.037 3.352 -7.507 1.00 0.00 H new ATOM 0 HG12 ILE B 33 0.186 2.229 -10.348 1.00 0.00 H new ATOM 0 HG13 ILE B 33 -0.290 3.880 -10.005 1.00 0.00 H new ATOM 0 HG21 ILE B 33 1.489 1.364 -7.849 1.00 0.00 H new ATOM 0 HG22 ILE B 33 0.039 0.946 -6.905 1.00 0.00 H new ATOM 0 HG23 ILE B 33 0.134 0.512 -8.629 1.00 0.00 H new ATOM 0 HD11 ILE B 33 2.138 3.754 -10.501 1.00 0.00 H new ATOM 0 HD12 ILE B 33 1.872 4.272 -8.820 1.00 0.00 H new ATOM 0 HD13 ILE B 33 2.356 2.596 -9.168 1.00 0.00 H new ATOM 721 N GLY B 34 -2.342 2.501 -5.944 1.00 0.00 N ATOM 722 CA GLY B 34 -2.805 1.922 -4.687 1.00 0.00 C ATOM 723 C GLY B 34 -4.232 1.403 -4.816 1.00 0.00 C ATOM 724 O GLY B 34 -4.542 0.292 -4.383 1.00 0.00 O ATOM 0 H GLY B 34 -2.094 3.489 -5.894 1.00 0.00 H new ATOM 0 HA2 GLY B 34 -2.143 1.107 -4.393 1.00 0.00 H new ATOM 0 HA3 GLY B 34 -2.757 2.672 -3.898 1.00 0.00 H new ATOM 728 N ILE B 35 -5.097 2.207 -5.424 1.00 0.00 N ATOM 729 CA ILE B 35 -6.488 1.813 -5.615 1.00 0.00 C ATOM 730 C ILE B 35 -6.572 0.594 -6.530 1.00 0.00 C ATOM 731 O ILE B 35 -7.337 -0.335 -6.276 1.00 0.00 O ATOM 732 CB ILE B 35 -7.286 2.974 -6.213 1.00 0.00 C ATOM 733 CG1 ILE B 35 -7.384 4.104 -5.186 1.00 0.00 C ATOM 734 CG2 ILE B 35 -8.698 2.496 -6.576 1.00 0.00 C ATOM 735 CD1 ILE B 35 -7.915 5.365 -5.868 1.00 0.00 C ATOM 0 H ILE B 35 -4.862 3.129 -5.791 1.00 0.00 H new ATOM 0 HA ILE B 35 -6.914 1.553 -4.646 1.00 0.00 H new ATOM 0 HB ILE B 35 -6.783 3.334 -7.110 1.00 0.00 H new ATOM 0 HG12 ILE B 35 -8.045 3.812 -4.370 1.00 0.00 H new ATOM 0 HG13 ILE B 35 -6.405 4.299 -4.748 1.00 0.00 H new ATOM 0 HG21 ILE B 35 -9.264 3.324 -7.002 1.00 0.00 H new ATOM 0 HG22 ILE B 35 -8.633 1.689 -7.305 1.00 0.00 H new ATOM 0 HG23 ILE B 35 -9.202 2.135 -5.679 1.00 0.00 H new ATOM 0 HD11 ILE B 35 -7.986 6.171 -5.138 1.00 0.00 H new ATOM 0 HD12 ILE B 35 -7.236 5.659 -6.669 1.00 0.00 H new ATOM 0 HD13 ILE B 35 -8.902 5.165 -6.284 1.00 0.00 H new ATOM 747 N LEU B 36 -5.779 0.609 -7.599 1.00 0.00 N ATOM 748 CA LEU B 36 -5.775 -0.497 -8.548 1.00 0.00 C ATOM 749 C LEU B 36 -5.359 -1.787 -7.853 1.00 0.00 C ATOM 750 O LEU B 36 -5.931 -2.849 -8.098 1.00 0.00 O ATOM 751 CB LEU B 36 -4.809 -0.200 -9.704 1.00 0.00 C ATOM 752 CG LEU B 36 -4.783 -1.373 -10.702 1.00 0.00 C ATOM 753 CD1 LEU B 36 -6.195 -1.639 -11.254 1.00 0.00 C ATOM 754 CD2 LEU B 36 -3.836 -1.023 -11.855 1.00 0.00 C ATOM 0 H LEU B 36 -5.137 1.368 -7.827 1.00 0.00 H new ATOM 0 HA LEU B 36 -6.783 -0.615 -8.945 1.00 0.00 H new ATOM 0 HB2 LEU B 36 -5.114 0.713 -10.215 1.00 0.00 H new ATOM 0 HB3 LEU B 36 -3.807 -0.026 -9.312 1.00 0.00 H new ATOM 0 HG LEU B 36 -4.435 -2.272 -10.193 1.00 0.00 H new ATOM 0 HD11 LEU B 36 -6.160 -2.471 -11.958 1.00 0.00 H new ATOM 0 HD12 LEU B 36 -6.866 -1.887 -10.432 1.00 0.00 H new ATOM 0 HD13 LEU B 36 -6.560 -0.748 -11.764 1.00 0.00 H new ATOM 0 HD21 LEU B 36 -3.810 -1.847 -12.568 1.00 0.00 H new ATOM 0 HD22 LEU B 36 -4.190 -0.122 -12.355 1.00 0.00 H new ATOM 0 HD23 LEU B 36 -2.834 -0.851 -11.463 1.00 0.00 H new ATOM 766 N HIS B 37 -4.363 -1.688 -6.980 1.00 0.00 N ATOM 767 CA HIS B 37 -3.884 -2.860 -6.257 1.00 0.00 C ATOM 768 C HIS B 37 -5.022 -3.485 -5.460 1.00 0.00 C ATOM 769 O HIS B 37 -5.166 -4.706 -5.420 1.00 0.00 O ATOM 770 CB HIS B 37 -2.764 -2.466 -5.298 1.00 0.00 C ATOM 771 CG HIS B 37 -2.249 -3.701 -4.613 1.00 0.00 C ATOM 772 ND1 HIS B 37 -0.948 -4.147 -4.765 1.00 0.00 N ATOM 773 CD2 HIS B 37 -2.857 -4.606 -3.781 1.00 0.00 C ATOM 774 CE1 HIS B 37 -0.821 -5.275 -4.044 1.00 0.00 C ATOM 775 NE2 HIS B 37 -1.954 -5.598 -3.423 1.00 0.00 N ATOM 0 H HIS B 37 -3.876 -0.820 -6.757 1.00 0.00 H new ATOM 0 HA HIS B 37 -3.506 -3.581 -6.982 1.00 0.00 H new ATOM 0 HB2 HIS B 37 -1.958 -1.974 -5.842 1.00 0.00 H new ATOM 0 HB3 HIS B 37 -3.133 -1.753 -4.561 1.00 0.00 H new ATOM 0 HD2 HIS B 37 -3.885 -4.555 -3.453 1.00 0.00 H new ATOM 0 HE1 HIS B 37 0.091 -5.850 -3.977 1.00 0.00 H new ATOM 0 HE2 HIS B 37 -2.122 -6.400 -2.816 1.00 0.00 H new ATOM 783 N LEU B 38 -5.828 -2.640 -4.820 1.00 0.00 N ATOM 784 CA LEU B 38 -6.949 -3.123 -4.018 1.00 0.00 C ATOM 785 C LEU B 38 -7.941 -3.901 -4.874 1.00 0.00 C ATOM 786 O LEU B 38 -8.473 -4.915 -4.433 1.00 0.00 O ATOM 787 CB LEU B 38 -7.657 -1.936 -3.326 1.00 0.00 C ATOM 788 CG LEU B 38 -7.033 -1.672 -1.937 1.00 0.00 C ATOM 789 CD1 LEU B 38 -7.316 -0.235 -1.497 1.00 0.00 C ATOM 790 CD2 LEU B 38 -7.637 -2.636 -0.900 1.00 0.00 C ATOM 0 H LEU B 38 -5.727 -1.625 -4.841 1.00 0.00 H new ATOM 0 HA LEU B 38 -6.557 -3.798 -3.257 1.00 0.00 H new ATOM 0 HB2 LEU B 38 -7.573 -1.043 -3.945 1.00 0.00 H new ATOM 0 HB3 LEU B 38 -8.720 -2.151 -3.219 1.00 0.00 H new ATOM 0 HG LEU B 38 -5.956 -1.828 -2.006 1.00 0.00 H new ATOM 0 HD11 LEU B 38 -6.872 -0.060 -0.517 1.00 0.00 H new ATOM 0 HD12 LEU B 38 -6.885 0.458 -2.220 1.00 0.00 H new ATOM 0 HD13 LEU B 38 -8.393 -0.077 -1.440 1.00 0.00 H new ATOM 0 HD21 LEU B 38 -7.193 -2.445 0.077 1.00 0.00 H new ATOM 0 HD22 LEU B 38 -8.715 -2.482 -0.845 1.00 0.00 H new ATOM 0 HD23 LEU B 38 -7.432 -3.665 -1.197 1.00 0.00 H new ATOM 802 N ILE B 39 -8.196 -3.427 -6.083 1.00 0.00 N ATOM 803 CA ILE B 39 -9.141 -4.109 -6.957 1.00 0.00 C ATOM 804 C ILE B 39 -8.654 -5.522 -7.279 1.00 0.00 C ATOM 805 O ILE B 39 -9.427 -6.478 -7.242 1.00 0.00 O ATOM 806 CB ILE B 39 -9.305 -3.310 -8.253 1.00 0.00 C ATOM 807 CG1 ILE B 39 -9.987 -1.975 -7.935 1.00 0.00 C ATOM 808 CG2 ILE B 39 -10.164 -4.103 -9.242 1.00 0.00 C ATOM 809 CD1 ILE B 39 -9.943 -1.061 -9.164 1.00 0.00 C ATOM 0 H ILE B 39 -7.771 -2.588 -6.478 1.00 0.00 H new ATOM 0 HA ILE B 39 -10.101 -4.182 -6.447 1.00 0.00 H new ATOM 0 HB ILE B 39 -8.327 -3.127 -8.697 1.00 0.00 H new ATOM 0 HG12 ILE B 39 -11.021 -2.147 -7.636 1.00 0.00 H new ATOM 0 HG13 ILE B 39 -9.488 -1.493 -7.094 1.00 0.00 H new ATOM 0 HG21 ILE B 39 -10.279 -3.532 -10.163 1.00 0.00 H new ATOM 0 HG22 ILE B 39 -9.680 -5.054 -9.463 1.00 0.00 H new ATOM 0 HG23 ILE B 39 -11.145 -4.288 -8.805 1.00 0.00 H new ATOM 0 HD11 ILE B 39 -10.430 -0.114 -8.931 1.00 0.00 H new ATOM 0 HD12 ILE B 39 -8.906 -0.877 -9.444 1.00 0.00 H new ATOM 0 HD13 ILE B 39 -10.462 -1.541 -9.993 1.00 0.00 H new ATOM 821 N LEU B 40 -7.375 -5.647 -7.600 1.00 0.00 N ATOM 822 CA LEU B 40 -6.811 -6.954 -7.919 1.00 0.00 C ATOM 823 C LEU B 40 -6.657 -7.814 -6.663 1.00 0.00 C ATOM 824 O LEU B 40 -6.966 -9.007 -6.674 1.00 0.00 O ATOM 825 CB LEU B 40 -5.457 -6.772 -8.597 1.00 0.00 C ATOM 826 CG LEU B 40 -5.601 -5.791 -9.768 1.00 0.00 C ATOM 827 CD1 LEU B 40 -4.229 -5.563 -10.404 1.00 0.00 C ATOM 828 CD2 LEU B 40 -6.570 -6.360 -10.816 1.00 0.00 C ATOM 0 H LEU B 40 -6.714 -4.872 -7.647 1.00 0.00 H new ATOM 0 HA LEU B 40 -7.494 -7.469 -8.595 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -4.727 -6.396 -7.881 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -5.086 -7.732 -8.956 1.00 0.00 H new ATOM 0 HG LEU B 40 -5.997 -4.845 -9.400 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -4.325 -4.867 -11.237 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -3.548 -5.148 -9.661 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -3.835 -6.512 -10.768 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -6.666 -5.656 -11.643 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -6.186 -7.309 -11.190 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -7.547 -6.519 -10.360 1.00 0.00 H new ATOM 840 N TRP B 41 -6.165 -7.205 -5.586 1.00 0.00 N ATOM 841 CA TRP B 41 -5.960 -7.925 -4.331 1.00 0.00 C ATOM 842 C TRP B 41 -7.286 -8.349 -3.701 1.00 0.00 C ATOM 843 O TRP B 41 -7.442 -9.495 -3.277 1.00 0.00 O ATOM 844 CB TRP B 41 -5.168 -7.047 -3.354 1.00 0.00 C ATOM 845 CG TRP B 41 -5.141 -7.683 -1.999 1.00 0.00 C ATOM 846 CD1 TRP B 41 -4.265 -8.631 -1.598 1.00 0.00 C ATOM 847 CD2 TRP B 41 -5.995 -7.403 -0.856 1.00 0.00 C ATOM 848 NE1 TRP B 41 -4.548 -8.971 -0.287 1.00 0.00 N ATOM 849 CE2 TRP B 41 -5.601 -8.234 0.214 1.00 0.00 C ATOM 850 CE3 TRP B 41 -7.066 -6.519 -0.647 1.00 0.00 C ATOM 851 CZ2 TRP B 41 -6.250 -8.190 1.445 1.00 0.00 C ATOM 852 CZ3 TRP B 41 -7.714 -6.468 0.596 1.00 0.00 C ATOM 853 CH2 TRP B 41 -7.305 -7.302 1.636 1.00 0.00 C ATOM 0 H TRP B 41 -5.902 -6.220 -5.557 1.00 0.00 H new ATOM 0 HA TRP B 41 -5.395 -8.831 -4.550 1.00 0.00 H new ATOM 0 HB2 TRP B 41 -4.151 -6.908 -3.720 1.00 0.00 H new ATOM 0 HB3 TRP B 41 -5.622 -6.058 -3.291 1.00 0.00 H new ATOM 0 HD1 TRP B 41 -3.475 -9.053 -2.201 1.00 0.00 H new ATOM 0 HE1 TRP B 41 -4.041 -9.679 0.244 1.00 0.00 H new ATOM 0 HE3 TRP B 41 -7.393 -5.874 -1.449 1.00 0.00 H new ATOM 0 HZ2 TRP B 41 -5.937 -8.841 2.247 1.00 0.00 H new ATOM 0 HZ3 TRP B 41 -8.533 -5.780 0.748 1.00 0.00 H new ATOM 0 HH2 TRP B 41 -7.807 -7.259 2.591 1.00 0.00 H new ATOM 864 N ILE B 42 -8.231 -7.423 -3.629 1.00 0.00 N ATOM 865 CA ILE B 42 -9.526 -7.721 -3.031 1.00 0.00 C ATOM 866 C ILE B 42 -10.249 -8.782 -3.852 1.00 0.00 C ATOM 867 O ILE B 42 -10.943 -9.638 -3.307 1.00 0.00 O ATOM 868 CB ILE B 42 -10.379 -6.443 -2.943 1.00 0.00 C ATOM 869 CG1 ILE B 42 -11.550 -6.666 -1.982 1.00 0.00 C ATOM 870 CG2 ILE B 42 -10.934 -6.074 -4.331 1.00 0.00 C ATOM 871 CD1 ILE B 42 -12.255 -5.332 -1.738 1.00 0.00 C ATOM 0 H ILE B 42 -8.129 -6.468 -3.973 1.00 0.00 H new ATOM 0 HA ILE B 42 -9.368 -8.104 -2.023 1.00 0.00 H new ATOM 0 HB ILE B 42 -9.750 -5.631 -2.578 1.00 0.00 H new ATOM 0 HG12 ILE B 42 -12.249 -7.390 -2.402 1.00 0.00 H new ATOM 0 HG13 ILE B 42 -11.190 -7.079 -1.040 1.00 0.00 H new ATOM 0 HG21 ILE B 42 -11.535 -5.168 -4.253 1.00 0.00 H new ATOM 0 HG22 ILE B 42 -10.107 -5.903 -5.020 1.00 0.00 H new ATOM 0 HG23 ILE B 42 -11.553 -6.890 -4.704 1.00 0.00 H new ATOM 0 HD11 ILE B 42 -13.091 -5.482 -1.054 1.00 0.00 H new ATOM 0 HD12 ILE B 42 -11.551 -4.623 -1.301 1.00 0.00 H new ATOM 0 HD13 ILE B 42 -12.626 -4.938 -2.684 1.00 0.00 H new ATOM 883 N LEU B 43 -10.086 -8.713 -5.171 1.00 0.00 N ATOM 884 CA LEU B 43 -10.734 -9.669 -6.056 1.00 0.00 C ATOM 885 C LEU B 43 -10.252 -11.083 -5.749 1.00 0.00 C ATOM 886 O LEU B 43 -11.045 -12.020 -5.694 1.00 0.00 O ATOM 887 CB LEU B 43 -10.426 -9.325 -7.519 1.00 0.00 C ATOM 888 CG LEU B 43 -11.095 -10.337 -8.465 1.00 0.00 C ATOM 889 CD1 LEU B 43 -12.617 -10.353 -8.241 1.00 0.00 C ATOM 890 CD2 LEU B 43 -10.792 -9.939 -9.914 1.00 0.00 C ATOM 0 H LEU B 43 -9.516 -8.012 -5.644 1.00 0.00 H new ATOM 0 HA LEU B 43 -11.811 -9.618 -5.895 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -10.780 -8.319 -7.744 1.00 0.00 H new ATOM 0 HB3 LEU B 43 -9.348 -9.327 -7.679 1.00 0.00 H new ATOM 0 HG LEU B 43 -10.703 -11.334 -8.262 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -13.077 -11.074 -8.917 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -12.830 -10.636 -7.210 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -13.024 -9.361 -8.437 1.00 0.00 H new ATOM 0 HD21 LEU B 43 -11.262 -10.651 -10.593 1.00 0.00 H new ATOM 0 HD22 LEU B 43 -11.184 -8.940 -10.107 1.00 0.00 H new ATOM 0 HD23 LEU B 43 -9.714 -9.943 -10.074 1.00 0.00 H new ATOM 902 N ASP B 44 -8.949 -11.236 -5.554 1.00 0.00 N ATOM 903 CA ASP B 44 -8.394 -12.549 -5.256 1.00 0.00 C ATOM 904 C ASP B 44 -8.901 -13.049 -3.908 1.00 0.00 C ATOM 905 O ASP B 44 -9.280 -14.212 -3.769 1.00 0.00 O ATOM 906 CB ASP B 44 -6.868 -12.481 -5.242 1.00 0.00 C ATOM 907 CG ASP B 44 -6.288 -13.890 -5.212 1.00 0.00 C ATOM 908 OD1 ASP B 44 -7.039 -14.811 -4.936 1.00 0.00 O ATOM 909 OD2 ASP B 44 -5.105 -14.028 -5.470 1.00 0.00 O ATOM 0 H ASP B 44 -8.266 -10.480 -5.596 1.00 0.00 H new ATOM 0 HA ASP B 44 -8.715 -13.245 -6.031 1.00 0.00 H new ATOM 0 HB2 ASP B 44 -6.511 -11.950 -6.124 1.00 0.00 H new ATOM 0 HB3 ASP B 44 -6.528 -11.919 -4.372 1.00 0.00 H new ATOM 914 N ARG B 45 -8.906 -12.166 -2.916 1.00 0.00 N ATOM 915 CA ARG B 45 -9.369 -12.529 -1.581 1.00 0.00 C ATOM 916 C ARG B 45 -10.878 -12.760 -1.573 1.00 0.00 C ATOM 917 O ARG B 45 -11.418 -13.377 -0.656 1.00 0.00 O ATOM 918 CB ARG B 45 -8.999 -11.424 -0.585 1.00 0.00 C ATOM 919 CG ARG B 45 -9.388 -11.852 0.834 1.00 0.00 C ATOM 920 CD ARG B 45 -8.904 -10.804 1.837 1.00 0.00 C ATOM 921 NE ARG B 45 -9.142 -11.269 3.202 1.00 0.00 N ATOM 922 CZ ARG B 45 -10.298 -11.042 3.823 1.00 0.00 C ATOM 923 NH1 ARG B 45 -11.251 -10.389 3.213 1.00 0.00 N ATOM 924 NH2 ARG B 45 -10.482 -11.474 5.040 1.00 0.00 N ATOM 0 H ARG B 45 -8.597 -11.199 -3.009 1.00 0.00 H new ATOM 0 HA ARG B 45 -8.881 -13.458 -1.286 1.00 0.00 H new ATOM 0 HB2 ARG B 45 -7.929 -11.222 -0.633 1.00 0.00 H new ATOM 0 HB3 ARG B 45 -9.510 -10.498 -0.848 1.00 0.00 H new ATOM 0 HG2 ARG B 45 -10.470 -11.967 0.906 1.00 0.00 H new ATOM 0 HG3 ARG B 45 -8.948 -12.822 1.066 1.00 0.00 H new ATOM 0 HD2 ARG B 45 -7.841 -10.612 1.690 1.00 0.00 H new ATOM 0 HD3 ARG B 45 -9.425 -9.861 1.670 1.00 0.00 H new ATOM 0 HE ARG B 45 -8.406 -11.779 3.690 1.00 0.00 H new ATOM 0 HH11 ARG B 45 -11.110 -10.053 2.260 1.00 0.00 H new ATOM 0 HH12 ARG B 45 -12.136 -10.216 3.689 1.00 0.00 H new ATOM 0 HH21 ARG B 45 -9.740 -11.986 5.517 1.00 0.00 H new ATOM 0 HH22 ARG B 45 -11.368 -11.300 5.515 1.00 0.00 H new ATOM 938 N LEU B 46 -11.561 -12.260 -2.597 1.00 0.00 N ATOM 939 CA LEU B 46 -13.008 -12.424 -2.676 1.00 0.00 C ATOM 940 C LEU B 46 -13.377 -13.903 -2.763 1.00 0.00 C ATOM 941 O LEU B 46 -14.316 -14.356 -2.109 1.00 0.00 O ATOM 942 CB LEU B 46 -13.555 -11.685 -3.903 1.00 0.00 C ATOM 943 CG LEU B 46 -15.090 -11.723 -3.910 1.00 0.00 C ATOM 944 CD1 LEU B 46 -15.653 -10.945 -2.705 1.00 0.00 C ATOM 945 CD2 LEU B 46 -15.587 -11.092 -5.214 1.00 0.00 C ATOM 0 H LEU B 46 -11.144 -11.745 -3.373 1.00 0.00 H new ATOM 0 HA LEU B 46 -13.451 -12.003 -1.773 1.00 0.00 H new ATOM 0 HB2 LEU B 46 -13.210 -10.651 -3.896 1.00 0.00 H new ATOM 0 HB3 LEU B 46 -13.169 -12.144 -4.814 1.00 0.00 H new ATOM 0 HG LEU B 46 -15.430 -12.756 -3.839 1.00 0.00 H new ATOM 0 HD11 LEU B 46 -16.742 -10.982 -2.725 1.00 0.00 H new ATOM 0 HD12 LEU B 46 -15.292 -11.395 -1.780 1.00 0.00 H new ATOM 0 HD13 LEU B 46 -15.324 -9.907 -2.756 1.00 0.00 H new ATOM 0 HD21 LEU B 46 -16.677 -11.111 -5.235 1.00 0.00 H new ATOM 0 HD22 LEU B 46 -15.241 -10.060 -5.274 1.00 0.00 H new ATOM 0 HD23 LEU B 46 -15.198 -11.655 -6.062 1.00 0.00 H new ATOM 957 N PHE B 47 -12.639 -14.651 -3.585 1.00 0.00 N ATOM 958 CA PHE B 47 -12.904 -16.083 -3.765 1.00 0.00 C ATOM 959 C PHE B 47 -11.932 -16.929 -2.948 1.00 0.00 C ATOM 960 O PHE B 47 -12.055 -18.154 -2.900 1.00 0.00 O ATOM 961 CB PHE B 47 -12.772 -16.443 -5.247 1.00 0.00 C ATOM 962 CG PHE B 47 -13.815 -15.688 -6.040 1.00 0.00 C ATOM 963 CD1 PHE B 47 -15.131 -16.163 -6.099 1.00 0.00 C ATOM 964 CD2 PHE B 47 -13.464 -14.513 -6.715 1.00 0.00 C ATOM 965 CE1 PHE B 47 -16.095 -15.461 -6.833 1.00 0.00 C ATOM 966 CE2 PHE B 47 -14.428 -13.811 -7.448 1.00 0.00 C ATOM 967 CZ PHE B 47 -15.744 -14.285 -7.507 1.00 0.00 C ATOM 0 H PHE B 47 -11.857 -14.294 -4.134 1.00 0.00 H new ATOM 0 HA PHE B 47 -13.916 -16.292 -3.418 1.00 0.00 H new ATOM 0 HB2 PHE B 47 -11.774 -16.193 -5.606 1.00 0.00 H new ATOM 0 HB3 PHE B 47 -12.900 -17.517 -5.385 1.00 0.00 H new ATOM 0 HD1 PHE B 47 -15.402 -17.070 -5.579 1.00 0.00 H new ATOM 0 HD2 PHE B 47 -12.449 -14.148 -6.670 1.00 0.00 H new ATOM 0 HE1 PHE B 47 -17.110 -15.827 -6.879 1.00 0.00 H new ATOM 0 HE2 PHE B 47 -14.157 -12.904 -7.968 1.00 0.00 H new ATOM 0 HZ PHE B 47 -16.488 -13.744 -8.072 1.00 0.00 H new ATOM 977 N PHE B 48 -10.966 -16.275 -2.304 1.00 0.00 N ATOM 978 CA PHE B 48 -9.972 -16.980 -1.487 1.00 0.00 C ATOM 979 C PHE B 48 -9.823 -16.306 -0.126 1.00 0.00 C ATOM 980 O PHE B 48 -9.963 -15.091 -0.007 1.00 0.00 O ATOM 981 CB PHE B 48 -8.624 -16.985 -2.207 1.00 0.00 C ATOM 982 CG PHE B 48 -8.707 -17.885 -3.418 1.00 0.00 C ATOM 983 CD1 PHE B 48 -9.186 -17.382 -4.633 1.00 0.00 C ATOM 984 CD2 PHE B 48 -8.311 -19.223 -3.321 1.00 0.00 C ATOM 985 CE1 PHE B 48 -9.266 -18.218 -5.753 1.00 0.00 C ATOM 986 CE2 PHE B 48 -8.393 -20.060 -4.441 1.00 0.00 C ATOM 987 CZ PHE B 48 -8.869 -19.557 -5.658 1.00 0.00 C ATOM 0 H PHE B 48 -10.848 -15.262 -2.330 1.00 0.00 H new ATOM 0 HA PHE B 48 -10.309 -18.005 -1.335 1.00 0.00 H new ATOM 0 HB2 PHE B 48 -8.357 -15.973 -2.510 1.00 0.00 H new ATOM 0 HB3 PHE B 48 -7.841 -17.333 -1.534 1.00 0.00 H new ATOM 0 HD1 PHE B 48 -9.494 -16.349 -4.706 1.00 0.00 H new ATOM 0 HD2 PHE B 48 -7.942 -19.611 -2.383 1.00 0.00 H new ATOM 0 HE1 PHE B 48 -9.634 -17.830 -6.691 1.00 0.00 H new ATOM 0 HE2 PHE B 48 -8.089 -21.094 -4.366 1.00 0.00 H new ATOM 0 HZ PHE B 48 -8.930 -20.201 -6.523 1.00 0.00 H new ATOM 997 N LYS B 49 -9.536 -17.103 0.896 1.00 0.00 N ATOM 998 CA LYS B 49 -9.369 -16.568 2.242 1.00 0.00 C ATOM 999 C LYS B 49 -8.692 -17.592 3.147 1.00 0.00 C ATOM 1000 O LYS B 49 -8.424 -18.685 2.672 1.00 0.00 O ATOM 1001 CB LYS B 49 -10.737 -16.188 2.819 1.00 0.00 C ATOM 1002 CG LYS B 49 -11.638 -17.425 2.853 1.00 0.00 C ATOM 1003 CD LYS B 49 -13.024 -17.032 3.368 1.00 0.00 C ATOM 1004 CE LYS B 49 -13.928 -18.267 3.385 1.00 0.00 C ATOM 1005 NZ LYS B 49 -15.277 -17.889 3.896 1.00 0.00 N ATOM 1006 OXT LYS B 49 -8.450 -17.270 4.297 1.00 0.00 O ATOM 0 H LYS B 49 -9.415 -18.113 0.820 1.00 0.00 H new ATOM 0 HA LYS B 49 -8.737 -15.681 2.190 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -10.620 -15.783 3.824 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -11.196 -15.407 2.212 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -11.718 -17.857 1.856 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -11.202 -18.188 3.497 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -12.946 -16.611 4.370 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -13.456 -16.260 2.731 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -14.011 -18.684 2.381 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -13.492 -19.041 4.016 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -15.891 -18.728 3.908 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -15.189 -17.511 4.861 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -15.692 -17.164 3.276 1.00 0.00 H new TER 1020 LYS B 49 ATOM 1021 N SER C 19 8.139 24.816 -6.373 1.00 0.00 N ATOM 1022 CA SER C 19 9.388 24.508 -7.125 1.00 0.00 C ATOM 1023 C SER C 19 10.060 23.283 -6.513 1.00 0.00 C ATOM 1024 O SER C 19 11.277 23.125 -6.598 1.00 0.00 O ATOM 1025 CB SER C 19 10.332 25.707 -7.057 1.00 0.00 C ATOM 1026 OG SER C 19 9.648 26.870 -7.508 1.00 0.00 O ATOM 0 HA SER C 19 9.146 24.301 -8.168 1.00 0.00 H new ATOM 0 HB2 SER C 19 10.683 25.851 -6.035 1.00 0.00 H new ATOM 0 HB3 SER C 19 11.212 25.527 -7.674 1.00 0.00 H new ATOM 0 HG SER C 19 8.699 26.804 -7.272 1.00 0.00 H new ATOM 1034 N ASN C 20 9.258 22.421 -5.895 1.00 0.00 N ATOM 1035 CA ASN C 20 9.780 21.213 -5.269 1.00 0.00 C ATOM 1036 C ASN C 20 10.868 21.559 -4.258 1.00 0.00 C ATOM 1037 O ASN C 20 11.825 20.805 -4.075 1.00 0.00 O ATOM 1038 CB ASN C 20 10.350 20.277 -6.337 1.00 0.00 C ATOM 1039 CG ASN C 20 9.219 19.699 -7.181 1.00 0.00 C ATOM 1040 OD1 ASN C 20 8.076 19.632 -6.728 1.00 0.00 O ATOM 1041 ND2 ASN C 20 9.468 19.283 -8.392 1.00 0.00 N ATOM 0 H ASN C 20 8.248 22.537 -5.815 1.00 0.00 H new ATOM 0 HA ASN C 20 8.963 20.714 -4.747 1.00 0.00 H new ATOM 0 HB2 ASN C 20 11.049 20.820 -6.973 1.00 0.00 H new ATOM 0 HB3 ASN C 20 10.911 19.471 -5.864 1.00 0.00 H new ATOM 0 HD21 ASN C 20 8.715 18.902 -8.965 1.00 0.00 H new ATOM 0 HD22 ASN C 20 10.415 19.339 -8.766 1.00 0.00 H new ATOM 1048 N ASP C 21 10.710 22.705 -3.602 1.00 0.00 N ATOM 1049 CA ASP C 21 11.682 23.146 -2.607 1.00 0.00 C ATOM 1050 C ASP C 21 11.680 22.209 -1.404 1.00 0.00 C ATOM 1051 O ASP C 21 12.719 21.972 -0.787 1.00 0.00 O ATOM 1052 CB ASP C 21 11.356 24.571 -2.157 1.00 0.00 C ATOM 1053 CG ASP C 21 9.924 24.642 -1.635 1.00 0.00 C ATOM 1054 OD1 ASP C 21 9.232 23.641 -1.729 1.00 0.00 O ATOM 1055 OD2 ASP C 21 9.543 25.695 -1.154 1.00 0.00 O ATOM 0 H ASP C 21 9.924 23.341 -3.740 1.00 0.00 H new ATOM 0 HA ASP C 21 12.674 23.129 -3.059 1.00 0.00 H new ATOM 0 HB2 ASP C 21 12.051 24.882 -1.377 1.00 0.00 H new ATOM 0 HB3 ASP C 21 11.482 25.262 -2.991 1.00 0.00 H new ATOM 1060 N SER C 22 10.506 21.679 -1.079 1.00 0.00 N ATOM 1061 CA SER C 22 10.377 20.767 0.050 1.00 0.00 C ATOM 1062 C SER C 22 11.258 19.540 -0.153 1.00 0.00 C ATOM 1063 O SER C 22 11.872 19.043 0.791 1.00 0.00 O ATOM 1064 CB SER C 22 8.921 20.326 0.202 1.00 0.00 C ATOM 1065 OG SER C 22 8.090 21.475 0.288 1.00 0.00 O ATOM 0 H SER C 22 9.636 21.864 -1.578 1.00 0.00 H new ATOM 0 HA SER C 22 10.696 21.289 0.952 1.00 0.00 H new ATOM 0 HB2 SER C 22 8.624 19.711 -0.648 1.00 0.00 H new ATOM 0 HB3 SER C 22 8.806 19.712 1.095 1.00 0.00 H new ATOM 0 HG SER C 22 7.155 21.196 0.384 1.00 0.00 H new ATOM 1071 N SER C 23 11.308 19.048 -1.386 1.00 0.00 N ATOM 1072 CA SER C 23 12.111 17.871 -1.691 1.00 0.00 C ATOM 1073 C SER C 23 11.809 16.760 -0.692 1.00 0.00 C ATOM 1074 O SER C 23 12.620 15.856 -0.493 1.00 0.00 O ATOM 1075 CB SER C 23 13.600 18.217 -1.623 1.00 0.00 C ATOM 1076 OG SER C 23 13.931 18.624 -0.303 1.00 0.00 O ATOM 0 H SER C 23 10.807 19.441 -2.183 1.00 0.00 H new ATOM 0 HA SER C 23 11.863 17.533 -2.697 1.00 0.00 H new ATOM 0 HB2 SER C 23 14.199 17.352 -1.909 1.00 0.00 H new ATOM 0 HB3 SER C 23 13.832 19.014 -2.330 1.00 0.00 H new ATOM 0 HG SER C 23 13.207 18.374 0.308 1.00 0.00 H new ATOM 1082 N ASP C 24 10.637 16.836 -0.064 1.00 0.00 N ATOM 1083 CA ASP C 24 10.243 15.832 0.922 1.00 0.00 C ATOM 1084 C ASP C 24 10.551 14.418 0.400 1.00 0.00 C ATOM 1085 O ASP C 24 9.863 13.938 -0.501 1.00 0.00 O ATOM 1086 CB ASP C 24 8.740 15.957 1.214 1.00 0.00 C ATOM 1087 CG ASP C 24 7.946 16.069 -0.085 1.00 0.00 C ATOM 1088 OD1 ASP C 24 8.564 16.164 -1.132 1.00 0.00 O ATOM 1089 OD2 ASP C 24 6.727 16.064 -0.008 1.00 0.00 O ATOM 0 H ASP C 24 9.950 17.574 -0.218 1.00 0.00 H new ATOM 0 HA ASP C 24 10.809 16.000 1.839 1.00 0.00 H new ATOM 0 HB2 ASP C 24 8.401 15.089 1.780 1.00 0.00 H new ATOM 0 HB3 ASP C 24 8.557 16.834 1.835 1.00 0.00 H new ATOM 1094 N PRO C 25 11.570 13.740 0.913 1.00 0.00 N ATOM 1095 CA PRO C 25 11.924 12.373 0.428 1.00 0.00 C ATOM 1096 C PRO C 25 10.949 11.305 0.929 1.00 0.00 C ATOM 1097 O PRO C 25 10.905 10.196 0.395 1.00 0.00 O ATOM 1098 CB PRO C 25 13.344 12.147 0.970 1.00 0.00 C ATOM 1099 CG PRO C 25 13.439 12.996 2.200 1.00 0.00 C ATOM 1100 CD PRO C 25 12.476 14.179 1.999 1.00 0.00 C ATOM 0 HA PRO C 25 11.870 12.297 -0.658 1.00 0.00 H new ATOM 0 HB2 PRO C 25 13.513 11.096 1.204 1.00 0.00 H new ATOM 0 HB3 PRO C 25 14.096 12.435 0.235 1.00 0.00 H new ATOM 0 HG2 PRO C 25 13.168 12.423 3.087 1.00 0.00 H new ATOM 0 HG3 PRO C 25 14.460 13.349 2.348 1.00 0.00 H new ATOM 0 HD2 PRO C 25 11.923 14.400 2.912 1.00 0.00 H new ATOM 0 HD3 PRO C 25 13.014 15.086 1.725 1.00 0.00 H new ATOM 1108 N LEU C 26 10.180 11.643 1.957 1.00 0.00 N ATOM 1109 CA LEU C 26 9.220 10.703 2.521 1.00 0.00 C ATOM 1110 C LEU C 26 8.160 10.331 1.482 1.00 0.00 C ATOM 1111 O LEU C 26 7.783 9.166 1.359 1.00 0.00 O ATOM 1112 CB LEU C 26 8.549 11.331 3.752 1.00 0.00 C ATOM 1113 CG LEU C 26 9.466 11.193 4.972 1.00 0.00 C ATOM 1114 CD1 LEU C 26 10.821 11.838 4.672 1.00 0.00 C ATOM 1115 CD2 LEU C 26 8.825 11.889 6.173 1.00 0.00 C ATOM 0 H LEU C 26 10.202 12.555 2.414 1.00 0.00 H new ATOM 0 HA LEU C 26 9.747 9.796 2.817 1.00 0.00 H new ATOM 0 HB2 LEU C 26 8.335 12.383 3.564 1.00 0.00 H new ATOM 0 HB3 LEU C 26 7.595 10.842 3.946 1.00 0.00 H new ATOM 0 HG LEU C 26 9.611 10.136 5.198 1.00 0.00 H new ATOM 0 HD11 LEU C 26 11.472 11.739 5.541 1.00 0.00 H new ATOM 0 HD12 LEU C 26 11.279 11.341 3.817 1.00 0.00 H new ATOM 0 HD13 LEU C 26 10.679 12.894 4.444 1.00 0.00 H new ATOM 0 HD21 LEU C 26 9.477 11.791 7.041 1.00 0.00 H new ATOM 0 HD22 LEU C 26 8.679 12.945 5.946 1.00 0.00 H new ATOM 0 HD23 LEU C 26 7.861 11.428 6.389 1.00 0.00 H new ATOM 1127 N VAL C 27 7.686 11.328 0.739 1.00 0.00 N ATOM 1128 CA VAL C 27 6.672 11.086 -0.283 1.00 0.00 C ATOM 1129 C VAL C 27 7.226 10.182 -1.382 1.00 0.00 C ATOM 1130 O VAL C 27 6.568 9.233 -1.809 1.00 0.00 O ATOM 1131 CB VAL C 27 6.216 12.415 -0.886 1.00 0.00 C ATOM 1132 CG1 VAL C 27 5.254 12.150 -2.048 1.00 0.00 C ATOM 1133 CG2 VAL C 27 5.503 13.240 0.187 1.00 0.00 C ATOM 0 H VAL C 27 7.984 12.300 0.824 1.00 0.00 H new ATOM 0 HA VAL C 27 5.820 10.589 0.181 1.00 0.00 H new ATOM 0 HB VAL C 27 7.084 12.963 -1.253 1.00 0.00 H new ATOM 0 HG11 VAL C 27 4.930 13.099 -2.476 1.00 0.00 H new ATOM 0 HG12 VAL C 27 5.760 11.561 -2.813 1.00 0.00 H new ATOM 0 HG13 VAL C 27 4.385 11.601 -1.683 1.00 0.00 H new ATOM 0 HG21 VAL C 27 5.177 14.188 -0.240 1.00 0.00 H new ATOM 0 HG22 VAL C 27 4.636 12.690 0.553 1.00 0.00 H new ATOM 0 HG23 VAL C 27 6.187 13.431 1.014 1.00 0.00 H new ATOM 1143 N VAL C 28 8.439 10.484 -1.835 1.00 0.00 N ATOM 1144 CA VAL C 28 9.070 9.695 -2.886 1.00 0.00 C ATOM 1145 C VAL C 28 9.327 8.271 -2.399 1.00 0.00 C ATOM 1146 O VAL C 28 9.072 7.304 -3.116 1.00 0.00 O ATOM 1147 CB VAL C 28 10.391 10.343 -3.307 1.00 0.00 C ATOM 1148 CG1 VAL C 28 11.102 9.449 -4.325 1.00 0.00 C ATOM 1149 CG2 VAL C 28 10.105 11.706 -3.940 1.00 0.00 C ATOM 0 H VAL C 28 9.001 11.264 -1.493 1.00 0.00 H new ATOM 0 HA VAL C 28 8.399 9.659 -3.744 1.00 0.00 H new ATOM 0 HB VAL C 28 11.028 10.470 -2.432 1.00 0.00 H new ATOM 0 HG11 VAL C 28 12.042 9.913 -4.623 1.00 0.00 H new ATOM 0 HG12 VAL C 28 11.304 8.476 -3.877 1.00 0.00 H new ATOM 0 HG13 VAL C 28 10.467 9.320 -5.202 1.00 0.00 H new ATOM 0 HG21 VAL C 28 11.043 12.171 -4.241 1.00 0.00 H new ATOM 0 HG22 VAL C 28 9.468 11.575 -4.815 1.00 0.00 H new ATOM 0 HG23 VAL C 28 9.600 12.345 -3.216 1.00 0.00 H new ATOM 1159 N ALA C 29 9.833 8.153 -1.175 1.00 0.00 N ATOM 1160 CA ALA C 29 10.119 6.844 -0.604 1.00 0.00 C ATOM 1161 C ALA C 29 8.844 6.009 -0.530 1.00 0.00 C ATOM 1162 O ALA C 29 8.882 4.785 -0.627 1.00 0.00 O ATOM 1163 CB ALA C 29 10.712 7.002 0.796 1.00 0.00 C ATOM 0 H ALA C 29 10.051 8.941 -0.565 1.00 0.00 H new ATOM 0 HA ALA C 29 10.839 6.335 -1.244 1.00 0.00 H new ATOM 0 HB1 ALA C 29 10.923 6.018 1.215 1.00 0.00 H new ATOM 0 HB2 ALA C 29 11.636 7.577 0.737 1.00 0.00 H new ATOM 0 HB3 ALA C 29 10.000 7.524 1.436 1.00 0.00 H new ATOM 1169 N ALA C 30 7.711 6.673 -0.355 1.00 0.00 N ATOM 1170 CA ALA C 30 6.442 5.965 -0.279 1.00 0.00 C ATOM 1171 C ALA C 30 6.033 5.453 -1.662 1.00 0.00 C ATOM 1172 O ALA C 30 5.518 4.343 -1.798 1.00 0.00 O ATOM 1173 CB ALA C 30 5.355 6.888 0.277 1.00 0.00 C ATOM 0 H ALA C 30 7.644 7.687 -0.264 1.00 0.00 H new ATOM 0 HA ALA C 30 6.561 5.113 0.390 1.00 0.00 H new ATOM 0 HB1 ALA C 30 4.410 6.347 0.329 1.00 0.00 H new ATOM 0 HB2 ALA C 30 5.637 7.222 1.275 1.00 0.00 H new ATOM 0 HB3 ALA C 30 5.242 7.753 -0.377 1.00 0.00 H new ATOM 1179 N ASN C 31 6.258 6.279 -2.685 1.00 0.00 N ATOM 1180 CA ASN C 31 5.899 5.910 -4.054 1.00 0.00 C ATOM 1181 C ASN C 31 6.776 4.779 -4.593 1.00 0.00 C ATOM 1182 O ASN C 31 6.271 3.826 -5.185 1.00 0.00 O ATOM 1183 CB ASN C 31 6.030 7.128 -4.969 1.00 0.00 C ATOM 1184 CG ASN C 31 5.665 6.747 -6.399 1.00 0.00 C ATOM 1185 OD1 ASN C 31 4.753 5.948 -6.614 1.00 0.00 O ATOM 1186 ND2 ASN C 31 6.325 7.270 -7.394 1.00 0.00 N ATOM 0 H ASN C 31 6.684 7.201 -2.592 1.00 0.00 H new ATOM 0 HA ASN C 31 4.868 5.557 -4.037 1.00 0.00 H new ATOM 0 HB2 ASN C 31 5.377 7.928 -4.619 1.00 0.00 H new ATOM 0 HB3 ASN C 31 7.050 7.511 -4.935 1.00 0.00 H new ATOM 0 HD21 ASN C 31 6.086 7.018 -8.353 1.00 0.00 H new ATOM 0 HD22 ASN C 31 7.080 7.932 -7.214 1.00 0.00 H new ATOM 1193 N ILE C 32 8.089 4.891 -4.403 1.00 0.00 N ATOM 1194 CA ILE C 32 9.007 3.872 -4.896 1.00 0.00 C ATOM 1195 C ILE C 32 8.791 2.551 -4.158 1.00 0.00 C ATOM 1196 O ILE C 32 8.763 1.484 -4.773 1.00 0.00 O ATOM 1197 CB ILE C 32 10.447 4.357 -4.702 1.00 0.00 C ATOM 1198 CG1 ILE C 32 11.418 3.450 -5.463 1.00 0.00 C ATOM 1199 CG2 ILE C 32 10.800 4.339 -3.215 1.00 0.00 C ATOM 1200 CD1 ILE C 32 12.807 4.095 -5.472 1.00 0.00 C ATOM 0 H ILE C 32 8.535 5.669 -3.917 1.00 0.00 H new ATOM 0 HA ILE C 32 8.818 3.702 -5.956 1.00 0.00 H new ATOM 0 HB ILE C 32 10.530 5.373 -5.087 1.00 0.00 H new ATOM 0 HG12 ILE C 32 11.463 2.468 -4.992 1.00 0.00 H new ATOM 0 HG13 ILE C 32 11.068 3.298 -6.484 1.00 0.00 H new ATOM 0 HG21 ILE C 32 11.825 4.684 -3.080 1.00 0.00 H new ATOM 0 HG22 ILE C 32 10.121 4.996 -2.672 1.00 0.00 H new ATOM 0 HG23 ILE C 32 10.706 3.323 -2.831 1.00 0.00 H new ATOM 0 HD11 ILE C 32 13.503 3.453 -6.013 1.00 0.00 H new ATOM 0 HD12 ILE C 32 12.754 5.067 -5.963 1.00 0.00 H new ATOM 0 HD13 ILE C 32 13.155 4.225 -4.447 1.00 0.00 H new ATOM 1212 N ILE C 33 8.624 2.630 -2.839 1.00 0.00 N ATOM 1213 CA ILE C 33 8.396 1.435 -2.032 1.00 0.00 C ATOM 1214 C ILE C 33 7.075 0.771 -2.422 1.00 0.00 C ATOM 1215 O ILE C 33 7.002 -0.451 -2.552 1.00 0.00 O ATOM 1216 CB ILE C 33 8.385 1.793 -0.538 1.00 0.00 C ATOM 1217 CG1 ILE C 33 9.800 2.186 -0.091 1.00 0.00 C ATOM 1218 CG2 ILE C 33 7.920 0.587 0.285 1.00 0.00 C ATOM 1219 CD1 ILE C 33 9.754 2.801 1.310 1.00 0.00 C ATOM 0 H ILE C 33 8.642 3.502 -2.311 1.00 0.00 H new ATOM 0 HA ILE C 33 9.209 0.733 -2.219 1.00 0.00 H new ATOM 0 HB ILE C 33 7.702 2.628 -0.381 1.00 0.00 H new ATOM 0 HG12 ILE C 33 10.447 1.309 -0.091 1.00 0.00 H new ATOM 0 HG13 ILE C 33 10.228 2.898 -0.796 1.00 0.00 H new ATOM 0 HG21 ILE C 33 7.915 0.849 1.343 1.00 0.00 H new ATOM 0 HG22 ILE C 33 6.914 0.302 -0.023 1.00 0.00 H new ATOM 0 HG23 ILE C 33 8.600 -0.249 0.121 1.00 0.00 H new ATOM 0 HD11 ILE C 33 10.762 3.077 1.619 1.00 0.00 H new ATOM 0 HD12 ILE C 33 9.122 3.689 1.297 1.00 0.00 H new ATOM 0 HD13 ILE C 33 9.345 2.075 2.013 1.00 0.00 H new ATOM 1231 N GLY C 34 6.034 1.580 -2.599 1.00 0.00 N ATOM 1232 CA GLY C 34 4.725 1.050 -2.964 1.00 0.00 C ATOM 1233 C GLY C 34 4.784 0.322 -4.303 1.00 0.00 C ATOM 1234 O GLY C 34 4.256 -0.782 -4.446 1.00 0.00 O ATOM 0 H GLY C 34 6.070 2.594 -2.497 1.00 0.00 H new ATOM 0 HA2 GLY C 34 4.377 0.367 -2.190 1.00 0.00 H new ATOM 0 HA3 GLY C 34 4.002 1.864 -3.020 1.00 0.00 H new ATOM 1238 N ILE C 35 5.441 0.939 -5.280 1.00 0.00 N ATOM 1239 CA ILE C 35 5.572 0.334 -6.601 1.00 0.00 C ATOM 1240 C ILE C 35 6.383 -0.956 -6.512 1.00 0.00 C ATOM 1241 O ILE C 35 6.040 -1.960 -7.135 1.00 0.00 O ATOM 1242 CB ILE C 35 6.249 1.315 -7.562 1.00 0.00 C ATOM 1243 CG1 ILE C 35 5.316 2.500 -7.815 1.00 0.00 C ATOM 1244 CG2 ILE C 35 6.543 0.611 -8.891 1.00 0.00 C ATOM 1245 CD1 ILE C 35 6.089 3.611 -8.529 1.00 0.00 C ATOM 0 H ILE C 35 5.888 1.851 -5.184 1.00 0.00 H new ATOM 0 HA ILE C 35 4.578 0.097 -6.979 1.00 0.00 H new ATOM 0 HB ILE C 35 7.182 1.668 -7.123 1.00 0.00 H new ATOM 0 HG12 ILE C 35 4.466 2.185 -8.421 1.00 0.00 H new ATOM 0 HG13 ILE C 35 4.915 2.869 -6.871 1.00 0.00 H new ATOM 0 HG21 ILE C 35 7.025 1.310 -9.574 1.00 0.00 H new ATOM 0 HG22 ILE C 35 7.204 -0.238 -8.715 1.00 0.00 H new ATOM 0 HG23 ILE C 35 5.610 0.259 -9.331 1.00 0.00 H new ATOM 0 HD11 ILE C 35 5.426 4.457 -8.710 1.00 0.00 H new ATOM 0 HD12 ILE C 35 6.924 3.932 -7.906 1.00 0.00 H new ATOM 0 HD13 ILE C 35 6.469 3.237 -9.480 1.00 0.00 H new ATOM 1257 N LEU C 36 7.464 -0.917 -5.739 1.00 0.00 N ATOM 1258 CA LEU C 36 8.321 -2.085 -5.582 1.00 0.00 C ATOM 1259 C LEU C 36 7.531 -3.241 -4.979 1.00 0.00 C ATOM 1260 O LEU C 36 7.680 -4.390 -5.393 1.00 0.00 O ATOM 1261 CB LEU C 36 9.515 -1.750 -4.677 1.00 0.00 C ATOM 1262 CG LEU C 36 10.414 -2.987 -4.488 1.00 0.00 C ATOM 1263 CD1 LEU C 36 10.915 -3.498 -5.850 1.00 0.00 C ATOM 1264 CD2 LEU C 36 11.607 -2.602 -3.610 1.00 0.00 C ATOM 0 H LEU C 36 7.765 -0.095 -5.215 1.00 0.00 H new ATOM 0 HA LEU C 36 8.689 -2.378 -6.565 1.00 0.00 H new ATOM 0 HB2 LEU C 36 10.093 -0.936 -5.115 1.00 0.00 H new ATOM 0 HB3 LEU C 36 9.158 -1.402 -3.708 1.00 0.00 H new ATOM 0 HG LEU C 36 9.840 -3.781 -4.010 1.00 0.00 H new ATOM 0 HD11 LEU C 36 11.549 -4.372 -5.700 1.00 0.00 H new ATOM 0 HD12 LEU C 36 10.063 -3.770 -6.472 1.00 0.00 H new ATOM 0 HD13 LEU C 36 11.489 -2.714 -6.344 1.00 0.00 H new ATOM 0 HD21 LEU C 36 12.251 -3.470 -3.469 1.00 0.00 H new ATOM 0 HD22 LEU C 36 12.173 -1.806 -4.094 1.00 0.00 H new ATOM 0 HD23 LEU C 36 11.249 -2.255 -2.641 1.00 0.00 H new ATOM 1276 N HIS C 37 6.689 -2.929 -3.999 1.00 0.00 N ATOM 1277 CA HIS C 37 5.885 -3.957 -3.353 1.00 0.00 C ATOM 1278 C HIS C 37 5.015 -4.668 -4.384 1.00 0.00 C ATOM 1279 O HIS C 37 4.873 -5.890 -4.351 1.00 0.00 O ATOM 1280 CB HIS C 37 4.989 -3.331 -2.286 1.00 0.00 C ATOM 1281 CG HIS C 37 4.212 -4.418 -1.599 1.00 0.00 C ATOM 1282 ND1 HIS C 37 4.350 -4.688 -0.248 1.00 0.00 N ATOM 1283 CD2 HIS C 37 3.294 -5.324 -2.065 1.00 0.00 C ATOM 1284 CE1 HIS C 37 3.538 -5.717 0.043 1.00 0.00 C ATOM 1285 NE2 HIS C 37 2.869 -6.142 -1.028 1.00 0.00 N ATOM 0 H HIS C 37 6.547 -1.985 -3.639 1.00 0.00 H new ATOM 0 HA HIS C 37 6.556 -4.678 -2.886 1.00 0.00 H new ATOM 0 HB2 HIS C 37 5.592 -2.784 -1.561 1.00 0.00 H new ATOM 0 HB3 HIS C 37 4.308 -2.612 -2.741 1.00 0.00 H new ATOM 0 HD2 HIS C 37 2.953 -5.391 -3.087 1.00 0.00 H new ATOM 0 HE1 HIS C 37 3.439 -6.149 1.028 1.00 0.00 H new ATOM 0 HE2 HIS C 37 2.192 -6.903 -1.075 1.00 0.00 H new ATOM 1293 N LEU C 38 4.437 -3.895 -5.298 1.00 0.00 N ATOM 1294 CA LEU C 38 3.578 -4.463 -6.334 1.00 0.00 C ATOM 1295 C LEU C 38 4.346 -5.445 -7.209 1.00 0.00 C ATOM 1296 O LEU C 38 3.811 -6.483 -7.586 1.00 0.00 O ATOM 1297 CB LEU C 38 2.977 -3.335 -7.201 1.00 0.00 C ATOM 1298 CG LEU C 38 1.620 -2.878 -6.626 1.00 0.00 C ATOM 1299 CD1 LEU C 38 1.294 -1.463 -7.103 1.00 0.00 C ATOM 1300 CD2 LEU C 38 0.508 -3.832 -7.096 1.00 0.00 C ATOM 0 H LEU C 38 4.546 -2.882 -5.344 1.00 0.00 H new ATOM 0 HA LEU C 38 2.771 -5.008 -5.844 1.00 0.00 H new ATOM 0 HB2 LEU C 38 3.666 -2.491 -7.239 1.00 0.00 H new ATOM 0 HB3 LEU C 38 2.846 -3.685 -8.225 1.00 0.00 H new ATOM 0 HG LEU C 38 1.682 -2.889 -5.538 1.00 0.00 H new ATOM 0 HD11 LEU C 38 0.334 -1.152 -6.691 1.00 0.00 H new ATOM 0 HD12 LEU C 38 2.072 -0.778 -6.767 1.00 0.00 H new ATOM 0 HD13 LEU C 38 1.243 -1.449 -8.192 1.00 0.00 H new ATOM 0 HD21 LEU C 38 -0.448 -3.505 -6.688 1.00 0.00 H new ATOM 0 HD22 LEU C 38 0.459 -3.825 -8.185 1.00 0.00 H new ATOM 0 HD23 LEU C 38 0.725 -4.842 -6.749 1.00 0.00 H new ATOM 1312 N ILE C 39 5.583 -5.117 -7.537 1.00 0.00 N ATOM 1313 CA ILE C 39 6.378 -5.996 -8.383 1.00 0.00 C ATOM 1314 C ILE C 39 6.591 -7.347 -7.699 1.00 0.00 C ATOM 1315 O ILE C 39 6.459 -8.397 -8.325 1.00 0.00 O ATOM 1316 CB ILE C 39 7.731 -5.341 -8.666 1.00 0.00 C ATOM 1317 CG1 ILE C 39 7.511 -4.094 -9.530 1.00 0.00 C ATOM 1318 CG2 ILE C 39 8.637 -6.328 -9.411 1.00 0.00 C ATOM 1319 CD1 ILE C 39 8.811 -3.289 -9.627 1.00 0.00 C ATOM 0 H ILE C 39 6.055 -4.264 -7.238 1.00 0.00 H new ATOM 0 HA ILE C 39 5.847 -6.161 -9.320 1.00 0.00 H new ATOM 0 HB ILE C 39 8.206 -5.060 -7.726 1.00 0.00 H new ATOM 0 HG12 ILE C 39 7.179 -4.386 -10.526 1.00 0.00 H new ATOM 0 HG13 ILE C 39 6.723 -3.477 -9.099 1.00 0.00 H new ATOM 0 HG21 ILE C 39 9.600 -5.858 -9.611 1.00 0.00 H new ATOM 0 HG22 ILE C 39 8.787 -7.217 -8.799 1.00 0.00 H new ATOM 0 HG23 ILE C 39 8.169 -6.611 -10.354 1.00 0.00 H new ATOM 0 HD11 ILE C 39 8.646 -2.405 -10.243 1.00 0.00 H new ATOM 0 HD12 ILE C 39 9.125 -2.983 -8.629 1.00 0.00 H new ATOM 0 HD13 ILE C 39 9.588 -3.906 -10.079 1.00 0.00 H new ATOM 1331 N LEU C 40 6.924 -7.316 -6.417 1.00 0.00 N ATOM 1332 CA LEU C 40 7.145 -8.551 -5.673 1.00 0.00 C ATOM 1333 C LEU C 40 5.825 -9.272 -5.386 1.00 0.00 C ATOM 1334 O LEU C 40 5.732 -10.491 -5.520 1.00 0.00 O ATOM 1335 CB LEU C 40 7.861 -8.234 -4.363 1.00 0.00 C ATOM 1336 CG LEU C 40 9.104 -7.385 -4.653 1.00 0.00 C ATOM 1337 CD1 LEU C 40 9.784 -7.017 -3.334 1.00 0.00 C ATOM 1338 CD2 LEU C 40 10.086 -8.171 -5.538 1.00 0.00 C ATOM 0 H LEU C 40 7.046 -6.461 -5.874 1.00 0.00 H new ATOM 0 HA LEU C 40 7.762 -9.213 -6.281 1.00 0.00 H new ATOM 0 HB2 LEU C 40 7.191 -7.699 -3.690 1.00 0.00 H new ATOM 0 HB3 LEU C 40 8.147 -9.158 -3.860 1.00 0.00 H new ATOM 0 HG LEU C 40 8.804 -6.478 -5.177 1.00 0.00 H new ATOM 0 HD11 LEU C 40 10.669 -6.413 -3.537 1.00 0.00 H new ATOM 0 HD12 LEU C 40 9.091 -6.449 -2.714 1.00 0.00 H new ATOM 0 HD13 LEU C 40 10.078 -7.926 -2.810 1.00 0.00 H new ATOM 0 HD21 LEU C 40 10.965 -7.559 -5.738 1.00 0.00 H new ATOM 0 HD22 LEU C 40 10.388 -9.084 -5.024 1.00 0.00 H new ATOM 0 HD23 LEU C 40 9.601 -8.428 -6.480 1.00 0.00 H new ATOM 1350 N TRP C 41 4.810 -8.510 -4.979 1.00 0.00 N ATOM 1351 CA TRP C 41 3.504 -9.087 -4.664 1.00 0.00 C ATOM 1352 C TRP C 41 2.817 -9.640 -5.911 1.00 0.00 C ATOM 1353 O TRP C 41 2.297 -10.755 -5.896 1.00 0.00 O ATOM 1354 CB TRP C 41 2.618 -8.023 -4.001 1.00 0.00 C ATOM 1355 CG TRP C 41 1.213 -8.529 -3.872 1.00 0.00 C ATOM 1356 CD1 TRP C 41 0.747 -9.300 -2.865 1.00 0.00 C ATOM 1357 CD2 TRP C 41 0.082 -8.281 -4.753 1.00 0.00 C ATOM 1358 NE1 TRP C 41 -0.594 -9.559 -3.084 1.00 0.00 N ATOM 1359 CE2 TRP C 41 -1.049 -8.949 -4.233 1.00 0.00 C ATOM 1360 CE3 TRP C 41 -0.069 -7.551 -5.945 1.00 0.00 C ATOM 1361 CZ2 TRP C 41 -2.283 -8.893 -4.873 1.00 0.00 C ATOM 1362 CZ3 TRP C 41 -1.316 -7.489 -6.585 1.00 0.00 C ATOM 1363 CH2 TRP C 41 -2.418 -8.160 -6.050 1.00 0.00 C ATOM 0 H TRP C 41 4.866 -7.498 -4.860 1.00 0.00 H new ATOM 0 HA TRP C 41 3.657 -9.919 -3.976 1.00 0.00 H new ATOM 0 HB2 TRP C 41 3.014 -7.771 -3.017 1.00 0.00 H new ATOM 0 HB3 TRP C 41 2.630 -7.108 -4.593 1.00 0.00 H new ATOM 0 HD1 TRP C 41 1.327 -9.656 -2.026 1.00 0.00 H new ATOM 0 HE1 TRP C 41 -1.175 -10.131 -2.471 1.00 0.00 H new ATOM 0 HE3 TRP C 41 0.779 -7.035 -6.370 1.00 0.00 H new ATOM 0 HZ2 TRP C 41 -3.133 -9.416 -4.459 1.00 0.00 H new ATOM 0 HZ3 TRP C 41 -1.424 -6.919 -7.496 1.00 0.00 H new ATOM 0 HH2 TRP C 41 -3.375 -8.111 -6.549 1.00 0.00 H new ATOM 1374 N ILE C 42 2.806 -8.855 -6.979 1.00 0.00 N ATOM 1375 CA ILE C 42 2.161 -9.284 -8.214 1.00 0.00 C ATOM 1376 C ILE C 42 2.881 -10.503 -8.784 1.00 0.00 C ATOM 1377 O ILE C 42 2.253 -11.402 -9.342 1.00 0.00 O ATOM 1378 CB ILE C 42 2.164 -8.139 -9.243 1.00 0.00 C ATOM 1379 CG1 ILE C 42 1.165 -8.446 -10.362 1.00 0.00 C ATOM 1380 CG2 ILE C 42 3.566 -7.971 -9.854 1.00 0.00 C ATOM 1381 CD1 ILE C 42 1.016 -7.210 -11.250 1.00 0.00 C ATOM 0 H ILE C 42 3.231 -7.928 -7.017 1.00 0.00 H new ATOM 0 HA ILE C 42 1.128 -9.554 -7.994 1.00 0.00 H new ATOM 0 HB ILE C 42 1.880 -7.217 -8.736 1.00 0.00 H new ATOM 0 HG12 ILE C 42 1.511 -9.294 -10.953 1.00 0.00 H new ATOM 0 HG13 ILE C 42 0.200 -8.724 -9.939 1.00 0.00 H new ATOM 0 HG21 ILE C 42 3.552 -7.158 -10.580 1.00 0.00 H new ATOM 0 HG22 ILE C 42 4.282 -7.741 -9.065 1.00 0.00 H new ATOM 0 HG23 ILE C 42 3.859 -8.896 -10.351 1.00 0.00 H new ATOM 0 HD11 ILE C 42 0.306 -7.420 -12.050 1.00 0.00 H new ATOM 0 HD12 ILE C 42 0.652 -6.374 -10.652 1.00 0.00 H new ATOM 0 HD13 ILE C 42 1.983 -6.953 -11.682 1.00 0.00 H new ATOM 1393 N LEU C 43 4.202 -10.521 -8.641 1.00 0.00 N ATOM 1394 CA LEU C 43 4.994 -11.631 -9.151 1.00 0.00 C ATOM 1395 C LEU C 43 4.581 -12.930 -8.466 1.00 0.00 C ATOM 1396 O LEU C 43 4.437 -13.964 -9.116 1.00 0.00 O ATOM 1397 CB LEU C 43 6.486 -11.369 -8.905 1.00 0.00 C ATOM 1398 CG LEU C 43 7.334 -12.541 -9.428 1.00 0.00 C ATOM 1399 CD1 LEU C 43 7.080 -12.757 -10.930 1.00 0.00 C ATOM 1400 CD2 LEU C 43 8.815 -12.227 -9.196 1.00 0.00 C ATOM 0 H LEU C 43 4.741 -9.787 -8.181 1.00 0.00 H new ATOM 0 HA LEU C 43 4.818 -11.722 -10.223 1.00 0.00 H new ATOM 0 HB2 LEU C 43 6.786 -10.446 -9.402 1.00 0.00 H new ATOM 0 HB3 LEU C 43 6.666 -11.230 -7.839 1.00 0.00 H new ATOM 0 HG LEU C 43 7.058 -13.451 -8.895 1.00 0.00 H new ATOM 0 HD11 LEU C 43 7.687 -13.590 -11.286 1.00 0.00 H new ATOM 0 HD12 LEU C 43 6.026 -12.981 -11.092 1.00 0.00 H new ATOM 0 HD13 LEU C 43 7.347 -11.853 -11.478 1.00 0.00 H new ATOM 0 HD21 LEU C 43 9.424 -13.053 -9.564 1.00 0.00 H new ATOM 0 HD22 LEU C 43 9.081 -11.314 -9.729 1.00 0.00 H new ATOM 0 HD23 LEU C 43 8.995 -12.090 -8.130 1.00 0.00 H new ATOM 1412 N ASP C 44 4.397 -12.877 -7.155 1.00 0.00 N ATOM 1413 CA ASP C 44 4.005 -14.067 -6.414 1.00 0.00 C ATOM 1414 C ASP C 44 2.612 -14.524 -6.835 1.00 0.00 C ATOM 1415 O ASP C 44 2.370 -15.711 -7.043 1.00 0.00 O ATOM 1416 CB ASP C 44 4.023 -13.782 -4.915 1.00 0.00 C ATOM 1417 CG ASP C 44 3.891 -15.087 -4.138 1.00 0.00 C ATOM 1418 OD1 ASP C 44 3.534 -16.082 -4.748 1.00 0.00 O ATOM 1419 OD2 ASP C 44 4.152 -15.074 -2.948 1.00 0.00 O ATOM 0 H ASP C 44 4.511 -12.036 -6.589 1.00 0.00 H new ATOM 0 HA ASP C 44 4.718 -14.861 -6.636 1.00 0.00 H new ATOM 0 HB2 ASP C 44 4.951 -13.279 -4.643 1.00 0.00 H new ATOM 0 HB3 ASP C 44 3.206 -13.109 -4.654 1.00 0.00 H new ATOM 1424 N ARG C 45 1.695 -13.569 -6.961 1.00 0.00 N ATOM 1425 CA ARG C 45 0.326 -13.882 -7.355 1.00 0.00 C ATOM 1426 C ARG C 45 0.272 -14.325 -8.817 1.00 0.00 C ATOM 1427 O ARG C 45 -0.703 -14.934 -9.257 1.00 0.00 O ATOM 1428 CB ARG C 45 -0.570 -12.656 -7.142 1.00 0.00 C ATOM 1429 CG ARG C 45 -2.027 -13.016 -7.456 1.00 0.00 C ATOM 1430 CD ARG C 45 -2.931 -11.828 -7.121 1.00 0.00 C ATOM 1431 NE ARG C 45 -4.335 -12.205 -7.278 1.00 0.00 N ATOM 1432 CZ ARG C 45 -4.956 -12.094 -8.450 1.00 0.00 C ATOM 1433 NH1 ARG C 45 -4.315 -11.640 -9.491 1.00 0.00 N ATOM 1434 NH2 ARG C 45 -6.209 -12.443 -8.558 1.00 0.00 N ATOM 0 H ARG C 45 1.874 -12.578 -6.797 1.00 0.00 H new ATOM 0 HA ARG C 45 -0.035 -14.702 -6.735 1.00 0.00 H new ATOM 0 HB2 ARG C 45 -0.486 -12.307 -6.113 1.00 0.00 H new ATOM 0 HB3 ARG C 45 -0.242 -11.838 -7.784 1.00 0.00 H new ATOM 0 HG2 ARG C 45 -2.129 -13.278 -8.509 1.00 0.00 H new ATOM 0 HG3 ARG C 45 -2.329 -13.890 -6.879 1.00 0.00 H new ATOM 0 HD2 ARG C 45 -2.747 -11.498 -6.099 1.00 0.00 H new ATOM 0 HD3 ARG C 45 -2.697 -10.987 -7.774 1.00 0.00 H new ATOM 0 HE ARG C 45 -4.849 -12.561 -6.472 1.00 0.00 H new ATOM 0 HH11 ARG C 45 -3.335 -11.369 -9.408 1.00 0.00 H new ATOM 0 HH12 ARG C 45 -4.793 -11.556 -10.388 1.00 0.00 H new ATOM 0 HH21 ARG C 45 -6.711 -12.800 -7.745 1.00 0.00 H new ATOM 0 HH22 ARG C 45 -6.686 -12.359 -9.455 1.00 0.00 H new ATOM 1448 N LEU C 46 1.319 -14.016 -9.571 1.00 0.00 N ATOM 1449 CA LEU C 46 1.356 -14.390 -10.980 1.00 0.00 C ATOM 1450 C LEU C 46 1.317 -15.909 -11.132 1.00 0.00 C ATOM 1451 O LEU C 46 0.609 -16.436 -11.991 1.00 0.00 O ATOM 1452 CB LEU C 46 2.630 -13.844 -11.636 1.00 0.00 C ATOM 1453 CG LEU C 46 2.607 -14.101 -13.149 1.00 0.00 C ATOM 1454 CD1 LEU C 46 1.459 -13.314 -13.811 1.00 0.00 C ATOM 1455 CD2 LEU C 46 3.949 -13.660 -13.740 1.00 0.00 C ATOM 0 H LEU C 46 2.143 -13.515 -9.238 1.00 0.00 H new ATOM 0 HA LEU C 46 0.482 -13.962 -11.472 1.00 0.00 H new ATOM 0 HB2 LEU C 46 2.716 -12.774 -11.444 1.00 0.00 H new ATOM 0 HB3 LEU C 46 3.506 -14.318 -11.194 1.00 0.00 H new ATOM 0 HG LEU C 46 2.446 -15.163 -13.336 1.00 0.00 H new ATOM 0 HD11 LEU C 46 1.457 -13.507 -14.884 1.00 0.00 H new ATOM 0 HD12 LEU C 46 0.507 -13.630 -13.383 1.00 0.00 H new ATOM 0 HD13 LEU C 46 1.600 -12.248 -13.635 1.00 0.00 H new ATOM 0 HD21 LEU C 46 3.948 -13.836 -14.816 1.00 0.00 H new ATOM 0 HD22 LEU C 46 4.100 -12.598 -13.547 1.00 0.00 H new ATOM 0 HD23 LEU C 46 4.755 -14.231 -13.279 1.00 0.00 H new ATOM 1467 N PHE C 47 2.091 -16.611 -10.302 1.00 0.00 N ATOM 1468 CA PHE C 47 2.146 -18.075 -10.359 1.00 0.00 C ATOM 1469 C PHE C 47 1.282 -18.704 -9.269 1.00 0.00 C ATOM 1470 O PHE C 47 1.133 -19.925 -9.213 1.00 0.00 O ATOM 1471 CB PHE C 47 3.596 -18.536 -10.188 1.00 0.00 C ATOM 1472 CG PHE C 47 4.428 -18.006 -11.333 1.00 0.00 C ATOM 1473 CD1 PHE C 47 4.424 -18.668 -12.566 1.00 0.00 C ATOM 1474 CD2 PHE C 47 5.203 -16.852 -11.158 1.00 0.00 C ATOM 1475 CE1 PHE C 47 5.195 -18.173 -13.628 1.00 0.00 C ATOM 1476 CE2 PHE C 47 5.974 -16.359 -12.219 1.00 0.00 C ATOM 1477 CZ PHE C 47 5.969 -17.020 -13.453 1.00 0.00 C ATOM 0 H PHE C 47 2.686 -16.193 -9.586 1.00 0.00 H new ATOM 0 HA PHE C 47 1.761 -18.395 -11.327 1.00 0.00 H new ATOM 0 HB2 PHE C 47 3.994 -18.178 -9.238 1.00 0.00 H new ATOM 0 HB3 PHE C 47 3.643 -19.625 -10.163 1.00 0.00 H new ATOM 0 HD1 PHE C 47 3.828 -19.559 -12.700 1.00 0.00 H new ATOM 0 HD2 PHE C 47 5.206 -16.343 -10.206 1.00 0.00 H new ATOM 0 HE1 PHE C 47 5.191 -18.682 -14.581 1.00 0.00 H new ATOM 0 HE2 PHE C 47 6.572 -15.470 -12.085 1.00 0.00 H new ATOM 0 HZ PHE C 47 6.563 -16.640 -14.271 1.00 0.00 H new ATOM 1487 N PHE C 48 0.711 -17.866 -8.404 1.00 0.00 N ATOM 1488 CA PHE C 48 -0.143 -18.349 -7.313 1.00 0.00 C ATOM 1489 C PHE C 48 -1.439 -17.550 -7.253 1.00 0.00 C ATOM 1490 O PHE C 48 -1.464 -16.362 -7.565 1.00 0.00 O ATOM 1491 CB PHE C 48 0.600 -18.223 -5.982 1.00 0.00 C ATOM 1492 CG PHE C 48 1.730 -19.222 -5.945 1.00 0.00 C ATOM 1493 CD1 PHE C 48 2.975 -18.897 -6.499 1.00 0.00 C ATOM 1494 CD2 PHE C 48 1.532 -20.478 -5.360 1.00 0.00 C ATOM 1495 CE1 PHE C 48 4.021 -19.826 -6.464 1.00 0.00 C ATOM 1496 CE2 PHE C 48 2.578 -21.408 -5.327 1.00 0.00 C ATOM 1497 CZ PHE C 48 3.822 -21.081 -5.881 1.00 0.00 C ATOM 0 H PHE C 48 0.822 -16.853 -8.435 1.00 0.00 H new ATOM 0 HA PHE C 48 -0.386 -19.395 -7.499 1.00 0.00 H new ATOM 0 HB2 PHE C 48 0.989 -17.212 -5.864 1.00 0.00 H new ATOM 0 HB3 PHE C 48 -0.084 -18.400 -5.152 1.00 0.00 H new ATOM 0 HD1 PHE C 48 3.128 -17.929 -6.953 1.00 0.00 H new ATOM 0 HD2 PHE C 48 0.572 -20.730 -4.934 1.00 0.00 H new ATOM 0 HE1 PHE C 48 4.982 -19.573 -6.887 1.00 0.00 H new ATOM 0 HE2 PHE C 48 2.426 -22.377 -4.875 1.00 0.00 H new ATOM 0 HZ PHE C 48 4.628 -21.799 -5.858 1.00 0.00 H new ATOM 1507 N LYS C 49 -2.518 -18.210 -6.848 1.00 0.00 N ATOM 1508 CA LYS C 49 -3.814 -17.547 -6.751 1.00 0.00 C ATOM 1509 C LYS C 49 -4.785 -18.384 -5.926 1.00 0.00 C ATOM 1510 O LYS C 49 -4.396 -19.460 -5.504 1.00 0.00 O ATOM 1511 CB LYS C 49 -4.385 -17.319 -8.153 1.00 0.00 C ATOM 1512 CG LYS C 49 -4.535 -18.665 -8.867 1.00 0.00 C ATOM 1513 CD LYS C 49 -5.042 -18.435 -10.292 1.00 0.00 C ATOM 1514 CE LYS C 49 -5.177 -19.780 -11.008 1.00 0.00 C ATOM 1515 NZ LYS C 49 -5.679 -19.557 -12.394 1.00 0.00 N ATOM 1516 OXT LYS C 49 -5.902 -17.937 -5.727 1.00 0.00 O ATOM 0 H LYS C 49 -2.523 -19.195 -6.583 1.00 0.00 H new ATOM 0 HA LYS C 49 -3.677 -16.586 -6.255 1.00 0.00 H new ATOM 0 HB2 LYS C 49 -5.352 -16.820 -8.087 1.00 0.00 H new ATOM 0 HB3 LYS C 49 -3.727 -16.664 -8.723 1.00 0.00 H new ATOM 0 HG2 LYS C 49 -3.577 -19.185 -8.890 1.00 0.00 H new ATOM 0 HG3 LYS C 49 -5.230 -19.302 -8.321 1.00 0.00 H new ATOM 0 HD2 LYS C 49 -6.005 -17.925 -10.269 1.00 0.00 H new ATOM 0 HD3 LYS C 49 -4.352 -17.789 -10.835 1.00 0.00 H new ATOM 0 HE2 LYS C 49 -4.213 -20.287 -11.036 1.00 0.00 H new ATOM 0 HE3 LYS C 49 -5.862 -20.428 -10.461 1.00 0.00 H new ATOM 0 HZ1 LYS C 49 -5.771 -20.471 -12.881 1.00 0.00 H new ATOM 0 HZ2 LYS C 49 -6.607 -19.090 -12.356 1.00 0.00 H new ATOM 0 HZ3 LYS C 49 -5.009 -18.954 -12.913 1.00 0.00 H new TER 1530 LYS C 49 ATOM 1531 N SER D 19 9.082 24.945 4.560 1.00 0.00 N ATOM 1532 CA SER D 19 9.812 24.744 5.843 1.00 0.00 C ATOM 1533 C SER D 19 9.087 23.700 6.682 1.00 0.00 C ATOM 1534 O SER D 19 9.172 23.709 7.912 1.00 0.00 O ATOM 1535 CB SER D 19 9.879 26.069 6.602 1.00 0.00 C ATOM 1536 OG SER D 19 10.434 27.068 5.757 1.00 0.00 O ATOM 0 HA SER D 19 10.825 24.397 5.638 1.00 0.00 H new ATOM 0 HB2 SER D 19 8.882 26.365 6.928 1.00 0.00 H new ATOM 0 HB3 SER D 19 10.487 25.957 7.499 1.00 0.00 H new ATOM 0 HG SER D 19 10.247 26.845 4.821 1.00 0.00 H new ATOM 1544 N ASN D 20 8.372 22.802 6.010 1.00 0.00 N ATOM 1545 CA ASN D 20 7.632 21.751 6.702 1.00 0.00 C ATOM 1546 C ASN D 20 6.675 22.353 7.725 1.00 0.00 C ATOM 1547 O ASN D 20 6.427 21.768 8.780 1.00 0.00 O ATOM 1548 CB ASN D 20 8.607 20.801 7.404 1.00 0.00 C ATOM 1549 CG ASN D 20 9.372 19.984 6.370 1.00 0.00 C ATOM 1550 OD1 ASN D 20 8.901 19.802 5.247 1.00 0.00 O ATOM 1551 ND2 ASN D 20 10.537 19.485 6.679 1.00 0.00 N ATOM 0 H ASN D 20 8.289 22.780 4.994 1.00 0.00 H new ATOM 0 HA ASN D 20 7.052 21.195 5.965 1.00 0.00 H new ATOM 0 HB2 ASN D 20 9.304 21.371 8.018 1.00 0.00 H new ATOM 0 HB3 ASN D 20 8.062 20.136 8.074 1.00 0.00 H new ATOM 0 HD21 ASN D 20 11.059 18.943 5.990 1.00 0.00 H new ATOM 0 HD22 ASN D 20 10.926 19.636 7.610 1.00 0.00 H new ATOM 1558 N ASP D 21 6.140 23.526 7.405 1.00 0.00 N ATOM 1559 CA ASP D 21 5.207 24.205 8.299 1.00 0.00 C ATOM 1560 C ASP D 21 3.915 23.406 8.430 1.00 0.00 C ATOM 1561 O ASP D 21 3.291 23.386 9.490 1.00 0.00 O ATOM 1562 CB ASP D 21 4.902 25.606 7.770 1.00 0.00 C ATOM 1563 CG ASP D 21 4.372 25.523 6.342 1.00 0.00 C ATOM 1564 OD1 ASP D 21 4.352 24.431 5.800 1.00 0.00 O ATOM 1565 OD2 ASP D 21 3.999 26.557 5.810 1.00 0.00 O ATOM 0 H ASP D 21 6.335 24.025 6.537 1.00 0.00 H new ATOM 0 HA ASP D 21 5.667 24.287 9.284 1.00 0.00 H new ATOM 0 HB2 ASP D 21 4.167 26.093 8.411 1.00 0.00 H new ATOM 0 HB3 ASP D 21 5.804 26.218 7.797 1.00 0.00 H new ATOM 1570 N SER D 22 3.521 22.748 7.345 1.00 0.00 N ATOM 1571 CA SER D 22 2.303 21.948 7.347 1.00 0.00 C ATOM 1572 C SER D 22 2.391 20.846 8.396 1.00 0.00 C ATOM 1573 O SER D 22 1.409 20.543 9.071 1.00 0.00 O ATOM 1574 CB SER D 22 2.088 21.321 5.971 1.00 0.00 C ATOM 1575 OG SER D 22 2.104 22.341 4.981 1.00 0.00 O ATOM 0 H SER D 22 4.024 22.753 6.458 1.00 0.00 H new ATOM 0 HA SER D 22 1.463 22.600 7.586 1.00 0.00 H new ATOM 0 HB2 SER D 22 2.869 20.588 5.767 1.00 0.00 H new ATOM 0 HB3 SER D 22 1.137 20.789 5.946 1.00 0.00 H new ATOM 0 HG SER D 22 1.968 21.941 4.097 1.00 0.00 H new ATOM 1581 N SER D 23 3.568 20.244 8.520 1.00 0.00 N ATOM 1582 CA SER D 23 3.761 19.169 9.485 1.00 0.00 C ATOM 1583 C SER D 23 2.650 18.134 9.344 1.00 0.00 C ATOM 1584 O SER D 23 2.370 17.381 10.276 1.00 0.00 O ATOM 1585 CB SER D 23 3.749 19.731 10.908 1.00 0.00 C ATOM 1586 OG SER D 23 2.482 20.318 11.171 1.00 0.00 O ATOM 0 H SER D 23 4.395 20.479 7.971 1.00 0.00 H new ATOM 0 HA SER D 23 4.724 18.697 9.291 1.00 0.00 H new ATOM 0 HB2 SER D 23 3.951 18.937 11.627 1.00 0.00 H new ATOM 0 HB3 SER D 23 4.538 20.474 11.024 1.00 0.00 H new ATOM 0 HG SER D 23 1.821 19.967 10.538 1.00 0.00 H new ATOM 1592 N ASP D 24 2.018 18.106 8.173 1.00 0.00 N ATOM 1593 CA ASP D 24 0.931 17.163 7.926 1.00 0.00 C ATOM 1594 C ASP D 24 1.308 15.760 8.438 1.00 0.00 C ATOM 1595 O ASP D 24 2.146 15.098 7.826 1.00 0.00 O ATOM 1596 CB ASP D 24 0.632 17.099 6.420 1.00 0.00 C ATOM 1597 CG ASP D 24 1.926 16.965 5.621 1.00 0.00 C ATOM 1598 OD1 ASP D 24 2.984 17.033 6.220 1.00 0.00 O ATOM 1599 OD2 ASP D 24 1.834 16.797 4.414 1.00 0.00 O ATOM 0 H ASP D 24 2.237 18.719 7.388 1.00 0.00 H new ATOM 0 HA ASP D 24 0.044 17.505 8.460 1.00 0.00 H new ATOM 0 HB2 ASP D 24 -0.021 16.252 6.209 1.00 0.00 H new ATOM 0 HB3 ASP D 24 0.099 17.998 6.111 1.00 0.00 H new ATOM 1604 N PRO D 25 0.741 15.293 9.540 1.00 0.00 N ATOM 1605 CA PRO D 25 1.089 13.948 10.090 1.00 0.00 C ATOM 1606 C PRO D 25 0.468 12.809 9.279 1.00 0.00 C ATOM 1607 O PRO D 25 0.886 11.657 9.395 1.00 0.00 O ATOM 1608 CB PRO D 25 0.545 13.986 11.526 1.00 0.00 C ATOM 1609 CG PRO D 25 -0.591 14.962 11.494 1.00 0.00 C ATOM 1610 CD PRO D 25 -0.283 15.967 10.372 1.00 0.00 C ATOM 0 HA PRO D 25 2.161 13.753 10.050 1.00 0.00 H new ATOM 0 HB2 PRO D 25 0.207 13.000 11.845 1.00 0.00 H new ATOM 0 HB3 PRO D 25 1.315 14.302 12.230 1.00 0.00 H new ATOM 0 HG2 PRO D 25 -1.535 14.450 11.306 1.00 0.00 H new ATOM 0 HG3 PRO D 25 -0.690 15.471 12.453 1.00 0.00 H new ATOM 0 HD2 PRO D 25 -1.176 16.199 9.791 1.00 0.00 H new ATOM 0 HD3 PRO D 25 0.090 16.909 10.774 1.00 0.00 H new ATOM 1618 N LEU D 26 -0.529 13.138 8.466 1.00 0.00 N ATOM 1619 CA LEU D 26 -1.199 12.133 7.649 1.00 0.00 C ATOM 1620 C LEU D 26 -0.219 11.507 6.657 1.00 0.00 C ATOM 1621 O LEU D 26 -0.218 10.294 6.453 1.00 0.00 O ATOM 1622 CB LEU D 26 -2.368 12.783 6.892 1.00 0.00 C ATOM 1623 CG LEU D 26 -3.582 12.903 7.817 1.00 0.00 C ATOM 1624 CD1 LEU D 26 -3.201 13.702 9.065 1.00 0.00 C ATOM 1625 CD2 LEU D 26 -4.714 13.624 7.079 1.00 0.00 C ATOM 0 H LEU D 26 -0.889 14.086 8.355 1.00 0.00 H new ATOM 0 HA LEU D 26 -1.580 11.346 8.300 1.00 0.00 H new ATOM 0 HB2 LEU D 26 -2.076 13.769 6.531 1.00 0.00 H new ATOM 0 HB3 LEU D 26 -2.624 12.186 6.017 1.00 0.00 H new ATOM 0 HG LEU D 26 -3.912 11.907 8.112 1.00 0.00 H new ATOM 0 HD11 LEU D 26 -4.067 13.786 9.722 1.00 0.00 H new ATOM 0 HD12 LEU D 26 -2.394 13.192 9.591 1.00 0.00 H new ATOM 0 HD13 LEU D 26 -2.870 14.698 8.772 1.00 0.00 H new ATOM 0 HD21 LEU D 26 -5.579 13.710 7.736 1.00 0.00 H new ATOM 0 HD22 LEU D 26 -4.381 14.619 6.785 1.00 0.00 H new ATOM 0 HD23 LEU D 26 -4.989 13.056 6.190 1.00 0.00 H new ATOM 1637 N VAL D 27 0.616 12.342 6.045 1.00 0.00 N ATOM 1638 CA VAL D 27 1.596 11.852 5.080 1.00 0.00 C ATOM 1639 C VAL D 27 2.604 10.928 5.761 1.00 0.00 C ATOM 1640 O VAL D 27 2.922 9.855 5.249 1.00 0.00 O ATOM 1641 CB VAL D 27 2.326 13.032 4.436 1.00 0.00 C ATOM 1642 CG1 VAL D 27 3.440 12.512 3.524 1.00 0.00 C ATOM 1643 CG2 VAL D 27 1.333 13.852 3.611 1.00 0.00 C ATOM 0 H VAL D 27 0.635 13.350 6.197 1.00 0.00 H new ATOM 0 HA VAL D 27 1.072 11.287 4.309 1.00 0.00 H new ATOM 0 HB VAL D 27 2.761 13.659 5.215 1.00 0.00 H new ATOM 0 HG11 VAL D 27 3.959 13.354 3.066 1.00 0.00 H new ATOM 0 HG12 VAL D 27 4.147 11.926 4.111 1.00 0.00 H new ATOM 0 HG13 VAL D 27 3.009 11.885 2.744 1.00 0.00 H new ATOM 0 HG21 VAL D 27 1.850 14.694 3.151 1.00 0.00 H new ATOM 0 HG22 VAL D 27 0.900 13.223 2.833 1.00 0.00 H new ATOM 0 HG23 VAL D 27 0.541 14.224 4.260 1.00 0.00 H new ATOM 1653 N VAL D 28 3.103 11.356 6.917 1.00 0.00 N ATOM 1654 CA VAL D 28 4.073 10.560 7.660 1.00 0.00 C ATOM 1655 C VAL D 28 3.447 9.249 8.117 1.00 0.00 C ATOM 1656 O VAL D 28 4.056 8.183 8.006 1.00 0.00 O ATOM 1657 CB VAL D 28 4.576 11.347 8.874 1.00 0.00 C ATOM 1658 CG1 VAL D 28 5.506 10.462 9.709 1.00 0.00 C ATOM 1659 CG2 VAL D 28 5.342 12.581 8.394 1.00 0.00 C ATOM 0 H VAL D 28 2.854 12.242 7.356 1.00 0.00 H new ATOM 0 HA VAL D 28 4.914 10.336 7.004 1.00 0.00 H new ATOM 0 HB VAL D 28 3.728 11.657 9.484 1.00 0.00 H new ATOM 0 HG11 VAL D 28 5.863 11.023 10.573 1.00 0.00 H new ATOM 0 HG12 VAL D 28 4.962 9.581 10.049 1.00 0.00 H new ATOM 0 HG13 VAL D 28 6.356 10.152 9.101 1.00 0.00 H new ATOM 0 HG21 VAL D 28 5.702 13.144 9.255 1.00 0.00 H new ATOM 0 HG22 VAL D 28 6.190 12.269 7.785 1.00 0.00 H new ATOM 0 HG23 VAL D 28 4.681 13.211 7.799 1.00 0.00 H new ATOM 1669 N ALA D 29 2.224 9.331 8.632 1.00 0.00 N ATOM 1670 CA ALA D 29 1.523 8.143 9.103 1.00 0.00 C ATOM 1671 C ALA D 29 1.349 7.144 7.962 1.00 0.00 C ATOM 1672 O ALA D 29 1.319 5.937 8.178 1.00 0.00 O ATOM 1673 CB ALA D 29 0.155 8.529 9.663 1.00 0.00 C ATOM 0 H ALA D 29 1.702 10.201 8.733 1.00 0.00 H new ATOM 0 HA ALA D 29 2.115 7.680 9.892 1.00 0.00 H new ATOM 0 HB1 ALA D 29 -0.361 7.635 10.012 1.00 0.00 H new ATOM 0 HB2 ALA D 29 0.285 9.221 10.495 1.00 0.00 H new ATOM 0 HB3 ALA D 29 -0.436 9.007 8.882 1.00 0.00 H new ATOM 1679 N ALA D 30 1.228 7.653 6.744 1.00 0.00 N ATOM 1680 CA ALA D 30 1.067 6.780 5.591 1.00 0.00 C ATOM 1681 C ALA D 30 2.384 6.073 5.266 1.00 0.00 C ATOM 1682 O ALA D 30 2.398 4.891 4.919 1.00 0.00 O ATOM 1683 CB ALA D 30 0.593 7.587 4.382 1.00 0.00 C ATOM 0 H ALA D 30 1.238 8.650 6.530 1.00 0.00 H new ATOM 0 HA ALA D 30 0.317 6.026 5.830 1.00 0.00 H new ATOM 0 HB1 ALA D 30 0.476 6.924 3.525 1.00 0.00 H new ATOM 0 HB2 ALA D 30 -0.364 8.057 4.611 1.00 0.00 H new ATOM 0 HB3 ALA D 30 1.328 8.357 4.147 1.00 0.00 H new ATOM 1689 N ASN D 31 3.487 6.814 5.367 1.00 0.00 N ATOM 1690 CA ASN D 31 4.807 6.257 5.070 1.00 0.00 C ATOM 1691 C ASN D 31 5.240 5.215 6.102 1.00 0.00 C ATOM 1692 O ASN D 31 5.723 4.144 5.743 1.00 0.00 O ATOM 1693 CB ASN D 31 5.844 7.380 5.026 1.00 0.00 C ATOM 1694 CG ASN D 31 7.222 6.804 4.722 1.00 0.00 C ATOM 1695 OD1 ASN D 31 7.342 5.864 3.938 1.00 0.00 O ATOM 1696 ND2 ASN D 31 8.275 7.313 5.300 1.00 0.00 N ATOM 0 H ASN D 31 3.494 7.794 5.650 1.00 0.00 H new ATOM 0 HA ASN D 31 4.740 5.762 4.101 1.00 0.00 H new ATOM 0 HB2 ASN D 31 5.570 8.110 4.265 1.00 0.00 H new ATOM 0 HB3 ASN D 31 5.863 7.906 5.980 1.00 0.00 H new ATOM 0 HD21 ASN D 31 9.200 6.931 5.102 1.00 0.00 H new ATOM 0 HD22 ASN D 31 8.173 8.093 5.950 1.00 0.00 H new ATOM 1703 N ILE D 32 5.079 5.534 7.384 1.00 0.00 N ATOM 1704 CA ILE D 32 5.475 4.613 8.442 1.00 0.00 C ATOM 1705 C ILE D 32 4.603 3.358 8.416 1.00 0.00 C ATOM 1706 O ILE D 32 5.104 2.241 8.545 1.00 0.00 O ATOM 1707 CB ILE D 32 5.350 5.318 9.795 1.00 0.00 C ATOM 1708 CG1 ILE D 32 6.026 4.487 10.889 1.00 0.00 C ATOM 1709 CG2 ILE D 32 3.873 5.504 10.145 1.00 0.00 C ATOM 1710 CD1 ILE D 32 6.120 5.321 12.168 1.00 0.00 C ATOM 0 H ILE D 32 4.681 6.414 7.712 1.00 0.00 H new ATOM 0 HA ILE D 32 6.510 4.309 8.284 1.00 0.00 H new ATOM 0 HB ILE D 32 5.838 6.290 9.729 1.00 0.00 H new ATOM 0 HG12 ILE D 32 5.456 3.577 11.075 1.00 0.00 H new ATOM 0 HG13 ILE D 32 7.021 4.180 10.567 1.00 0.00 H new ATOM 0 HG21 ILE D 32 3.788 6.006 11.109 1.00 0.00 H new ATOM 0 HG22 ILE D 32 3.390 6.108 9.377 1.00 0.00 H new ATOM 0 HG23 ILE D 32 3.386 4.530 10.199 1.00 0.00 H new ATOM 0 HD11 ILE D 32 6.601 4.734 12.951 1.00 0.00 H new ATOM 0 HD12 ILE D 32 6.708 6.218 11.975 1.00 0.00 H new ATOM 0 HD13 ILE D 32 5.119 5.606 12.491 1.00 0.00 H new ATOM 1722 N ILE D 33 3.295 3.549 8.237 1.00 0.00 N ATOM 1723 CA ILE D 33 2.368 2.423 8.183 1.00 0.00 C ATOM 1724 C ILE D 33 2.671 1.539 6.973 1.00 0.00 C ATOM 1725 O ILE D 33 2.674 0.313 7.078 1.00 0.00 O ATOM 1726 CB ILE D 33 0.917 2.929 8.118 1.00 0.00 C ATOM 1727 CG1 ILE D 33 0.533 3.564 9.460 1.00 0.00 C ATOM 1728 CG2 ILE D 33 -0.028 1.760 7.830 1.00 0.00 C ATOM 1729 CD1 ILE D 33 -0.799 4.310 9.323 1.00 0.00 C ATOM 0 H ILE D 33 2.859 4.465 8.128 1.00 0.00 H new ATOM 0 HA ILE D 33 2.493 1.829 9.089 1.00 0.00 H new ATOM 0 HB ILE D 33 0.835 3.669 7.322 1.00 0.00 H new ATOM 0 HG12 ILE D 33 0.451 2.793 10.226 1.00 0.00 H new ATOM 0 HG13 ILE D 33 1.314 4.253 9.783 1.00 0.00 H new ATOM 0 HG21 ILE D 33 -1.054 2.124 7.785 1.00 0.00 H new ATOM 0 HG22 ILE D 33 0.237 1.304 6.876 1.00 0.00 H new ATOM 0 HG23 ILE D 33 0.059 1.018 8.623 1.00 0.00 H new ATOM 0 HD11 ILE D 33 -1.065 4.758 10.280 1.00 0.00 H new ATOM 0 HD12 ILE D 33 -0.702 5.092 8.570 1.00 0.00 H new ATOM 0 HD13 ILE D 33 -1.578 3.610 9.021 1.00 0.00 H new ATOM 1741 N GLY D 34 2.917 2.167 5.827 1.00 0.00 N ATOM 1742 CA GLY D 34 3.207 1.418 4.608 1.00 0.00 C ATOM 1743 C GLY D 34 4.466 0.571 4.776 1.00 0.00 C ATOM 1744 O GLY D 34 4.488 -0.606 4.412 1.00 0.00 O ATOM 0 H GLY D 34 2.922 3.181 5.716 1.00 0.00 H new ATOM 0 HA2 GLY D 34 2.362 0.775 4.361 1.00 0.00 H new ATOM 0 HA3 GLY D 34 3.337 2.108 3.774 1.00 0.00 H new ATOM 1748 N ILE D 35 5.508 1.173 5.338 1.00 0.00 N ATOM 1749 CA ILE D 35 6.761 0.461 5.558 1.00 0.00 C ATOM 1750 C ILE D 35 6.553 -0.684 6.546 1.00 0.00 C ATOM 1751 O ILE D 35 7.067 -1.786 6.353 1.00 0.00 O ATOM 1752 CB ILE D 35 7.828 1.424 6.088 1.00 0.00 C ATOM 1753 CG1 ILE D 35 8.189 2.431 4.994 1.00 0.00 C ATOM 1754 CG2 ILE D 35 9.081 0.638 6.484 1.00 0.00 C ATOM 1755 CD1 ILE D 35 9.021 3.562 5.600 1.00 0.00 C ATOM 0 H ILE D 35 5.511 2.145 5.647 1.00 0.00 H new ATOM 0 HA ILE D 35 7.099 0.047 4.608 1.00 0.00 H new ATOM 0 HB ILE D 35 7.439 1.950 6.960 1.00 0.00 H new ATOM 0 HG12 ILE D 35 8.750 1.937 4.200 1.00 0.00 H new ATOM 0 HG13 ILE D 35 7.283 2.833 4.541 1.00 0.00 H new ATOM 0 HG21 ILE D 35 9.838 1.326 6.861 1.00 0.00 H new ATOM 0 HG22 ILE D 35 8.828 -0.083 7.261 1.00 0.00 H new ATOM 0 HG23 ILE D 35 9.471 0.111 5.613 1.00 0.00 H new ATOM 0 HD11 ILE D 35 9.279 4.281 4.822 1.00 0.00 H new ATOM 0 HD12 ILE D 35 8.444 4.061 6.378 1.00 0.00 H new ATOM 0 HD13 ILE D 35 9.934 3.151 6.032 1.00 0.00 H new ATOM 1767 N LEU D 36 5.802 -0.409 7.609 1.00 0.00 N ATOM 1768 CA LEU D 36 5.537 -1.421 8.624 1.00 0.00 C ATOM 1769 C LEU D 36 4.808 -2.608 8.007 1.00 0.00 C ATOM 1770 O LEU D 36 5.104 -3.762 8.321 1.00 0.00 O ATOM 1771 CB LEU D 36 4.686 -0.827 9.755 1.00 0.00 C ATOM 1772 CG LEU D 36 4.385 -1.894 10.822 1.00 0.00 C ATOM 1773 CD1 LEU D 36 5.694 -2.466 11.396 1.00 0.00 C ATOM 1774 CD2 LEU D 36 3.565 -1.253 11.947 1.00 0.00 C ATOM 0 H LEU D 36 5.370 0.498 7.788 1.00 0.00 H new ATOM 0 HA LEU D 36 6.490 -1.759 9.032 1.00 0.00 H new ATOM 0 HB2 LEU D 36 5.211 0.013 10.210 1.00 0.00 H new ATOM 0 HB3 LEU D 36 3.753 -0.437 9.349 1.00 0.00 H new ATOM 0 HG LEU D 36 3.822 -2.709 10.367 1.00 0.00 H new ATOM 0 HD11 LEU D 36 5.463 -3.219 12.149 1.00 0.00 H new ATOM 0 HD12 LEU D 36 6.275 -2.921 10.594 1.00 0.00 H new ATOM 0 HD13 LEU D 36 6.273 -1.663 11.852 1.00 0.00 H new ATOM 0 HD21 LEU D 36 3.346 -2.001 12.709 1.00 0.00 H new ATOM 0 HD22 LEU D 36 4.134 -0.437 12.392 1.00 0.00 H new ATOM 0 HD23 LEU D 36 2.631 -0.865 11.541 1.00 0.00 H new ATOM 1786 N HIS D 37 3.857 -2.322 7.125 1.00 0.00 N ATOM 1787 CA HIS D 37 3.098 -3.382 6.477 1.00 0.00 C ATOM 1788 C HIS D 37 4.039 -4.315 5.723 1.00 0.00 C ATOM 1789 O HIS D 37 3.877 -5.533 5.757 1.00 0.00 O ATOM 1790 CB HIS D 37 2.094 -2.783 5.494 1.00 0.00 C ATOM 1791 CG HIS D 37 1.286 -3.892 4.883 1.00 0.00 C ATOM 1792 ND1 HIS D 37 -0.083 -3.996 5.055 1.00 0.00 N ATOM 1793 CD2 HIS D 37 1.643 -4.968 4.108 1.00 0.00 C ATOM 1794 CE1 HIS D 37 -0.492 -5.097 4.400 1.00 0.00 C ATOM 1795 NE2 HIS D 37 0.521 -5.724 3.806 1.00 0.00 N ATOM 0 H HIS D 37 3.596 -1.376 6.845 1.00 0.00 H new ATOM 0 HA HIS D 37 2.565 -3.944 7.244 1.00 0.00 H new ATOM 0 HB2 HIS D 37 1.439 -2.079 6.007 1.00 0.00 H new ATOM 0 HB3 HIS D 37 2.616 -2.225 4.717 1.00 0.00 H new ATOM 0 HD2 HIS D 37 2.648 -5.192 3.782 1.00 0.00 H new ATOM 0 HE1 HIS D 37 -1.518 -5.432 4.361 1.00 0.00 H new ATOM 0 HE2 HIS D 37 0.480 -6.577 3.249 1.00 0.00 H new ATOM 1803 N LEU D 38 5.019 -3.733 5.038 1.00 0.00 N ATOM 1804 CA LEU D 38 5.979 -4.522 4.272 1.00 0.00 C ATOM 1805 C LEU D 38 6.759 -5.468 5.177 1.00 0.00 C ATOM 1806 O LEU D 38 7.021 -6.606 4.799 1.00 0.00 O ATOM 1807 CB LEU D 38 6.950 -3.589 3.514 1.00 0.00 C ATOM 1808 CG LEU D 38 6.400 -3.267 2.107 1.00 0.00 C ATOM 1809 CD1 LEU D 38 7.017 -1.970 1.584 1.00 0.00 C ATOM 1810 CD2 LEU D 38 6.747 -4.410 1.137 1.00 0.00 C ATOM 0 H LEU D 38 5.169 -2.725 4.997 1.00 0.00 H new ATOM 0 HA LEU D 38 5.425 -5.123 3.551 1.00 0.00 H new ATOM 0 HB2 LEU D 38 7.091 -2.666 4.076 1.00 0.00 H new ATOM 0 HB3 LEU D 38 7.928 -4.063 3.429 1.00 0.00 H new ATOM 0 HG LEU D 38 5.318 -3.154 2.175 1.00 0.00 H new ATOM 0 HD11 LEU D 38 6.622 -1.753 0.592 1.00 0.00 H new ATOM 0 HD12 LEU D 38 6.770 -1.151 2.260 1.00 0.00 H new ATOM 0 HD13 LEU D 38 8.100 -2.079 1.527 1.00 0.00 H new ATOM 0 HD21 LEU D 38 6.357 -4.178 0.146 1.00 0.00 H new ATOM 0 HD22 LEU D 38 7.830 -4.525 1.083 1.00 0.00 H new ATOM 0 HD23 LEU D 38 6.301 -5.338 1.494 1.00 0.00 H new ATOM 1822 N ILE D 39 7.136 -5.000 6.355 1.00 0.00 N ATOM 1823 CA ILE D 39 7.895 -5.838 7.272 1.00 0.00 C ATOM 1824 C ILE D 39 7.082 -7.066 7.676 1.00 0.00 C ATOM 1825 O ILE D 39 7.595 -8.184 7.699 1.00 0.00 O ATOM 1826 CB ILE D 39 8.263 -5.026 8.516 1.00 0.00 C ATOM 1827 CG1 ILE D 39 9.248 -3.922 8.119 1.00 0.00 C ATOM 1828 CG2 ILE D 39 8.915 -5.945 9.556 1.00 0.00 C ATOM 1829 CD1 ILE D 39 9.446 -2.952 9.289 1.00 0.00 C ATOM 0 H ILE D 39 6.934 -4.060 6.696 1.00 0.00 H new ATOM 0 HA ILE D 39 8.803 -6.175 6.772 1.00 0.00 H new ATOM 0 HB ILE D 39 7.364 -4.582 8.944 1.00 0.00 H new ATOM 0 HG12 ILE D 39 10.204 -4.361 7.834 1.00 0.00 H new ATOM 0 HG13 ILE D 39 8.872 -3.384 7.249 1.00 0.00 H new ATOM 0 HG21 ILE D 39 9.176 -5.365 10.441 1.00 0.00 H new ATOM 0 HG22 ILE D 39 8.216 -6.735 9.833 1.00 0.00 H new ATOM 0 HG23 ILE D 39 9.816 -6.390 9.134 1.00 0.00 H new ATOM 0 HD11 ILE D 39 10.148 -2.170 8.999 1.00 0.00 H new ATOM 0 HD12 ILE D 39 8.490 -2.501 9.554 1.00 0.00 H new ATOM 0 HD13 ILE D 39 9.842 -3.494 10.148 1.00 0.00 H new ATOM 1841 N LEU D 40 5.814 -6.854 7.998 1.00 0.00 N ATOM 1842 CA LEU D 40 4.949 -7.962 8.395 1.00 0.00 C ATOM 1843 C LEU D 40 4.573 -8.832 7.192 1.00 0.00 C ATOM 1844 O LEU D 40 4.581 -10.061 7.277 1.00 0.00 O ATOM 1845 CB LEU D 40 3.690 -7.412 9.057 1.00 0.00 C ATOM 1846 CG LEU D 40 4.081 -6.427 10.164 1.00 0.00 C ATOM 1847 CD1 LEU D 40 2.814 -5.831 10.780 1.00 0.00 C ATOM 1848 CD2 LEU D 40 4.895 -7.150 11.250 1.00 0.00 C ATOM 0 H LEU D 40 5.363 -5.939 7.994 1.00 0.00 H new ATOM 0 HA LEU D 40 5.493 -8.588 9.103 1.00 0.00 H new ATOM 0 HB2 LEU D 40 3.065 -6.913 8.316 1.00 0.00 H new ATOM 0 HB3 LEU D 40 3.100 -8.228 9.474 1.00 0.00 H new ATOM 0 HG LEU D 40 4.691 -5.630 9.738 1.00 0.00 H new ATOM 0 HD11 LEU D 40 3.088 -5.130 11.568 1.00 0.00 H new ATOM 0 HD12 LEU D 40 2.246 -5.308 10.010 1.00 0.00 H new ATOM 0 HD13 LEU D 40 2.204 -6.630 11.201 1.00 0.00 H new ATOM 0 HD21 LEU D 40 5.168 -6.442 12.032 1.00 0.00 H new ATOM 0 HD22 LEU D 40 4.296 -7.952 11.680 1.00 0.00 H new ATOM 0 HD23 LEU D 40 5.799 -7.569 10.808 1.00 0.00 H new ATOM 1860 N TRP D 41 4.233 -8.187 6.077 1.00 0.00 N ATOM 1861 CA TRP D 41 3.843 -8.909 4.868 1.00 0.00 C ATOM 1862 C TRP D 41 5.018 -9.681 4.271 1.00 0.00 C ATOM 1863 O TRP D 41 4.884 -10.853 3.918 1.00 0.00 O ATOM 1864 CB TRP D 41 3.280 -7.922 3.836 1.00 0.00 C ATOM 1865 CG TRP D 41 3.085 -8.611 2.521 1.00 0.00 C ATOM 1866 CD1 TRP D 41 1.998 -9.337 2.172 1.00 0.00 C ATOM 1867 CD2 TRP D 41 3.970 -8.621 1.367 1.00 0.00 C ATOM 1868 NE1 TRP D 41 2.174 -9.812 0.882 1.00 0.00 N ATOM 1869 CE2 TRP D 41 3.373 -9.389 0.345 1.00 0.00 C ATOM 1870 CE3 TRP D 41 5.224 -8.042 1.112 1.00 0.00 C ATOM 1871 CZ2 TRP D 41 3.999 -9.578 -0.883 1.00 0.00 C ATOM 1872 CZ3 TRP D 41 5.852 -8.226 -0.128 1.00 0.00 C ATOM 1873 CH2 TRP D 41 5.241 -8.992 -1.121 1.00 0.00 C ATOM 0 H TRP D 41 4.220 -7.171 5.986 1.00 0.00 H new ATOM 0 HA TRP D 41 3.075 -9.634 5.138 1.00 0.00 H new ATOM 0 HB2 TRP D 41 2.331 -7.517 4.188 1.00 0.00 H new ATOM 0 HB3 TRP D 41 3.961 -7.080 3.717 1.00 0.00 H new ATOM 0 HD1 TRP D 41 1.135 -9.517 2.796 1.00 0.00 H new ATOM 0 HE1 TRP D 41 1.501 -10.401 0.391 1.00 0.00 H new ATOM 0 HE3 TRP D 41 5.708 -7.451 1.876 1.00 0.00 H new ATOM 0 HZ2 TRP D 41 3.525 -10.176 -1.648 1.00 0.00 H new ATOM 0 HZ3 TRP D 41 6.814 -7.772 -0.315 1.00 0.00 H new ATOM 0 HH2 TRP D 41 5.730 -9.131 -2.074 1.00 0.00 H new ATOM 1884 N ILE D 42 6.161 -9.021 4.147 1.00 0.00 N ATOM 1885 CA ILE D 42 7.337 -9.664 3.573 1.00 0.00 C ATOM 1886 C ILE D 42 7.787 -10.817 4.462 1.00 0.00 C ATOM 1887 O ILE D 42 8.243 -11.850 3.972 1.00 0.00 O ATOM 1888 CB ILE D 42 8.478 -8.642 3.414 1.00 0.00 C ATOM 1889 CG1 ILE D 42 9.547 -9.205 2.470 1.00 0.00 C ATOM 1890 CG2 ILE D 42 9.121 -8.338 4.776 1.00 0.00 C ATOM 1891 CD1 ILE D 42 10.555 -8.101 2.149 1.00 0.00 C ATOM 0 H ILE D 42 6.300 -8.052 4.432 1.00 0.00 H new ATOM 0 HA ILE D 42 7.078 -10.056 2.589 1.00 0.00 H new ATOM 0 HB ILE D 42 8.064 -7.722 3.001 1.00 0.00 H new ATOM 0 HG12 ILE D 42 10.051 -10.053 2.934 1.00 0.00 H new ATOM 0 HG13 ILE D 42 9.085 -9.572 1.553 1.00 0.00 H new ATOM 0 HG21 ILE D 42 9.925 -7.614 4.645 1.00 0.00 H new ATOM 0 HG22 ILE D 42 8.369 -7.927 5.450 1.00 0.00 H new ATOM 0 HG23 ILE D 42 9.525 -9.257 5.201 1.00 0.00 H new ATOM 0 HD11 ILE D 42 11.320 -8.491 1.478 1.00 0.00 H new ATOM 0 HD12 ILE D 42 10.042 -7.268 1.669 1.00 0.00 H new ATOM 0 HD13 ILE D 42 11.023 -7.756 3.071 1.00 0.00 H new ATOM 1903 N LEU D 43 7.662 -10.631 5.772 1.00 0.00 N ATOM 1904 CA LEU D 43 8.065 -11.663 6.717 1.00 0.00 C ATOM 1905 C LEU D 43 7.246 -12.931 6.496 1.00 0.00 C ATOM 1906 O LEU D 43 7.784 -14.036 6.503 1.00 0.00 O ATOM 1907 CB LEU D 43 7.868 -11.164 8.156 1.00 0.00 C ATOM 1908 CG LEU D 43 8.278 -12.252 9.164 1.00 0.00 C ATOM 1909 CD1 LEU D 43 9.747 -12.657 8.948 1.00 0.00 C ATOM 1910 CD2 LEU D 43 8.098 -11.704 10.585 1.00 0.00 C ATOM 0 H LEU D 43 7.288 -9.783 6.199 1.00 0.00 H new ATOM 0 HA LEU D 43 9.119 -11.890 6.557 1.00 0.00 H new ATOM 0 HB2 LEU D 43 8.462 -10.265 8.320 1.00 0.00 H new ATOM 0 HB3 LEU D 43 6.825 -10.889 8.312 1.00 0.00 H new ATOM 0 HG LEU D 43 7.651 -13.132 9.020 1.00 0.00 H new ATOM 0 HD11 LEU D 43 10.022 -13.427 9.669 1.00 0.00 H new ATOM 0 HD12 LEU D 43 9.873 -13.044 7.937 1.00 0.00 H new ATOM 0 HD13 LEU D 43 10.388 -11.786 9.085 1.00 0.00 H new ATOM 0 HD21 LEU D 43 8.386 -12.467 11.308 1.00 0.00 H new ATOM 0 HD22 LEU D 43 8.726 -10.823 10.718 1.00 0.00 H new ATOM 0 HD23 LEU D 43 7.054 -11.432 10.741 1.00 0.00 H new ATOM 1922 N ASP D 44 5.943 -12.769 6.304 1.00 0.00 N ATOM 1923 CA ASP D 44 5.080 -13.922 6.087 1.00 0.00 C ATOM 1924 C ASP D 44 5.434 -14.611 4.772 1.00 0.00 C ATOM 1925 O ASP D 44 5.515 -15.836 4.707 1.00 0.00 O ATOM 1926 CB ASP D 44 3.617 -13.483 6.062 1.00 0.00 C ATOM 1927 CG ASP D 44 2.711 -14.706 6.118 1.00 0.00 C ATOM 1928 OD1 ASP D 44 3.210 -15.798 5.906 1.00 0.00 O ATOM 1929 OD2 ASP D 44 1.531 -14.534 6.377 1.00 0.00 O ATOM 0 H ASP D 44 5.467 -11.867 6.294 1.00 0.00 H new ATOM 0 HA ASP D 44 5.230 -14.626 6.905 1.00 0.00 H new ATOM 0 HB2 ASP D 44 3.410 -12.827 6.907 1.00 0.00 H new ATOM 0 HB3 ASP D 44 3.415 -12.910 5.157 1.00 0.00 H new ATOM 1934 N ARG D 45 5.646 -13.817 3.729 1.00 0.00 N ATOM 1935 CA ARG D 45 5.988 -14.364 2.421 1.00 0.00 C ATOM 1936 C ARG D 45 7.396 -14.959 2.433 1.00 0.00 C ATOM 1937 O ARG D 45 7.757 -15.743 1.557 1.00 0.00 O ATOM 1938 CB ARG D 45 5.891 -13.263 1.356 1.00 0.00 C ATOM 1939 CG ARG D 45 6.147 -13.860 -0.033 1.00 0.00 C ATOM 1940 CD ARG D 45 5.924 -12.788 -1.099 1.00 0.00 C ATOM 1941 NE ARG D 45 6.024 -13.377 -2.434 1.00 0.00 N ATOM 1942 CZ ARG D 45 7.193 -13.479 -3.062 1.00 0.00 C ATOM 1943 NH1 ARG D 45 8.284 -13.045 -2.491 1.00 0.00 N ATOM 1944 NH2 ARG D 45 7.250 -14.015 -4.251 1.00 0.00 N ATOM 0 H ARG D 45 5.588 -12.799 3.762 1.00 0.00 H new ATOM 0 HA ARG D 45 5.282 -15.160 2.182 1.00 0.00 H new ATOM 0 HB2 ARG D 45 4.905 -12.800 1.387 1.00 0.00 H new ATOM 0 HB3 ARG D 45 6.618 -12.478 1.564 1.00 0.00 H new ATOM 0 HG2 ARG D 45 7.166 -14.242 -0.094 1.00 0.00 H new ATOM 0 HG3 ARG D 45 5.480 -14.704 -0.206 1.00 0.00 H new ATOM 0 HD2 ARG D 45 4.943 -12.332 -0.967 1.00 0.00 H new ATOM 0 HD3 ARG D 45 6.662 -11.994 -0.987 1.00 0.00 H new ATOM 0 HE ARG D 45 5.179 -13.717 -2.894 1.00 0.00 H new ATOM 0 HH11 ARG D 45 8.242 -12.627 -1.562 1.00 0.00 H new ATOM 0 HH12 ARG D 45 9.179 -13.124 -2.974 1.00 0.00 H new ATOM 0 HH21 ARG D 45 6.399 -14.355 -4.698 1.00 0.00 H new ATOM 0 HH22 ARG D 45 8.146 -14.093 -4.733 1.00 0.00 H new ATOM 1958 N LEU D 46 8.191 -14.582 3.427 1.00 0.00 N ATOM 1959 CA LEU D 46 9.553 -15.090 3.521 1.00 0.00 C ATOM 1960 C LEU D 46 9.551 -16.607 3.701 1.00 0.00 C ATOM 1961 O LEU D 46 10.340 -17.316 3.079 1.00 0.00 O ATOM 1962 CB LEU D 46 10.280 -14.437 4.701 1.00 0.00 C ATOM 1963 CG LEU D 46 11.759 -14.852 4.720 1.00 0.00 C ATOM 1964 CD1 LEU D 46 12.483 -14.310 3.472 1.00 0.00 C ATOM 1965 CD2 LEU D 46 12.410 -14.285 5.986 1.00 0.00 C ATOM 0 H LEU D 46 7.921 -13.936 4.169 1.00 0.00 H new ATOM 0 HA LEU D 46 10.072 -14.845 2.595 1.00 0.00 H new ATOM 0 HB2 LEU D 46 10.202 -13.352 4.628 1.00 0.00 H new ATOM 0 HB3 LEU D 46 9.802 -14.729 5.636 1.00 0.00 H new ATOM 0 HG LEU D 46 11.834 -15.939 4.716 1.00 0.00 H new ATOM 0 HD11 LEU D 46 13.530 -14.612 3.499 1.00 0.00 H new ATOM 0 HD12 LEU D 46 12.012 -14.712 2.575 1.00 0.00 H new ATOM 0 HD13 LEU D 46 12.419 -13.222 3.458 1.00 0.00 H new ATOM 0 HD21 LEU D 46 13.461 -14.571 6.014 1.00 0.00 H new ATOM 0 HD22 LEU D 46 12.330 -13.198 5.981 1.00 0.00 H new ATOM 0 HD23 LEU D 46 11.902 -14.682 6.865 1.00 0.00 H new ATOM 1977 N PHE D 47 8.662 -17.101 4.565 1.00 0.00 N ATOM 1978 CA PHE D 47 8.569 -18.539 4.833 1.00 0.00 C ATOM 1979 C PHE D 47 7.409 -19.170 4.066 1.00 0.00 C ATOM 1980 O PHE D 47 7.226 -20.387 4.094 1.00 0.00 O ATOM 1981 CB PHE D 47 8.369 -18.766 6.332 1.00 0.00 C ATOM 1982 CG PHE D 47 9.573 -18.244 7.083 1.00 0.00 C ATOM 1983 CD1 PHE D 47 10.732 -19.024 7.176 1.00 0.00 C ATOM 1984 CD2 PHE D 47 9.529 -16.979 7.682 1.00 0.00 C ATOM 1985 CE1 PHE D 47 11.847 -18.538 7.869 1.00 0.00 C ATOM 1986 CE2 PHE D 47 10.645 -16.494 8.375 1.00 0.00 C ATOM 1987 CZ PHE D 47 11.804 -17.272 8.468 1.00 0.00 C ATOM 0 H PHE D 47 7.999 -16.530 5.089 1.00 0.00 H new ATOM 0 HA PHE D 47 9.495 -19.009 4.502 1.00 0.00 H new ATOM 0 HB2 PHE D 47 7.466 -18.258 6.671 1.00 0.00 H new ATOM 0 HB3 PHE D 47 8.232 -19.828 6.535 1.00 0.00 H new ATOM 0 HD1 PHE D 47 10.766 -19.999 6.714 1.00 0.00 H new ATOM 0 HD2 PHE D 47 8.635 -16.378 7.610 1.00 0.00 H new ATOM 0 HE1 PHE D 47 12.741 -19.139 7.942 1.00 0.00 H new ATOM 0 HE2 PHE D 47 10.611 -15.519 8.838 1.00 0.00 H new ATOM 0 HZ PHE D 47 12.665 -16.897 9.001 1.00 0.00 H new ATOM 1997 N PHE D 48 6.626 -18.337 3.379 1.00 0.00 N ATOM 1998 CA PHE D 48 5.480 -18.824 2.601 1.00 0.00 C ATOM 1999 C PHE D 48 5.487 -18.218 1.202 1.00 0.00 C ATOM 2000 O PHE D 48 5.918 -17.084 1.008 1.00 0.00 O ATOM 2001 CB PHE D 48 4.180 -18.455 3.315 1.00 0.00 C ATOM 2002 CG PHE D 48 4.054 -19.272 4.579 1.00 0.00 C ATOM 2003 CD1 PHE D 48 4.655 -18.829 5.764 1.00 0.00 C ATOM 2004 CD2 PHE D 48 3.342 -20.476 4.563 1.00 0.00 C ATOM 2005 CE1 PHE D 48 4.542 -19.591 6.933 1.00 0.00 C ATOM 2006 CE2 PHE D 48 3.227 -21.237 5.731 1.00 0.00 C ATOM 2007 CZ PHE D 48 3.826 -20.795 6.917 1.00 0.00 C ATOM 0 H PHE D 48 6.761 -17.327 3.344 1.00 0.00 H new ATOM 0 HA PHE D 48 5.553 -19.908 2.512 1.00 0.00 H new ATOM 0 HB2 PHE D 48 4.172 -17.391 3.554 1.00 0.00 H new ATOM 0 HB3 PHE D 48 3.328 -18.641 2.662 1.00 0.00 H new ATOM 0 HD1 PHE D 48 5.205 -17.900 5.776 1.00 0.00 H new ATOM 0 HD2 PHE D 48 2.881 -20.818 3.648 1.00 0.00 H new ATOM 0 HE1 PHE D 48 5.007 -19.251 7.847 1.00 0.00 H new ATOM 0 HE2 PHE D 48 2.676 -22.166 5.718 1.00 0.00 H new ATOM 0 HZ PHE D 48 3.736 -21.382 7.819 1.00 0.00 H new ATOM 2017 N LYS D 49 5.002 -18.981 0.228 1.00 0.00 N ATOM 2018 CA LYS D 49 4.959 -18.504 -1.149 1.00 0.00 C ATOM 2019 C LYS D 49 4.039 -19.381 -1.990 1.00 0.00 C ATOM 2020 O LYS D 49 3.520 -20.348 -1.454 1.00 0.00 O ATOM 2021 CB LYS D 49 6.369 -18.509 -1.743 1.00 0.00 C ATOM 2022 CG LYS D 49 6.940 -19.927 -1.696 1.00 0.00 C ATOM 2023 CD LYS D 49 8.374 -19.920 -2.229 1.00 0.00 C ATOM 2024 CE LYS D 49 8.945 -21.338 -2.166 1.00 0.00 C ATOM 2025 NZ LYS D 49 10.339 -21.335 -2.693 1.00 0.00 N ATOM 2026 OXT LYS D 49 3.865 -19.074 -3.158 1.00 0.00 O ATOM 0 H LYS D 49 4.636 -19.923 0.364 1.00 0.00 H new ATOM 0 HA LYS D 49 4.569 -17.486 -1.154 1.00 0.00 H new ATOM 0 HB2 LYS D 49 6.342 -18.151 -2.772 1.00 0.00 H new ATOM 0 HB3 LYS D 49 7.012 -17.828 -1.185 1.00 0.00 H new ATOM 0 HG2 LYS D 49 6.923 -20.303 -0.673 1.00 0.00 H new ATOM 0 HG3 LYS D 49 6.323 -20.599 -2.293 1.00 0.00 H new ATOM 0 HD2 LYS D 49 8.391 -19.554 -3.256 1.00 0.00 H new ATOM 0 HD3 LYS D 49 8.990 -19.241 -1.639 1.00 0.00 H new ATOM 0 HE2 LYS D 49 8.934 -21.701 -1.138 1.00 0.00 H new ATOM 0 HE3 LYS D 49 8.325 -22.018 -2.751 1.00 0.00 H new ATOM 0 HZ1 LYS D 49 10.728 -22.298 -2.651 1.00 0.00 H new ATOM 0 HZ2 LYS D 49 10.336 -21.006 -3.679 1.00 0.00 H new ATOM 0 HZ3 LYS D 49 10.926 -20.699 -2.117 1.00 0.00 H new TER 2040 LYS D 49 HETATM 2041 S 3LW C 100 2.040 8.760 -1.612 1.00 0.00 S HETATM 2042 BR 3LW C 100 2.500 11.176 -3.268 1.00 0.00 BR HETATM 2043 C1 3LW C 100 1.922 10.216 -1.735 1.00 0.00 C HETATM 2044 C2 3LW C 100 1.367 10.777 -0.658 1.00 0.00 C HETATM 2045 N2 3LW C 100 0.374 6.456 -0.345 1.00 0.00 N HETATM 2046 C3 3LW C 100 1.085 9.811 0.224 1.00 0.00 C HETATM 2047 C5 3LW C 100 1.292 7.298 0.434 1.00 0.00 C HETATM 2048 C10 3LW C 100 0.391 4.988 -0.135 1.00 0.00 C HETATM 2049 C12 3LW C 100 1.451 8.613 -0.268 1.00 0.00 C HETATM 2050 C61 3LW C 100 -0.637 4.283 -1.063 1.00 0.00 C HETATM 2051 C62 3LW C 100 0.017 4.600 1.327 1.00 0.00 C HETATM 2052 C63 3LW C 100 1.783 4.359 -0.446 1.00 0.00 C HETATM 2053 C71 3LW C 100 -0.637 2.752 -0.857 1.00 0.00 C HETATM 2054 C72 3LW C 100 0.020 3.070 1.524 1.00 0.00 C HETATM 2055 C73 3LW C 100 1.771 2.831 -0.235 1.00 0.00 C HETATM 2056 C81 3LW C 100 -1.004 2.416 0.591 1.00 0.00 C HETATM 2057 C82 3LW C 100 1.414 2.507 1.219 1.00 0.00 C HETATM 2058 C83 3LW C 100 0.746 2.176 -1.165 1.00 0.00 C