USER MOD reduce.3.24.130724 H: found=0, std=0, add=880, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 878 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= -0.183 X(o=-0.18,f=-0.57) USER MOD Single : A 13 HIS : no HD1:sc= -0.324 X(o=-0.32,f=-0.75) USER MOD Single : A 15 ASN : amide:sc= 0.294 K(o=0.29,f=-4.5!) USER MOD Single : A 21 MET CE :methyl 162:sc= -0.0436 (180deg=-0.353) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 ASN : amide:sc= -0.056 X(o=-0.056,f=0) USER MOD Single : A 32 ASN : amide:sc= -0.0392 X(o=-0.039,f=0) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 GLN : amide:sc= 0 K(o=0,f=-0.9) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 MET CE :methyl -122:sc= -0.114 (180deg=-0.851) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot -81:sc= 1.1 USER MOD Single : A 57 CYS SG : rot 180:sc= -0.0581 USER MOD Single : A 62 ASN : amide:sc= 0.0549 K(o=0.055,f=-2.3!) USER MOD Single : A 66 GLN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 71 ASN : amide:sc= -0.664 K(o=-0.66,f=0.032) USER MOD Single : A 78 HIS : no HD1:sc= -2.72! C(o=-2.7!,f=-2.2!) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0.00382 USER MOD Single : A 80 HIS : no HD1:sc= -4.07! K(o=-4.1!,f=-2.4) USER MOD Single : A 82 GLN : amide:sc= -0.0789 K(o=-0.079,f=-1.5!) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 SER OG : rot -32:sc= 0 USER MOD Single : A 91 CYS SG : rot 180:sc= 0 USER MOD Single : A 94 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 99 MET CE :methyl 174:sc= 0 (180deg=-0.0306) USER MOD Single : A 105 ASN : amide:sc= 0 X(o=0,f=-0.049) USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -13.756 19.884 -4.201 1.00 0.00 N ATOM 2 CA GLY A 1 -12.567 19.309 -4.802 1.00 0.00 C ATOM 3 C GLY A 1 -11.904 20.249 -5.790 1.00 0.00 C ATOM 4 O GLY A 1 -11.505 21.357 -5.431 1.00 0.00 O ATOM 0 H1 GLY A 1 -14.172 19.203 -3.534 1.00 0.00 H new ATOM 0 H2 GLY A 1 -13.502 20.755 -3.693 1.00 0.00 H new ATOM 0 H3 GLY A 1 -14.448 20.107 -4.945 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -11.856 19.051 -4.017 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -12.832 18.382 -5.310 1.00 0.00 H new ATOM 8 N SER A 2 -11.785 19.806 -7.037 1.00 0.00 N ATOM 9 CA SER A 2 -11.161 20.613 -8.079 1.00 0.00 C ATOM 10 C SER A 2 -11.354 19.974 -9.451 1.00 0.00 C ATOM 11 O SER A 2 -11.912 18.883 -9.566 1.00 0.00 O ATOM 12 CB SER A 2 -9.668 20.790 -7.791 1.00 0.00 C ATOM 13 OG SER A 2 -9.036 19.538 -7.591 1.00 0.00 O ATOM 0 H SER A 2 -12.113 18.892 -7.351 1.00 0.00 H new ATOM 0 HA SER A 2 -11.642 21.591 -8.083 1.00 0.00 H new ATOM 0 HB2 SER A 2 -9.193 21.312 -8.622 1.00 0.00 H new ATOM 0 HB3 SER A 2 -9.536 21.413 -6.906 1.00 0.00 H new ATOM 0 HG SER A 2 -8.083 19.678 -7.411 1.00 0.00 H new ATOM 19 N SER A 3 -10.888 20.662 -10.488 1.00 0.00 N ATOM 20 CA SER A 3 -11.012 20.164 -11.853 1.00 0.00 C ATOM 21 C SER A 3 -9.649 19.772 -12.414 1.00 0.00 C ATOM 22 O SER A 3 -8.636 20.404 -12.116 1.00 0.00 O ATOM 23 CB SER A 3 -11.658 21.224 -12.748 1.00 0.00 C ATOM 24 OG SER A 3 -13.071 21.183 -12.648 1.00 0.00 O ATOM 0 H SER A 3 -10.421 21.566 -10.409 1.00 0.00 H new ATOM 0 HA SER A 3 -11.647 19.278 -11.834 1.00 0.00 H new ATOM 0 HB2 SER A 3 -11.299 22.213 -12.463 1.00 0.00 H new ATOM 0 HB3 SER A 3 -11.359 21.062 -13.783 1.00 0.00 H new ATOM 0 HG SER A 3 -13.460 21.871 -13.228 1.00 0.00 H new ATOM 30 N GLY A 4 -9.631 18.721 -13.230 1.00 0.00 N ATOM 31 CA GLY A 4 -8.388 18.261 -13.820 1.00 0.00 C ATOM 32 C GLY A 4 -8.609 17.211 -14.891 1.00 0.00 C ATOM 33 O GLY A 4 -9.661 16.574 -14.938 1.00 0.00 O ATOM 0 H GLY A 4 -10.455 18.181 -13.492 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -7.858 19.110 -14.252 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -7.749 17.850 -13.039 1.00 0.00 H new ATOM 37 N SER A 5 -7.615 17.031 -15.754 1.00 0.00 N ATOM 38 CA SER A 5 -7.707 16.054 -16.833 1.00 0.00 C ATOM 39 C SER A 5 -6.328 15.514 -17.197 1.00 0.00 C ATOM 40 O SER A 5 -5.390 16.278 -17.424 1.00 0.00 O ATOM 41 CB SER A 5 -8.362 16.683 -18.065 1.00 0.00 C ATOM 42 OG SER A 5 -8.606 15.711 -19.066 1.00 0.00 O ATOM 0 H SER A 5 -6.737 17.549 -15.727 1.00 0.00 H new ATOM 0 HA SER A 5 -8.323 15.224 -16.486 1.00 0.00 H new ATOM 0 HB2 SER A 5 -9.300 17.158 -17.779 1.00 0.00 H new ATOM 0 HB3 SER A 5 -7.717 17.466 -18.464 1.00 0.00 H new ATOM 0 HG SER A 5 -9.026 16.138 -19.841 1.00 0.00 H new ATOM 48 N SER A 6 -6.212 14.191 -17.251 1.00 0.00 N ATOM 49 CA SER A 6 -4.947 13.547 -17.583 1.00 0.00 C ATOM 50 C SER A 6 -5.071 12.738 -18.871 1.00 0.00 C ATOM 51 O SER A 6 -5.711 11.688 -18.899 1.00 0.00 O ATOM 52 CB SER A 6 -4.497 12.637 -16.438 1.00 0.00 C ATOM 53 OG SER A 6 -4.058 13.398 -15.326 1.00 0.00 O ATOM 0 H SER A 6 -6.979 13.544 -17.069 1.00 0.00 H new ATOM 0 HA SER A 6 -4.200 14.326 -17.734 1.00 0.00 H new ATOM 0 HB2 SER A 6 -5.321 11.990 -16.138 1.00 0.00 H new ATOM 0 HB3 SER A 6 -3.691 11.988 -16.780 1.00 0.00 H new ATOM 0 HG SER A 6 -3.777 12.794 -14.607 1.00 0.00 H new ATOM 59 N GLY A 7 -4.452 13.237 -19.937 1.00 0.00 N ATOM 60 CA GLY A 7 -4.504 12.549 -21.214 1.00 0.00 C ATOM 61 C GLY A 7 -3.469 11.448 -21.322 1.00 0.00 C ATOM 62 O GLY A 7 -2.520 11.553 -22.097 1.00 0.00 O ATOM 0 H GLY A 7 -3.916 14.105 -19.939 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -5.498 12.124 -21.354 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -4.349 13.269 -22.018 1.00 0.00 H new ATOM 66 N ASN A 8 -3.652 10.387 -20.542 1.00 0.00 N ATOM 67 CA ASN A 8 -2.724 9.262 -20.552 1.00 0.00 C ATOM 68 C ASN A 8 -3.428 7.981 -20.990 1.00 0.00 C ATOM 69 O ASN A 8 -4.653 7.884 -20.937 1.00 0.00 O ATOM 70 CB ASN A 8 -2.108 9.070 -19.164 1.00 0.00 C ATOM 71 CG ASN A 8 -3.107 8.536 -18.157 1.00 0.00 C ATOM 72 OD1 ASN A 8 -3.827 9.300 -17.514 1.00 0.00 O ATOM 73 ND2 ASN A 8 -3.155 7.216 -18.014 1.00 0.00 N ATOM 0 H ASN A 8 -4.434 10.283 -19.896 1.00 0.00 H new ATOM 0 HA ASN A 8 -1.931 9.483 -21.267 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -1.265 8.382 -19.235 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -1.713 10.022 -18.810 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -3.807 6.798 -17.350 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -2.540 6.620 -18.568 1.00 0.00 H new ATOM 80 N GLY A 9 -2.643 6.999 -21.422 1.00 0.00 N ATOM 81 CA GLY A 9 -3.208 5.737 -21.862 1.00 0.00 C ATOM 82 C GLY A 9 -2.991 4.623 -20.858 1.00 0.00 C ATOM 83 O GLY A 9 -3.579 4.628 -19.778 1.00 0.00 O ATOM 0 H GLY A 9 -1.626 7.055 -21.475 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -4.277 5.862 -22.036 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -2.761 5.455 -22.815 1.00 0.00 H new ATOM 87 N GLY A 10 -2.143 3.662 -21.215 1.00 0.00 N ATOM 88 CA GLY A 10 -1.867 2.549 -20.326 1.00 0.00 C ATOM 89 C GLY A 10 -1.017 1.479 -20.984 1.00 0.00 C ATOM 90 O GLY A 10 -1.418 0.889 -21.987 1.00 0.00 O ATOM 0 H GLY A 10 -1.643 3.635 -22.104 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -1.358 2.917 -19.435 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -2.808 2.109 -19.996 1.00 0.00 H new ATOM 94 N ILE A 11 0.159 1.231 -20.419 1.00 0.00 N ATOM 95 CA ILE A 11 1.067 0.226 -20.958 1.00 0.00 C ATOM 96 C ILE A 11 0.313 -1.036 -21.362 1.00 0.00 C ATOM 97 O ILE A 11 -0.726 -1.377 -20.796 1.00 0.00 O ATOM 98 CB ILE A 11 2.162 -0.147 -19.940 1.00 0.00 C ATOM 99 CG1 ILE A 11 1.562 -0.952 -18.785 1.00 0.00 C ATOM 100 CG2 ILE A 11 2.850 1.106 -19.419 1.00 0.00 C ATOM 101 CD1 ILE A 11 0.348 -0.300 -18.161 1.00 0.00 C ATOM 0 H ILE A 11 0.506 1.712 -19.589 1.00 0.00 H new ATOM 0 HA ILE A 11 1.535 0.664 -21.839 1.00 0.00 H new ATOM 0 HB ILE A 11 2.907 -0.765 -20.440 1.00 0.00 H new ATOM 0 HG12 ILE A 11 1.287 -1.942 -19.148 1.00 0.00 H new ATOM 0 HG13 ILE A 11 2.323 -1.094 -18.018 1.00 0.00 H new ATOM 0 HG21 ILE A 11 3.621 0.826 -18.701 1.00 0.00 H new ATOM 0 HG22 ILE A 11 3.306 1.643 -20.251 1.00 0.00 H new ATOM 0 HG23 ILE A 11 2.116 1.748 -18.932 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -0.024 -0.926 -17.350 1.00 0.00 H new ATOM 0 HD12 ILE A 11 0.622 0.679 -17.768 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -0.430 -0.183 -18.915 1.00 0.00 H new ATOM 113 N PRO A 12 0.848 -1.750 -22.364 1.00 0.00 N ATOM 114 CA PRO A 12 0.243 -2.988 -22.865 1.00 0.00 C ATOM 115 C PRO A 12 0.350 -4.132 -21.863 1.00 0.00 C ATOM 116 O PRO A 12 0.980 -3.995 -20.814 1.00 0.00 O ATOM 117 CB PRO A 12 1.061 -3.299 -24.121 1.00 0.00 C ATOM 118 CG PRO A 12 2.377 -2.640 -23.889 1.00 0.00 C ATOM 119 CD PRO A 12 2.085 -1.404 -23.084 1.00 0.00 C ATOM 0 HA PRO A 12 -0.825 -2.873 -23.052 1.00 0.00 H new ATOM 0 HB2 PRO A 12 1.176 -4.374 -24.263 1.00 0.00 H new ATOM 0 HB3 PRO A 12 0.576 -2.910 -25.016 1.00 0.00 H new ATOM 0 HG2 PRO A 12 3.056 -3.303 -23.353 1.00 0.00 H new ATOM 0 HG3 PRO A 12 2.858 -2.386 -24.834 1.00 0.00 H new ATOM 0 HD2 PRO A 12 2.898 -1.171 -22.397 1.00 0.00 H new ATOM 0 HD3 PRO A 12 1.947 -0.532 -23.723 1.00 0.00 H new ATOM 127 N HIS A 13 -0.271 -5.261 -22.192 1.00 0.00 N ATOM 128 CA HIS A 13 -0.245 -6.430 -21.320 1.00 0.00 C ATOM 129 C HIS A 13 1.167 -6.690 -20.803 1.00 0.00 C ATOM 130 O HIS A 13 2.087 -6.941 -21.581 1.00 0.00 O ATOM 131 CB HIS A 13 -0.762 -7.660 -22.066 1.00 0.00 C ATOM 132 CG HIS A 13 0.046 -8.009 -23.278 1.00 0.00 C ATOM 133 ND1 HIS A 13 1.027 -8.978 -23.275 1.00 0.00 N ATOM 134 CD2 HIS A 13 0.013 -7.514 -24.537 1.00 0.00 C ATOM 135 CE1 HIS A 13 1.564 -9.063 -24.479 1.00 0.00 C ATOM 136 NE2 HIS A 13 0.965 -8.185 -25.264 1.00 0.00 N ATOM 0 H HIS A 13 -0.798 -5.391 -23.056 1.00 0.00 H new ATOM 0 HA HIS A 13 -0.895 -6.232 -20.467 1.00 0.00 H new ATOM 0 HB2 HIS A 13 -0.768 -8.512 -21.386 1.00 0.00 H new ATOM 0 HB3 HIS A 13 -1.795 -7.485 -22.366 1.00 0.00 H new ATOM 0 HD2 HIS A 13 -0.641 -6.736 -24.902 1.00 0.00 H new ATOM 0 HE1 HIS A 13 2.357 -9.735 -24.772 1.00 0.00 H new ATOM 0 HE2 HIS A 13 1.176 -8.031 -26.250 1.00 0.00 H new ATOM 145 N ASP A 14 1.330 -6.628 -19.486 1.00 0.00 N ATOM 146 CA ASP A 14 2.629 -6.857 -18.864 1.00 0.00 C ATOM 147 C ASP A 14 2.648 -8.189 -18.120 1.00 0.00 C ATOM 148 O ASP A 14 1.655 -8.584 -17.510 1.00 0.00 O ATOM 149 CB ASP A 14 2.966 -5.716 -17.903 1.00 0.00 C ATOM 150 CG ASP A 14 4.424 -5.722 -17.487 1.00 0.00 C ATOM 151 OD1 ASP A 14 4.766 -6.452 -16.533 1.00 0.00 O ATOM 152 OD2 ASP A 14 5.223 -4.998 -18.116 1.00 0.00 O ATOM 0 H ASP A 14 0.578 -6.421 -18.828 1.00 0.00 H new ATOM 0 HA ASP A 14 3.381 -6.891 -19.652 1.00 0.00 H new ATOM 0 HB2 ASP A 14 2.730 -4.763 -18.378 1.00 0.00 H new ATOM 0 HB3 ASP A 14 2.338 -5.794 -17.016 1.00 0.00 H new ATOM 157 N ASN A 15 3.784 -8.876 -18.177 1.00 0.00 N ATOM 158 CA ASN A 15 3.932 -10.164 -17.510 1.00 0.00 C ATOM 159 C ASN A 15 3.495 -10.075 -16.051 1.00 0.00 C ATOM 160 O ASN A 15 2.698 -10.887 -15.578 1.00 0.00 O ATOM 161 CB ASN A 15 5.383 -10.641 -17.590 1.00 0.00 C ATOM 162 CG ASN A 15 5.908 -10.658 -19.013 1.00 0.00 C ATOM 163 OD1 ASN A 15 5.842 -9.655 -19.723 1.00 0.00 O ATOM 164 ND2 ASN A 15 6.432 -11.802 -19.436 1.00 0.00 N ATOM 0 H ASN A 15 4.615 -8.562 -18.678 1.00 0.00 H new ATOM 0 HA ASN A 15 3.291 -10.883 -18.020 1.00 0.00 H new ATOM 0 HB2 ASN A 15 6.011 -9.990 -16.982 1.00 0.00 H new ATOM 0 HB3 ASN A 15 5.457 -11.642 -17.166 1.00 0.00 H new ATOM 0 HD21 ASN A 15 6.801 -11.874 -20.384 1.00 0.00 H new ATOM 0 HD22 ASN A 15 6.466 -12.609 -18.813 1.00 0.00 H new ATOM 171 N LEU A 16 4.020 -9.082 -15.341 1.00 0.00 N ATOM 172 CA LEU A 16 3.684 -8.884 -13.936 1.00 0.00 C ATOM 173 C LEU A 16 2.182 -8.694 -13.756 1.00 0.00 C ATOM 174 O LEU A 16 1.483 -8.280 -14.681 1.00 0.00 O ATOM 175 CB LEU A 16 4.434 -7.673 -13.377 1.00 0.00 C ATOM 176 CG LEU A 16 5.829 -7.948 -12.816 1.00 0.00 C ATOM 177 CD1 LEU A 16 6.827 -8.158 -13.945 1.00 0.00 C ATOM 178 CD2 LEU A 16 6.275 -6.807 -11.914 1.00 0.00 C ATOM 0 H LEU A 16 4.681 -8.401 -15.716 1.00 0.00 H new ATOM 0 HA LEU A 16 3.986 -9.776 -13.387 1.00 0.00 H new ATOM 0 HB2 LEU A 16 4.523 -6.929 -14.168 1.00 0.00 H new ATOM 0 HB3 LEU A 16 3.828 -7.228 -12.588 1.00 0.00 H new ATOM 0 HG LEU A 16 5.787 -8.860 -12.221 1.00 0.00 H new ATOM 0 HD11 LEU A 16 7.814 -8.352 -13.526 1.00 0.00 H new ATOM 0 HD12 LEU A 16 6.516 -9.008 -14.552 1.00 0.00 H new ATOM 0 HD13 LEU A 16 6.866 -7.264 -14.567 1.00 0.00 H new ATOM 0 HD21 LEU A 16 7.270 -7.020 -11.523 1.00 0.00 H new ATOM 0 HD22 LEU A 16 6.300 -5.880 -12.486 1.00 0.00 H new ATOM 0 HD23 LEU A 16 5.575 -6.703 -11.085 1.00 0.00 H new ATOM 190 N VAL A 17 1.691 -8.998 -12.559 1.00 0.00 N ATOM 191 CA VAL A 17 0.271 -8.857 -12.257 1.00 0.00 C ATOM 192 C VAL A 17 -0.072 -7.418 -11.889 1.00 0.00 C ATOM 193 O VAL A 17 0.622 -6.786 -11.092 1.00 0.00 O ATOM 194 CB VAL A 17 -0.151 -9.785 -11.102 1.00 0.00 C ATOM 195 CG1 VAL A 17 -1.653 -9.702 -10.872 1.00 0.00 C ATOM 196 CG2 VAL A 17 0.275 -11.217 -11.387 1.00 0.00 C ATOM 0 H VAL A 17 2.255 -9.343 -11.783 1.00 0.00 H new ATOM 0 HA VAL A 17 -0.274 -9.138 -13.158 1.00 0.00 H new ATOM 0 HB VAL A 17 0.350 -9.455 -10.192 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -1.933 -10.364 -10.053 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -1.926 -8.677 -10.620 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -2.177 -10.005 -11.778 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -0.031 -11.859 -10.561 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -0.197 -11.561 -12.308 1.00 0.00 H new ATOM 0 HG23 VAL A 17 1.359 -11.259 -11.497 1.00 0.00 H new ATOM 206 N LEU A 18 -1.149 -6.905 -12.475 1.00 0.00 N ATOM 207 CA LEU A 18 -1.586 -5.538 -12.209 1.00 0.00 C ATOM 208 C LEU A 18 -2.895 -5.529 -11.425 1.00 0.00 C ATOM 209 O LEU A 18 -3.782 -6.347 -11.669 1.00 0.00 O ATOM 210 CB LEU A 18 -1.760 -4.773 -13.522 1.00 0.00 C ATOM 211 CG LEU A 18 -2.445 -3.410 -13.419 1.00 0.00 C ATOM 212 CD1 LEU A 18 -1.434 -2.329 -13.072 1.00 0.00 C ATOM 213 CD2 LEU A 18 -3.163 -3.074 -14.718 1.00 0.00 C ATOM 0 H LEU A 18 -1.735 -7.414 -13.137 1.00 0.00 H new ATOM 0 HA LEU A 18 -0.820 -5.047 -11.609 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -0.776 -4.630 -13.969 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -2.335 -5.395 -14.208 1.00 0.00 H new ATOM 0 HG LEU A 18 -3.185 -3.457 -12.620 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -1.940 -1.366 -13.003 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -0.966 -2.562 -12.116 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -0.670 -2.283 -13.848 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -3.645 -2.101 -14.626 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -2.442 -3.047 -15.535 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -3.917 -3.834 -14.924 1.00 0.00 H new ATOM 225 N ILE A 19 -3.008 -4.597 -10.485 1.00 0.00 N ATOM 226 CA ILE A 19 -4.209 -4.478 -9.668 1.00 0.00 C ATOM 227 C ILE A 19 -4.966 -3.193 -9.985 1.00 0.00 C ATOM 228 O ILE A 19 -4.369 -2.123 -10.103 1.00 0.00 O ATOM 229 CB ILE A 19 -3.873 -4.505 -8.165 1.00 0.00 C ATOM 230 CG1 ILE A 19 -3.116 -5.788 -7.812 1.00 0.00 C ATOM 231 CG2 ILE A 19 -5.143 -4.389 -7.336 1.00 0.00 C ATOM 232 CD1 ILE A 19 -3.948 -7.042 -7.966 1.00 0.00 C ATOM 0 H ILE A 19 -2.282 -3.913 -10.270 1.00 0.00 H new ATOM 0 HA ILE A 19 -4.838 -5.335 -9.907 1.00 0.00 H new ATOM 0 HB ILE A 19 -3.233 -3.653 -7.936 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -2.234 -5.866 -8.448 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -2.762 -5.720 -6.783 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -4.889 -4.410 -6.276 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -5.646 -3.451 -7.570 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -5.805 -5.223 -7.567 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -3.348 -7.912 -7.699 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -4.817 -6.985 -7.310 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -4.280 -7.134 -9.000 1.00 0.00 H new ATOM 244 N ARG A 20 -6.283 -3.306 -10.120 1.00 0.00 N ATOM 245 CA ARG A 20 -7.122 -2.152 -10.422 1.00 0.00 C ATOM 246 C ARG A 20 -8.367 -2.139 -9.541 1.00 0.00 C ATOM 247 O ARG A 20 -9.125 -3.109 -9.506 1.00 0.00 O ATOM 248 CB ARG A 20 -7.527 -2.163 -11.897 1.00 0.00 C ATOM 249 CG ARG A 20 -6.424 -1.702 -12.836 1.00 0.00 C ATOM 250 CD ARG A 20 -6.874 -1.745 -14.288 1.00 0.00 C ATOM 251 NE ARG A 20 -6.793 -3.092 -14.846 1.00 0.00 N ATOM 252 CZ ARG A 20 -7.508 -3.499 -15.889 1.00 0.00 C ATOM 253 NH1 ARG A 20 -8.352 -2.667 -16.484 1.00 0.00 N ATOM 254 NH2 ARG A 20 -7.379 -4.741 -16.339 1.00 0.00 N ATOM 0 H ARG A 20 -6.792 -4.185 -10.025 1.00 0.00 H new ATOM 0 HA ARG A 20 -6.545 -1.250 -10.217 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -7.830 -3.173 -12.174 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -8.398 -1.521 -12.031 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -6.125 -0.686 -12.577 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -5.546 -2.336 -12.707 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -7.900 -1.384 -14.361 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -6.256 -1.070 -14.879 1.00 0.00 H new ATOM 0 HE ARG A 20 -6.153 -3.756 -14.411 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -8.453 -1.712 -16.141 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -8.900 -2.982 -17.285 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -6.731 -5.384 -15.884 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -7.928 -5.053 -17.140 1.00 0.00 H new ATOM 268 N MET A 21 -8.572 -1.035 -8.831 1.00 0.00 N ATOM 269 CA MET A 21 -9.726 -0.896 -7.950 1.00 0.00 C ATOM 270 C MET A 21 -10.164 0.562 -7.853 1.00 0.00 C ATOM 271 O MET A 21 -9.460 1.464 -8.309 1.00 0.00 O ATOM 272 CB MET A 21 -9.399 -1.436 -6.557 1.00 0.00 C ATOM 273 CG MET A 21 -8.236 -0.723 -5.886 1.00 0.00 C ATOM 274 SD MET A 21 -7.818 -1.433 -4.282 1.00 0.00 S ATOM 275 CE MET A 21 -6.350 -2.370 -4.698 1.00 0.00 C ATOM 0 H MET A 21 -7.954 -0.223 -8.848 1.00 0.00 H new ATOM 0 HA MET A 21 -10.546 -1.476 -8.373 1.00 0.00 H new ATOM 0 HB2 MET A 21 -10.283 -1.347 -5.925 1.00 0.00 H new ATOM 0 HB3 MET A 21 -9.168 -2.498 -6.633 1.00 0.00 H new ATOM 0 HG2 MET A 21 -7.363 -0.768 -6.537 1.00 0.00 H new ATOM 0 HG3 MET A 21 -8.485 0.330 -5.759 1.00 0.00 H new ATOM 0 HE1 MET A 21 -5.795 -2.600 -3.788 1.00 0.00 H new ATOM 0 HE2 MET A 21 -6.638 -3.298 -5.192 1.00 0.00 H new ATOM 0 HE3 MET A 21 -5.721 -1.783 -5.367 1.00 0.00 H new ATOM 285 N LYS A 22 -11.330 0.786 -7.257 1.00 0.00 N ATOM 286 CA LYS A 22 -11.862 2.135 -7.099 1.00 0.00 C ATOM 287 C LYS A 22 -12.220 2.411 -5.643 1.00 0.00 C ATOM 288 O LYS A 22 -12.569 1.508 -4.882 1.00 0.00 O ATOM 289 CB LYS A 22 -13.096 2.325 -7.984 1.00 0.00 C ATOM 290 CG LYS A 22 -14.284 1.478 -7.562 1.00 0.00 C ATOM 291 CD LYS A 22 -15.599 2.125 -7.962 1.00 0.00 C ATOM 292 CE LYS A 22 -16.780 1.208 -7.677 1.00 0.00 C ATOM 293 NZ LYS A 22 -17.906 1.445 -8.622 1.00 0.00 N ATOM 0 H LYS A 22 -11.925 0.051 -6.875 1.00 0.00 H new ATOM 0 HA LYS A 22 -11.091 2.842 -7.405 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -13.386 3.376 -7.968 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -12.835 2.082 -9.014 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -14.209 0.491 -8.019 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -14.263 1.332 -6.482 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -15.725 3.062 -7.419 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -15.576 2.372 -9.023 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -16.459 0.169 -7.748 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -17.124 1.366 -6.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -18.691 0.801 -8.395 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -18.230 2.430 -8.536 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -17.585 1.270 -9.596 1.00 0.00 H new ATOM 307 N PRO A 23 -12.135 3.689 -5.244 1.00 0.00 N ATOM 308 CA PRO A 23 -12.448 4.113 -3.876 1.00 0.00 C ATOM 309 C PRO A 23 -13.938 4.013 -3.565 1.00 0.00 C ATOM 310 O PRO A 23 -14.778 4.408 -4.374 1.00 0.00 O ATOM 311 CB PRO A 23 -11.993 5.574 -3.845 1.00 0.00 C ATOM 312 CG PRO A 23 -12.063 6.023 -5.264 1.00 0.00 C ATOM 313 CD PRO A 23 -11.726 4.817 -6.097 1.00 0.00 C ATOM 0 HA PRO A 23 -11.959 3.484 -3.132 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -12.639 6.176 -3.207 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -10.981 5.665 -3.450 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -13.057 6.399 -5.506 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -11.361 6.835 -5.451 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -12.264 4.820 -7.045 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -10.663 4.777 -6.334 1.00 0.00 H new ATOM 321 N ASP A 24 -14.258 3.484 -2.389 1.00 0.00 N ATOM 322 CA ASP A 24 -15.646 3.334 -1.971 1.00 0.00 C ATOM 323 C ASP A 24 -16.279 4.693 -1.688 1.00 0.00 C ATOM 324 O ASP A 24 -15.614 5.725 -1.766 1.00 0.00 O ATOM 325 CB ASP A 24 -15.734 2.448 -0.727 1.00 0.00 C ATOM 326 CG ASP A 24 -14.965 1.151 -0.885 1.00 0.00 C ATOM 327 OD1 ASP A 24 -15.318 0.357 -1.783 1.00 0.00 O ATOM 328 OD2 ASP A 24 -14.010 0.929 -0.112 1.00 0.00 O ATOM 0 H ASP A 24 -13.574 3.152 -1.709 1.00 0.00 H new ATOM 0 HA ASP A 24 -16.195 2.860 -2.785 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -15.347 2.994 0.133 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -16.780 2.224 -0.517 1.00 0.00 H new ATOM 333 N GLU A 25 -17.567 4.684 -1.361 1.00 0.00 N ATOM 334 CA GLU A 25 -18.289 5.917 -1.069 1.00 0.00 C ATOM 335 C GLU A 25 -17.490 6.803 -0.118 1.00 0.00 C ATOM 336 O GLU A 25 -17.351 8.005 -0.342 1.00 0.00 O ATOM 337 CB GLU A 25 -19.657 5.601 -0.460 1.00 0.00 C ATOM 338 CG GLU A 25 -20.564 6.814 -0.339 1.00 0.00 C ATOM 339 CD GLU A 25 -21.807 6.533 0.484 1.00 0.00 C ATOM 340 OE1 GLU A 25 -22.293 5.383 0.449 1.00 0.00 O ATOM 341 OE2 GLU A 25 -22.293 7.463 1.161 1.00 0.00 O ATOM 0 H GLU A 25 -18.132 3.837 -1.292 1.00 0.00 H new ATOM 0 HA GLU A 25 -18.432 6.455 -2.006 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -20.152 4.847 -1.072 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -19.513 5.165 0.529 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -20.009 7.634 0.116 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -20.859 7.143 -1.335 1.00 0.00 H new ATOM 348 N ASN A 26 -16.966 6.200 0.944 1.00 0.00 N ATOM 349 CA ASN A 26 -16.181 6.934 1.930 1.00 0.00 C ATOM 350 C ASN A 26 -14.861 7.409 1.331 1.00 0.00 C ATOM 351 O ASN A 26 -14.296 8.413 1.763 1.00 0.00 O ATOM 352 CB ASN A 26 -15.912 6.057 3.154 1.00 0.00 C ATOM 353 CG ASN A 26 -17.188 5.653 3.868 1.00 0.00 C ATOM 354 OD1 ASN A 26 -17.451 4.468 4.070 1.00 0.00 O ATOM 355 ND2 ASN A 26 -17.987 6.641 4.254 1.00 0.00 N ATOM 0 H ASN A 26 -17.071 5.205 1.144 1.00 0.00 H new ATOM 0 HA ASN A 26 -16.756 7.808 2.237 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -15.373 5.162 2.845 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -15.265 6.594 3.848 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -18.859 6.431 4.739 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -17.728 7.609 4.065 1.00 0.00 H new ATOM 362 N GLY A 27 -14.375 6.680 0.331 1.00 0.00 N ATOM 363 CA GLY A 27 -13.126 7.042 -0.313 1.00 0.00 C ATOM 364 C GLY A 27 -11.926 6.381 0.337 1.00 0.00 C ATOM 365 O GLY A 27 -10.883 7.010 0.513 1.00 0.00 O ATOM 0 H GLY A 27 -14.824 5.845 -0.045 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -13.168 6.759 -1.365 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -13.004 8.125 -0.279 1.00 0.00 H new ATOM 369 N ARG A 28 -12.075 5.110 0.696 1.00 0.00 N ATOM 370 CA ARG A 28 -10.996 4.365 1.332 1.00 0.00 C ATOM 371 C ARG A 28 -10.858 2.975 0.718 1.00 0.00 C ATOM 372 O ARG A 28 -11.843 2.378 0.282 1.00 0.00 O ATOM 373 CB ARG A 28 -11.247 4.247 2.837 1.00 0.00 C ATOM 374 CG ARG A 28 -12.383 3.301 3.192 1.00 0.00 C ATOM 375 CD ARG A 28 -12.818 3.471 4.639 1.00 0.00 C ATOM 376 NE ARG A 28 -13.361 4.803 4.894 1.00 0.00 N ATOM 377 CZ ARG A 28 -13.422 5.353 6.102 1.00 0.00 C ATOM 378 NH1 ARG A 28 -12.975 4.689 7.159 1.00 0.00 N ATOM 379 NH2 ARG A 28 -13.929 6.569 6.254 1.00 0.00 N ATOM 0 H ARG A 28 -12.932 4.575 0.557 1.00 0.00 H new ATOM 0 HA ARG A 28 -10.066 4.910 1.167 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -10.334 3.904 3.323 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -11.470 5.236 3.238 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -13.231 3.485 2.532 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -12.066 2.272 3.025 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -13.570 2.720 4.882 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -11.967 3.294 5.297 1.00 0.00 H new ATOM 0 HE ARG A 28 -13.713 5.340 4.101 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -12.583 3.754 7.046 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -13.023 5.113 8.085 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -14.273 7.083 5.443 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -13.975 6.990 7.182 1.00 0.00 H new ATOM 393 N PHE A 29 -9.631 2.466 0.686 1.00 0.00 N ATOM 394 CA PHE A 29 -9.364 1.148 0.124 1.00 0.00 C ATOM 395 C PHE A 29 -9.526 0.062 1.184 1.00 0.00 C ATOM 396 O PHE A 29 -9.931 0.336 2.313 1.00 0.00 O ATOM 397 CB PHE A 29 -7.953 1.096 -0.464 1.00 0.00 C ATOM 398 CG PHE A 29 -7.774 1.971 -1.671 1.00 0.00 C ATOM 399 CD1 PHE A 29 -8.380 1.647 -2.874 1.00 0.00 C ATOM 400 CD2 PHE A 29 -6.999 3.118 -1.603 1.00 0.00 C ATOM 401 CE1 PHE A 29 -8.218 2.450 -3.987 1.00 0.00 C ATOM 402 CE2 PHE A 29 -6.834 3.926 -2.713 1.00 0.00 C ATOM 403 CZ PHE A 29 -7.443 3.591 -3.907 1.00 0.00 C ATOM 0 H PHE A 29 -8.805 2.947 1.043 1.00 0.00 H new ATOM 0 HA PHE A 29 -10.087 0.967 -0.671 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -7.238 1.396 0.302 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -7.718 0.066 -0.734 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -8.986 0.756 -2.943 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -6.519 3.384 -0.673 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -8.697 2.186 -4.918 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -6.229 4.818 -2.647 1.00 0.00 H new ATOM 0 HZ PHE A 29 -7.314 4.219 -4.776 1.00 0.00 H new ATOM 413 N GLY A 30 -9.207 -1.174 0.810 1.00 0.00 N ATOM 414 CA GLY A 30 -9.324 -2.283 1.739 1.00 0.00 C ATOM 415 C GLY A 30 -8.135 -3.221 1.674 1.00 0.00 C ATOM 416 O GLY A 30 -8.286 -4.407 1.378 1.00 0.00 O ATOM 0 H GLY A 30 -8.870 -1.427 -0.119 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -9.422 -1.895 2.753 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -10.235 -2.840 1.522 1.00 0.00 H new ATOM 420 N PHE A 31 -6.948 -2.690 1.949 1.00 0.00 N ATOM 421 CA PHE A 31 -5.728 -3.488 1.918 1.00 0.00 C ATOM 422 C PHE A 31 -4.599 -2.783 2.664 1.00 0.00 C ATOM 423 O PHE A 31 -4.365 -1.591 2.474 1.00 0.00 O ATOM 424 CB PHE A 31 -5.308 -3.760 0.472 1.00 0.00 C ATOM 425 CG PHE A 31 -4.856 -2.530 -0.262 1.00 0.00 C ATOM 426 CD1 PHE A 31 -5.781 -1.657 -0.812 1.00 0.00 C ATOM 427 CD2 PHE A 31 -3.507 -2.246 -0.402 1.00 0.00 C ATOM 428 CE1 PHE A 31 -5.368 -0.525 -1.489 1.00 0.00 C ATOM 429 CE2 PHE A 31 -3.088 -1.116 -1.077 1.00 0.00 C ATOM 430 CZ PHE A 31 -4.020 -0.253 -1.621 1.00 0.00 C ATOM 0 H PHE A 31 -6.805 -1.711 2.196 1.00 0.00 H new ATOM 0 HA PHE A 31 -5.931 -4.437 2.414 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -4.501 -4.493 0.468 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -6.146 -4.206 -0.064 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -6.836 -1.863 -0.711 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -2.774 -2.916 0.022 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -6.099 0.147 -1.915 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -2.033 -0.907 -1.179 1.00 0.00 H new ATOM 0 HZ PHE A 31 -3.695 0.632 -2.148 1.00 0.00 H new ATOM 440 N ASN A 32 -3.902 -3.531 3.514 1.00 0.00 N ATOM 441 CA ASN A 32 -2.797 -2.979 4.290 1.00 0.00 C ATOM 442 C ASN A 32 -1.455 -3.397 3.698 1.00 0.00 C ATOM 443 O ASN A 32 -1.363 -4.395 2.984 1.00 0.00 O ATOM 444 CB ASN A 32 -2.891 -3.437 5.746 1.00 0.00 C ATOM 445 CG ASN A 32 -3.974 -2.704 6.514 1.00 0.00 C ATOM 446 OD1 ASN A 32 -4.944 -3.308 6.972 1.00 0.00 O ATOM 447 ND2 ASN A 32 -3.812 -1.394 6.660 1.00 0.00 N ATOM 0 H ASN A 32 -4.083 -4.521 3.683 1.00 0.00 H new ATOM 0 HA ASN A 32 -2.867 -1.892 4.253 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -3.091 -4.508 5.775 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -1.931 -3.278 6.237 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -4.507 -0.848 7.168 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -2.992 -0.934 6.264 1.00 0.00 H new ATOM 454 N VAL A 33 -0.415 -2.627 4.003 1.00 0.00 N ATOM 455 CA VAL A 33 0.924 -2.919 3.503 1.00 0.00 C ATOM 456 C VAL A 33 1.952 -2.874 4.629 1.00 0.00 C ATOM 457 O VAL A 33 1.891 -2.014 5.507 1.00 0.00 O ATOM 458 CB VAL A 33 1.341 -1.925 2.403 1.00 0.00 C ATOM 459 CG1 VAL A 33 0.580 -2.205 1.115 1.00 0.00 C ATOM 460 CG2 VAL A 33 1.116 -0.493 2.864 1.00 0.00 C ATOM 0 H VAL A 33 -0.474 -1.797 4.593 1.00 0.00 H new ATOM 0 HA VAL A 33 0.893 -3.924 3.082 1.00 0.00 H new ATOM 0 HB VAL A 33 2.405 -2.055 2.205 1.00 0.00 H new ATOM 0 HG11 VAL A 33 0.887 -1.493 0.349 1.00 0.00 H new ATOM 0 HG12 VAL A 33 0.797 -3.218 0.777 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -0.490 -2.104 1.296 1.00 0.00 H new ATOM 0 HG21 VAL A 33 1.416 0.195 2.074 1.00 0.00 H new ATOM 0 HG22 VAL A 33 0.060 -0.346 3.092 1.00 0.00 H new ATOM 0 HG23 VAL A 33 1.710 -0.301 3.757 1.00 0.00 H new ATOM 470 N LYS A 34 2.897 -3.807 4.596 1.00 0.00 N ATOM 471 CA LYS A 34 3.941 -3.875 5.611 1.00 0.00 C ATOM 472 C LYS A 34 5.315 -4.037 4.969 1.00 0.00 C ATOM 473 O LYS A 34 5.429 -4.480 3.827 1.00 0.00 O ATOM 474 CB LYS A 34 3.674 -5.038 6.570 1.00 0.00 C ATOM 475 CG LYS A 34 3.676 -6.397 5.892 1.00 0.00 C ATOM 476 CD LYS A 34 3.921 -7.517 6.889 1.00 0.00 C ATOM 477 CE LYS A 34 4.007 -8.869 6.198 1.00 0.00 C ATOM 478 NZ LYS A 34 4.619 -9.904 7.078 1.00 0.00 N ATOM 0 H LYS A 34 2.961 -4.527 3.877 1.00 0.00 H new ATOM 0 HA LYS A 34 3.929 -2.940 6.171 1.00 0.00 H new ATOM 0 HB2 LYS A 34 4.430 -5.032 7.355 1.00 0.00 H new ATOM 0 HB3 LYS A 34 2.710 -4.884 7.055 1.00 0.00 H new ATOM 0 HG2 LYS A 34 2.721 -6.556 5.392 1.00 0.00 H new ATOM 0 HG3 LYS A 34 4.447 -6.419 5.122 1.00 0.00 H new ATOM 0 HD2 LYS A 34 4.846 -7.326 7.433 1.00 0.00 H new ATOM 0 HD3 LYS A 34 3.117 -7.533 7.624 1.00 0.00 H new ATOM 0 HE2 LYS A 34 3.008 -9.189 5.901 1.00 0.00 H new ATOM 0 HE3 LYS A 34 4.596 -8.774 5.286 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 4.660 -10.811 6.571 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 5.582 -9.611 7.341 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 4.043 -10.014 7.937 1.00 0.00 H new ATOM 492 N GLY A 35 6.357 -3.676 5.712 1.00 0.00 N ATOM 493 CA GLY A 35 7.710 -3.790 5.199 1.00 0.00 C ATOM 494 C GLY A 35 8.207 -2.498 4.582 1.00 0.00 C ATOM 495 O GLY A 35 7.871 -1.410 5.048 1.00 0.00 O ATOM 0 H GLY A 35 6.288 -3.307 6.660 1.00 0.00 H new ATOM 0 HA2 GLY A 35 8.379 -4.083 6.008 1.00 0.00 H new ATOM 0 HA3 GLY A 35 7.746 -4.583 4.452 1.00 0.00 H new ATOM 499 N GLY A 36 9.013 -2.616 3.531 1.00 0.00 N ATOM 500 CA GLY A 36 9.546 -1.440 2.869 1.00 0.00 C ATOM 501 C GLY A 36 11.014 -1.219 3.173 1.00 0.00 C ATOM 502 O GLY A 36 11.586 -1.891 4.032 1.00 0.00 O ATOM 0 H GLY A 36 9.306 -3.505 3.126 1.00 0.00 H new ATOM 0 HA2 GLY A 36 9.412 -1.541 1.792 1.00 0.00 H new ATOM 0 HA3 GLY A 36 8.978 -0.563 3.180 1.00 0.00 H new ATOM 506 N TYR A 37 11.627 -0.276 2.467 1.00 0.00 N ATOM 507 CA TYR A 37 13.040 0.029 2.663 1.00 0.00 C ATOM 508 C TYR A 37 13.391 0.053 4.147 1.00 0.00 C ATOM 509 O TYR A 37 14.485 -0.351 4.544 1.00 0.00 O ATOM 510 CB TYR A 37 13.386 1.375 2.024 1.00 0.00 C ATOM 511 CG TYR A 37 14.847 1.745 2.145 1.00 0.00 C ATOM 512 CD1 TYR A 37 15.812 1.106 1.377 1.00 0.00 C ATOM 513 CD2 TYR A 37 15.261 2.735 3.028 1.00 0.00 C ATOM 514 CE1 TYR A 37 17.148 1.441 1.486 1.00 0.00 C ATOM 515 CE2 TYR A 37 16.595 3.078 3.142 1.00 0.00 C ATOM 516 CZ TYR A 37 17.535 2.427 2.370 1.00 0.00 C ATOM 517 OH TYR A 37 18.864 2.764 2.480 1.00 0.00 O ATOM 0 H TYR A 37 11.168 0.291 1.754 1.00 0.00 H new ATOM 0 HA TYR A 37 13.625 -0.755 2.182 1.00 0.00 H new ATOM 0 HB2 TYR A 37 13.113 1.348 0.969 1.00 0.00 H new ATOM 0 HB3 TYR A 37 12.783 2.154 2.489 1.00 0.00 H new ATOM 0 HD1 TYR A 37 15.513 0.334 0.683 1.00 0.00 H new ATOM 0 HD2 TYR A 37 14.528 3.245 3.635 1.00 0.00 H new ATOM 0 HE1 TYR A 37 17.886 0.934 0.882 1.00 0.00 H new ATOM 0 HE2 TYR A 37 16.900 3.851 3.832 1.00 0.00 H new ATOM 0 HH TYR A 37 18.967 3.476 3.145 1.00 0.00 H new ATOM 527 N ASP A 38 12.456 0.528 4.962 1.00 0.00 N ATOM 528 CA ASP A 38 12.664 0.604 6.403 1.00 0.00 C ATOM 529 C ASP A 38 13.254 -0.699 6.936 1.00 0.00 C ATOM 530 O ASP A 38 14.166 -0.685 7.762 1.00 0.00 O ATOM 531 CB ASP A 38 11.346 0.910 7.115 1.00 0.00 C ATOM 532 CG ASP A 38 11.525 1.104 8.608 1.00 0.00 C ATOM 533 OD1 ASP A 38 12.533 0.607 9.153 1.00 0.00 O ATOM 534 OD2 ASP A 38 10.658 1.751 9.231 1.00 0.00 O ATOM 0 H ASP A 38 11.546 0.866 4.649 1.00 0.00 H new ATOM 0 HA ASP A 38 13.370 1.410 6.601 1.00 0.00 H new ATOM 0 HB2 ASP A 38 10.905 1.809 6.685 1.00 0.00 H new ATOM 0 HB3 ASP A 38 10.644 0.095 6.939 1.00 0.00 H new ATOM 539 N GLN A 39 12.726 -1.821 6.458 1.00 0.00 N ATOM 540 CA GLN A 39 13.199 -3.131 6.888 1.00 0.00 C ATOM 541 C GLN A 39 13.844 -3.884 5.729 1.00 0.00 C ATOM 542 O GLN A 39 13.687 -5.098 5.600 1.00 0.00 O ATOM 543 CB GLN A 39 12.043 -3.951 7.464 1.00 0.00 C ATOM 544 CG GLN A 39 11.749 -3.645 8.924 1.00 0.00 C ATOM 545 CD GLN A 39 12.599 -4.465 9.875 1.00 0.00 C ATOM 546 OE1 GLN A 39 13.661 -4.966 9.502 1.00 0.00 O ATOM 547 NE2 GLN A 39 12.136 -4.607 11.111 1.00 0.00 N ATOM 0 H GLN A 39 11.971 -1.849 5.773 1.00 0.00 H new ATOM 0 HA GLN A 39 13.950 -2.981 7.663 1.00 0.00 H new ATOM 0 HB2 GLN A 39 11.146 -3.763 6.874 1.00 0.00 H new ATOM 0 HB3 GLN A 39 12.275 -5.011 7.363 1.00 0.00 H new ATOM 0 HG2 GLN A 39 11.921 -2.585 9.111 1.00 0.00 H new ATOM 0 HG3 GLN A 39 10.695 -3.837 9.127 1.00 0.00 H new ATOM 0 HE21 GLN A 39 11.251 -4.175 11.377 1.00 0.00 H new ATOM 0 HE22 GLN A 39 12.665 -5.148 11.795 1.00 0.00 H new ATOM 556 N LYS A 40 14.570 -3.156 4.888 1.00 0.00 N ATOM 557 CA LYS A 40 15.241 -3.754 3.740 1.00 0.00 C ATOM 558 C LYS A 40 14.405 -4.886 3.151 1.00 0.00 C ATOM 559 O LYS A 40 14.944 -5.857 2.620 1.00 0.00 O ATOM 560 CB LYS A 40 16.619 -4.281 4.145 1.00 0.00 C ATOM 561 CG LYS A 40 17.731 -3.258 3.992 1.00 0.00 C ATOM 562 CD LYS A 40 18.839 -3.482 5.007 1.00 0.00 C ATOM 563 CE LYS A 40 20.130 -2.800 4.582 1.00 0.00 C ATOM 564 NZ LYS A 40 20.161 -1.368 4.989 1.00 0.00 N ATOM 0 H LYS A 40 14.709 -2.150 4.980 1.00 0.00 H new ATOM 0 HA LYS A 40 15.364 -2.982 2.980 1.00 0.00 H new ATOM 0 HB2 LYS A 40 16.581 -4.612 5.183 1.00 0.00 H new ATOM 0 HB3 LYS A 40 16.856 -5.156 3.540 1.00 0.00 H new ATOM 0 HG2 LYS A 40 18.143 -3.315 2.984 1.00 0.00 H new ATOM 0 HG3 LYS A 40 17.323 -2.255 4.113 1.00 0.00 H new ATOM 0 HD2 LYS A 40 18.527 -3.099 5.979 1.00 0.00 H new ATOM 0 HD3 LYS A 40 19.013 -4.551 5.127 1.00 0.00 H new ATOM 0 HE2 LYS A 40 20.979 -3.322 5.024 1.00 0.00 H new ATOM 0 HE3 LYS A 40 20.240 -2.872 3.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 21.057 -0.939 4.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 19.366 -0.864 4.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 20.082 -1.299 6.024 1.00 0.00 H new ATOM 578 N MET A 41 13.086 -4.754 3.247 1.00 0.00 N ATOM 579 CA MET A 41 12.176 -5.765 2.721 1.00 0.00 C ATOM 580 C MET A 41 11.133 -5.134 1.804 1.00 0.00 C ATOM 581 O MET A 41 10.781 -3.962 1.939 1.00 0.00 O ATOM 582 CB MET A 41 11.484 -6.505 3.867 1.00 0.00 C ATOM 583 CG MET A 41 10.349 -5.716 4.501 1.00 0.00 C ATOM 584 SD MET A 41 9.284 -6.741 5.535 1.00 0.00 S ATOM 585 CE MET A 41 8.483 -7.755 4.295 1.00 0.00 C ATOM 0 H MET A 41 12.623 -3.957 3.684 1.00 0.00 H new ATOM 0 HA MET A 41 12.761 -6.477 2.140 1.00 0.00 H new ATOM 0 HB2 MET A 41 11.094 -7.452 3.494 1.00 0.00 H new ATOM 0 HB3 MET A 41 12.222 -6.744 4.633 1.00 0.00 H new ATOM 0 HG2 MET A 41 10.765 -4.908 5.103 1.00 0.00 H new ATOM 0 HG3 MET A 41 9.751 -5.253 3.716 1.00 0.00 H new ATOM 0 HE1 MET A 41 7.403 -7.626 4.362 1.00 0.00 H new ATOM 0 HE2 MET A 41 8.823 -7.454 3.304 1.00 0.00 H new ATOM 0 HE3 MET A 41 8.735 -8.802 4.463 1.00 0.00 H new ATOM 595 N PRO A 42 10.627 -5.927 0.848 1.00 0.00 N ATOM 596 CA PRO A 42 9.618 -5.467 -0.110 1.00 0.00 C ATOM 597 C PRO A 42 8.262 -5.228 0.547 1.00 0.00 C ATOM 598 O PRO A 42 7.913 -5.882 1.530 1.00 0.00 O ATOM 599 CB PRO A 42 9.530 -6.619 -1.114 1.00 0.00 C ATOM 600 CG PRO A 42 9.970 -7.820 -0.351 1.00 0.00 C ATOM 601 CD PRO A 42 11.002 -7.334 0.629 1.00 0.00 C ATOM 0 HA PRO A 42 9.889 -4.512 -0.560 1.00 0.00 H new ATOM 0 HB2 PRO A 42 8.514 -6.739 -1.491 1.00 0.00 H new ATOM 0 HB3 PRO A 42 10.171 -6.442 -1.977 1.00 0.00 H new ATOM 0 HG2 PRO A 42 9.129 -8.284 0.165 1.00 0.00 H new ATOM 0 HG3 PRO A 42 10.389 -8.574 -1.018 1.00 0.00 H new ATOM 0 HD2 PRO A 42 10.976 -7.906 1.557 1.00 0.00 H new ATOM 0 HD3 PRO A 42 12.011 -7.423 0.227 1.00 0.00 H new ATOM 609 N VAL A 43 7.501 -4.287 -0.003 1.00 0.00 N ATOM 610 CA VAL A 43 6.182 -3.964 0.528 1.00 0.00 C ATOM 611 C VAL A 43 5.191 -5.092 0.265 1.00 0.00 C ATOM 612 O VAL A 43 4.605 -5.178 -0.814 1.00 0.00 O ATOM 613 CB VAL A 43 5.634 -2.661 -0.085 1.00 0.00 C ATOM 614 CG1 VAL A 43 4.253 -2.350 0.470 1.00 0.00 C ATOM 615 CG2 VAL A 43 6.593 -1.508 0.171 1.00 0.00 C ATOM 0 H VAL A 43 7.775 -3.735 -0.816 1.00 0.00 H new ATOM 0 HA VAL A 43 6.298 -3.831 1.604 1.00 0.00 H new ATOM 0 HB VAL A 43 5.544 -2.796 -1.163 1.00 0.00 H new ATOM 0 HG11 VAL A 43 3.882 -1.426 0.026 1.00 0.00 H new ATOM 0 HG12 VAL A 43 3.572 -3.167 0.231 1.00 0.00 H new ATOM 0 HG13 VAL A 43 4.314 -2.233 1.552 1.00 0.00 H new ATOM 0 HG21 VAL A 43 6.190 -0.595 -0.269 1.00 0.00 H new ATOM 0 HG22 VAL A 43 6.717 -1.369 1.245 1.00 0.00 H new ATOM 0 HG23 VAL A 43 7.560 -1.732 -0.280 1.00 0.00 H new ATOM 625 N ILE A 44 5.009 -5.956 1.259 1.00 0.00 N ATOM 626 CA ILE A 44 4.088 -7.079 1.135 1.00 0.00 C ATOM 627 C ILE A 44 2.777 -6.796 1.860 1.00 0.00 C ATOM 628 O ILE A 44 2.771 -6.260 2.968 1.00 0.00 O ATOM 629 CB ILE A 44 4.702 -8.375 1.695 1.00 0.00 C ATOM 630 CG1 ILE A 44 6.068 -8.635 1.057 1.00 0.00 C ATOM 631 CG2 ILE A 44 3.767 -9.551 1.455 1.00 0.00 C ATOM 632 CD1 ILE A 44 6.031 -8.676 -0.455 1.00 0.00 C ATOM 0 H ILE A 44 5.487 -5.899 2.158 1.00 0.00 H new ATOM 0 HA ILE A 44 3.891 -7.210 0.071 1.00 0.00 H new ATOM 0 HB ILE A 44 4.840 -8.259 2.770 1.00 0.00 H new ATOM 0 HG12 ILE A 44 6.762 -7.857 1.374 1.00 0.00 H new ATOM 0 HG13 ILE A 44 6.459 -9.582 1.429 1.00 0.00 H new ATOM 0 HG21 ILE A 44 4.215 -10.460 1.856 1.00 0.00 H new ATOM 0 HG22 ILE A 44 2.815 -9.366 1.952 1.00 0.00 H new ATOM 0 HG23 ILE A 44 3.600 -9.671 0.384 1.00 0.00 H new ATOM 0 HD11 ILE A 44 7.034 -8.864 -0.839 1.00 0.00 H new ATOM 0 HD12 ILE A 44 5.362 -9.473 -0.781 1.00 0.00 H new ATOM 0 HD13 ILE A 44 5.670 -7.721 -0.836 1.00 0.00 H new ATOM 644 N VAL A 45 1.666 -7.162 1.228 1.00 0.00 N ATOM 645 CA VAL A 45 0.348 -6.951 1.814 1.00 0.00 C ATOM 646 C VAL A 45 0.287 -7.491 3.238 1.00 0.00 C ATOM 647 O VAL A 45 0.712 -8.614 3.506 1.00 0.00 O ATOM 648 CB VAL A 45 -0.754 -7.624 0.974 1.00 0.00 C ATOM 649 CG1 VAL A 45 -2.096 -7.535 1.684 1.00 0.00 C ATOM 650 CG2 VAL A 45 -0.830 -6.993 -0.408 1.00 0.00 C ATOM 0 H VAL A 45 1.653 -7.606 0.310 1.00 0.00 H new ATOM 0 HA VAL A 45 0.177 -5.875 1.829 1.00 0.00 H new ATOM 0 HB VAL A 45 -0.503 -8.678 0.854 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -2.862 -8.016 1.076 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -2.031 -8.037 2.649 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -2.358 -6.488 1.837 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -1.614 -7.480 -0.988 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -1.057 -5.931 -0.311 1.00 0.00 H new ATOM 0 HG23 VAL A 45 0.126 -7.114 -0.916 1.00 0.00 H new ATOM 660 N SER A 46 -0.246 -6.682 4.149 1.00 0.00 N ATOM 661 CA SER A 46 -0.360 -7.077 5.548 1.00 0.00 C ATOM 662 C SER A 46 -1.639 -7.874 5.785 1.00 0.00 C ATOM 663 O SER A 46 -1.593 -9.047 6.154 1.00 0.00 O ATOM 664 CB SER A 46 -0.340 -5.843 6.452 1.00 0.00 C ATOM 665 OG SER A 46 -0.175 -6.208 7.811 1.00 0.00 O ATOM 0 H SER A 46 -0.605 -5.750 3.943 1.00 0.00 H new ATOM 0 HA SER A 46 0.493 -7.711 5.791 1.00 0.00 H new ATOM 0 HB2 SER A 46 0.471 -5.180 6.149 1.00 0.00 H new ATOM 0 HB3 SER A 46 -1.269 -5.286 6.332 1.00 0.00 H new ATOM 0 HG SER A 46 -0.164 -5.401 8.367 1.00 0.00 H new ATOM 671 N ARG A 47 -2.780 -7.227 5.570 1.00 0.00 N ATOM 672 CA ARG A 47 -4.072 -7.874 5.761 1.00 0.00 C ATOM 673 C ARG A 47 -5.094 -7.356 4.752 1.00 0.00 C ATOM 674 O ARG A 47 -4.929 -6.276 4.185 1.00 0.00 O ATOM 675 CB ARG A 47 -4.580 -7.636 7.184 1.00 0.00 C ATOM 676 CG ARG A 47 -5.853 -8.400 7.512 1.00 0.00 C ATOM 677 CD ARG A 47 -5.641 -9.903 7.419 1.00 0.00 C ATOM 678 NE ARG A 47 -6.508 -10.635 8.338 1.00 0.00 N ATOM 679 CZ ARG A 47 -6.213 -10.847 9.616 1.00 0.00 C ATOM 680 NH1 ARG A 47 -5.079 -10.384 10.123 1.00 0.00 N ATOM 681 NH2 ARG A 47 -7.054 -11.523 10.389 1.00 0.00 N ATOM 0 H ARG A 47 -2.836 -6.256 5.264 1.00 0.00 H new ATOM 0 HA ARG A 47 -3.941 -8.945 5.603 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -3.802 -7.923 7.891 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -4.760 -6.570 7.323 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -6.186 -8.140 8.517 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -6.645 -8.100 6.826 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -5.833 -10.234 6.398 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -4.599 -10.137 7.639 1.00 0.00 H new ATOM 0 HE ARG A 47 -7.389 -11.004 7.979 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -4.431 -9.864 9.532 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -4.855 -10.548 11.104 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -7.928 -11.880 10.002 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -6.827 -11.685 11.370 1.00 0.00 H new ATOM 695 N VAL A 48 -6.149 -8.134 4.534 1.00 0.00 N ATOM 696 CA VAL A 48 -7.197 -7.754 3.594 1.00 0.00 C ATOM 697 C VAL A 48 -8.580 -7.928 4.213 1.00 0.00 C ATOM 698 O VAL A 48 -8.920 -9.005 4.703 1.00 0.00 O ATOM 699 CB VAL A 48 -7.119 -8.584 2.299 1.00 0.00 C ATOM 700 CG1 VAL A 48 -8.197 -8.149 1.319 1.00 0.00 C ATOM 701 CG2 VAL A 48 -5.737 -8.464 1.673 1.00 0.00 C ATOM 0 H VAL A 48 -6.301 -9.031 4.995 1.00 0.00 H new ATOM 0 HA VAL A 48 -7.039 -6.703 3.353 1.00 0.00 H new ATOM 0 HB VAL A 48 -7.291 -9.631 2.548 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -8.126 -8.747 0.410 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -9.179 -8.292 1.771 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -8.061 -7.096 1.072 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -5.699 -9.057 0.759 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -5.534 -7.419 1.437 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -4.987 -8.830 2.374 1.00 0.00 H new ATOM 711 N ALA A 49 -9.373 -6.862 4.187 1.00 0.00 N ATOM 712 CA ALA A 49 -10.719 -6.898 4.743 1.00 0.00 C ATOM 713 C ALA A 49 -11.733 -7.352 3.699 1.00 0.00 C ATOM 714 O ALA A 49 -11.603 -7.068 2.508 1.00 0.00 O ATOM 715 CB ALA A 49 -11.100 -5.531 5.292 1.00 0.00 C ATOM 0 H ALA A 49 -9.106 -5.963 3.787 1.00 0.00 H new ATOM 0 HA ALA A 49 -10.729 -7.621 5.559 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -12.108 -5.573 5.704 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -10.399 -5.245 6.076 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -11.066 -4.794 4.489 1.00 0.00 H new ATOM 721 N PRO A 50 -12.768 -8.074 4.152 1.00 0.00 N ATOM 722 CA PRO A 50 -13.824 -8.583 3.272 1.00 0.00 C ATOM 723 C PRO A 50 -14.713 -7.469 2.730 1.00 0.00 C ATOM 724 O PRO A 50 -14.711 -6.353 3.246 1.00 0.00 O ATOM 725 CB PRO A 50 -14.628 -9.513 4.184 1.00 0.00 C ATOM 726 CG PRO A 50 -14.389 -8.995 5.560 1.00 0.00 C ATOM 727 CD PRO A 50 -12.987 -8.451 5.559 1.00 0.00 C ATOM 0 HA PRO A 50 -13.417 -9.077 2.390 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -15.688 -9.494 3.933 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -14.296 -10.547 4.087 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -15.109 -8.218 5.815 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -14.500 -9.787 6.300 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -12.888 -7.594 6.225 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -12.266 -9.198 5.892 1.00 0.00 H new ATOM 735 N GLY A 51 -15.474 -7.781 1.684 1.00 0.00 N ATOM 736 CA GLY A 51 -16.358 -6.795 1.090 1.00 0.00 C ATOM 737 C GLY A 51 -15.652 -5.487 0.793 1.00 0.00 C ATOM 738 O GLY A 51 -16.212 -4.409 0.996 1.00 0.00 O ATOM 0 H GLY A 51 -15.494 -8.698 1.238 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -16.776 -7.196 0.167 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -17.194 -6.608 1.764 1.00 0.00 H new ATOM 742 N THR A 52 -14.415 -5.579 0.314 1.00 0.00 N ATOM 743 CA THR A 52 -13.630 -4.394 -0.008 1.00 0.00 C ATOM 744 C THR A 52 -13.374 -4.295 -1.508 1.00 0.00 C ATOM 745 O THR A 52 -13.355 -5.295 -2.226 1.00 0.00 O ATOM 746 CB THR A 52 -12.280 -4.396 0.733 1.00 0.00 C ATOM 747 OG1 THR A 52 -11.601 -5.638 0.512 1.00 0.00 O ATOM 748 CG2 THR A 52 -12.482 -4.182 2.226 1.00 0.00 C ATOM 0 H THR A 52 -13.935 -6.462 0.141 1.00 0.00 H new ATOM 0 HA THR A 52 -14.212 -3.531 0.316 1.00 0.00 H new ATOM 0 HB THR A 52 -11.675 -3.577 0.343 1.00 0.00 H new ATOM 0 HG1 THR A 52 -11.955 -6.318 1.123 1.00 0.00 H new ATOM 0 HG21 THR A 52 -11.515 -4.187 2.728 1.00 0.00 H new ATOM 0 HG22 THR A 52 -12.972 -3.223 2.393 1.00 0.00 H new ATOM 0 HG23 THR A 52 -13.104 -4.982 2.627 1.00 0.00 H new ATOM 756 N PRO A 53 -13.170 -3.062 -1.994 1.00 0.00 N ATOM 757 CA PRO A 53 -12.909 -2.803 -3.413 1.00 0.00 C ATOM 758 C PRO A 53 -11.539 -3.308 -3.852 1.00 0.00 C ATOM 759 O PRO A 53 -11.139 -3.126 -5.002 1.00 0.00 O ATOM 760 CB PRO A 53 -12.974 -1.277 -3.513 1.00 0.00 C ATOM 761 CG PRO A 53 -12.636 -0.793 -2.146 1.00 0.00 C ATOM 762 CD PRO A 53 -13.178 -1.824 -1.195 1.00 0.00 C ATOM 0 HA PRO A 53 -13.621 -3.317 -4.059 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -12.269 -0.898 -4.253 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -13.966 -0.942 -3.818 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -11.558 -0.681 -2.027 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -13.081 0.184 -1.957 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -12.556 -1.916 -0.305 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -14.183 -1.570 -0.857 1.00 0.00 H new ATOM 770 N ALA A 54 -10.825 -3.945 -2.930 1.00 0.00 N ATOM 771 CA ALA A 54 -9.501 -4.478 -3.223 1.00 0.00 C ATOM 772 C ALA A 54 -9.531 -6.000 -3.319 1.00 0.00 C ATOM 773 O ALA A 54 -8.628 -6.614 -3.889 1.00 0.00 O ATOM 774 CB ALA A 54 -8.506 -4.034 -2.161 1.00 0.00 C ATOM 0 H ALA A 54 -11.142 -4.104 -1.974 1.00 0.00 H new ATOM 0 HA ALA A 54 -9.184 -4.085 -4.189 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -7.521 -4.440 -2.393 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -8.455 -2.945 -2.143 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -8.828 -4.399 -1.186 1.00 0.00 H new ATOM 780 N ASP A 55 -10.574 -6.603 -2.759 1.00 0.00 N ATOM 781 CA ASP A 55 -10.721 -8.053 -2.782 1.00 0.00 C ATOM 782 C ASP A 55 -11.660 -8.486 -3.904 1.00 0.00 C ATOM 783 O ASP A 55 -11.314 -9.338 -4.723 1.00 0.00 O ATOM 784 CB ASP A 55 -11.249 -8.555 -1.437 1.00 0.00 C ATOM 785 CG ASP A 55 -10.823 -9.980 -1.143 1.00 0.00 C ATOM 786 OD1 ASP A 55 -9.623 -10.197 -0.874 1.00 0.00 O ATOM 787 OD2 ASP A 55 -11.690 -10.879 -1.182 1.00 0.00 O ATOM 0 H ASP A 55 -11.330 -6.110 -2.284 1.00 0.00 H new ATOM 0 HA ASP A 55 -9.739 -8.490 -2.964 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -10.891 -7.901 -0.642 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -12.337 -8.496 -1.432 1.00 0.00 H new ATOM 792 N LEU A 56 -12.850 -7.895 -3.934 1.00 0.00 N ATOM 793 CA LEU A 56 -13.840 -8.220 -4.955 1.00 0.00 C ATOM 794 C LEU A 56 -13.248 -8.075 -6.353 1.00 0.00 C ATOM 795 O LEU A 56 -13.598 -8.823 -7.267 1.00 0.00 O ATOM 796 CB LEU A 56 -15.065 -7.316 -4.811 1.00 0.00 C ATOM 797 CG LEU A 56 -15.719 -7.287 -3.429 1.00 0.00 C ATOM 798 CD1 LEU A 56 -16.558 -6.029 -3.262 1.00 0.00 C ATOM 799 CD2 LEU A 56 -16.569 -8.530 -3.214 1.00 0.00 C ATOM 0 H LEU A 56 -13.152 -7.189 -3.263 1.00 0.00 H new ATOM 0 HA LEU A 56 -14.143 -9.258 -4.815 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -14.774 -6.299 -5.075 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -15.813 -7.632 -5.538 1.00 0.00 H new ATOM 0 HG LEU A 56 -14.931 -7.276 -2.676 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -17.016 -6.026 -2.273 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -15.922 -5.150 -3.371 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -17.338 -6.008 -4.023 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -17.026 -8.492 -2.225 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -17.350 -8.573 -3.973 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -15.941 -9.418 -3.289 1.00 0.00 H new ATOM 811 N CYS A 57 -12.349 -7.110 -6.512 1.00 0.00 N ATOM 812 CA CYS A 57 -11.707 -6.867 -7.799 1.00 0.00 C ATOM 813 C CYS A 57 -10.849 -8.059 -8.211 1.00 0.00 C ATOM 814 O CYS A 57 -10.560 -8.940 -7.401 1.00 0.00 O ATOM 815 CB CYS A 57 -10.848 -5.603 -7.733 1.00 0.00 C ATOM 816 SG CYS A 57 -9.290 -5.815 -6.841 1.00 0.00 S ATOM 0 H CYS A 57 -12.048 -6.483 -5.766 1.00 0.00 H new ATOM 0 HA CYS A 57 -12.488 -6.728 -8.547 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -10.631 -5.271 -8.748 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -11.423 -4.810 -7.255 1.00 0.00 H new ATOM 0 HG CYS A 57 -8.634 -4.693 -6.841 1.00 0.00 H new ATOM 822 N VAL A 58 -10.445 -8.081 -9.478 1.00 0.00 N ATOM 823 CA VAL A 58 -9.621 -9.164 -9.999 1.00 0.00 C ATOM 824 C VAL A 58 -8.472 -8.624 -10.843 1.00 0.00 C ATOM 825 O VAL A 58 -8.638 -7.705 -11.646 1.00 0.00 O ATOM 826 CB VAL A 58 -10.452 -10.143 -10.850 1.00 0.00 C ATOM 827 CG1 VAL A 58 -11.206 -9.396 -11.939 1.00 0.00 C ATOM 828 CG2 VAL A 58 -9.559 -11.218 -11.450 1.00 0.00 C ATOM 0 H VAL A 58 -10.676 -7.360 -10.162 1.00 0.00 H new ATOM 0 HA VAL A 58 -9.217 -9.696 -9.138 1.00 0.00 H new ATOM 0 HB VAL A 58 -11.183 -10.629 -10.203 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -11.787 -10.104 -12.530 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -11.876 -8.667 -11.483 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -10.496 -8.881 -12.586 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -10.163 -11.901 -12.048 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -8.804 -10.752 -12.083 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -9.069 -11.773 -10.650 1.00 0.00 H new ATOM 838 N PRO A 59 -7.278 -9.206 -10.659 1.00 0.00 N ATOM 839 CA PRO A 59 -7.069 -10.300 -9.706 1.00 0.00 C ATOM 840 C PRO A 59 -7.175 -9.835 -8.257 1.00 0.00 C ATOM 841 O PRO A 59 -6.594 -8.818 -7.878 1.00 0.00 O ATOM 842 CB PRO A 59 -5.646 -10.772 -10.013 1.00 0.00 C ATOM 843 CG PRO A 59 -4.974 -9.584 -10.610 1.00 0.00 C ATOM 844 CD PRO A 59 -6.040 -8.842 -11.367 1.00 0.00 C ATOM 0 HA PRO A 59 -7.823 -11.080 -9.810 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -5.135 -11.103 -9.109 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -5.649 -11.615 -10.705 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -4.535 -8.954 -9.836 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -4.163 -9.886 -11.273 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -5.869 -7.766 -11.350 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -6.073 -9.143 -12.414 1.00 0.00 H new ATOM 852 N ARG A 60 -7.919 -10.585 -7.452 1.00 0.00 N ATOM 853 CA ARG A 60 -8.101 -10.249 -6.045 1.00 0.00 C ATOM 854 C ARG A 60 -6.755 -10.042 -5.357 1.00 0.00 C ATOM 855 O ARG A 60 -5.845 -10.861 -5.491 1.00 0.00 O ATOM 856 CB ARG A 60 -8.886 -11.351 -5.333 1.00 0.00 C ATOM 857 CG ARG A 60 -8.927 -11.191 -3.822 1.00 0.00 C ATOM 858 CD ARG A 60 -9.133 -12.526 -3.125 1.00 0.00 C ATOM 859 NE ARG A 60 -10.548 -12.828 -2.928 1.00 0.00 N ATOM 860 CZ ARG A 60 -11.313 -13.398 -3.852 1.00 0.00 C ATOM 861 NH1 ARG A 60 -10.802 -13.726 -5.030 1.00 0.00 N ATOM 862 NH2 ARG A 60 -12.593 -13.642 -3.597 1.00 0.00 N ATOM 0 H ARG A 60 -8.406 -11.430 -7.750 1.00 0.00 H new ATOM 0 HA ARG A 60 -8.665 -9.318 -5.990 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -9.906 -11.364 -5.716 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -8.442 -12.316 -5.576 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -7.997 -10.740 -3.478 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -9.732 -10.509 -3.549 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -8.672 -13.318 -3.715 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -8.627 -12.513 -2.159 1.00 0.00 H new ATOM 0 HE ARG A 60 -10.972 -12.588 -2.032 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -9.819 -13.541 -5.229 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -11.392 -14.164 -5.738 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -12.989 -13.392 -2.691 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -13.180 -14.080 -4.307 1.00 0.00 H new ATOM 876 N LEU A 61 -6.635 -8.942 -4.622 1.00 0.00 N ATOM 877 CA LEU A 61 -5.400 -8.626 -3.913 1.00 0.00 C ATOM 878 C LEU A 61 -5.294 -9.429 -2.620 1.00 0.00 C ATOM 879 O LEU A 61 -5.735 -8.981 -1.563 1.00 0.00 O ATOM 880 CB LEU A 61 -5.333 -7.130 -3.605 1.00 0.00 C ATOM 881 CG LEU A 61 -4.007 -6.618 -3.043 1.00 0.00 C ATOM 882 CD1 LEU A 61 -2.909 -6.718 -4.090 1.00 0.00 C ATOM 883 CD2 LEU A 61 -4.152 -5.184 -2.555 1.00 0.00 C ATOM 0 H LEU A 61 -7.378 -8.254 -4.501 1.00 0.00 H new ATOM 0 HA LEU A 61 -4.562 -8.895 -4.556 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -5.552 -6.581 -4.521 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -6.123 -6.891 -2.893 1.00 0.00 H new ATOM 0 HG LEU A 61 -3.729 -7.243 -2.194 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -1.973 -6.349 -3.672 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -2.787 -7.758 -4.391 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -3.179 -6.118 -4.959 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -3.198 -4.836 -2.158 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -4.454 -4.546 -3.385 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -4.908 -5.141 -1.771 1.00 0.00 H new ATOM 895 N ASN A 62 -4.704 -10.616 -2.713 1.00 0.00 N ATOM 896 CA ASN A 62 -4.538 -11.480 -1.550 1.00 0.00 C ATOM 897 C ASN A 62 -3.166 -11.280 -0.914 1.00 0.00 C ATOM 898 O ASN A 62 -2.201 -10.934 -1.595 1.00 0.00 O ATOM 899 CB ASN A 62 -4.720 -12.946 -1.948 1.00 0.00 C ATOM 900 CG ASN A 62 -4.026 -13.281 -3.254 1.00 0.00 C ATOM 901 OD1 ASN A 62 -3.081 -12.604 -3.659 1.00 0.00 O ATOM 902 ND2 ASN A 62 -4.494 -14.329 -3.921 1.00 0.00 N ATOM 0 H ASN A 62 -4.333 -11.002 -3.581 1.00 0.00 H new ATOM 0 HA ASN A 62 -5.300 -11.212 -0.818 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -4.328 -13.586 -1.157 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -5.784 -13.166 -2.038 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -4.068 -14.601 -4.807 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -5.280 -14.862 -3.548 1.00 0.00 H new ATOM 909 N GLU A 63 -3.087 -11.501 0.394 1.00 0.00 N ATOM 910 CA GLU A 63 -1.833 -11.344 1.121 1.00 0.00 C ATOM 911 C GLU A 63 -0.685 -12.018 0.375 1.00 0.00 C ATOM 912 O GLU A 63 -0.868 -13.051 -0.267 1.00 0.00 O ATOM 913 CB GLU A 63 -1.956 -11.933 2.528 1.00 0.00 C ATOM 914 CG GLU A 63 -2.904 -11.160 3.430 1.00 0.00 C ATOM 915 CD GLU A 63 -4.329 -11.673 3.355 1.00 0.00 C ATOM 916 OE1 GLU A 63 -4.649 -12.398 2.391 1.00 0.00 O ATOM 917 OE2 GLU A 63 -5.124 -11.348 4.262 1.00 0.00 O ATOM 0 H GLU A 63 -3.876 -11.789 0.972 1.00 0.00 H new ATOM 0 HA GLU A 63 -1.618 -10.278 1.199 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -2.300 -12.965 2.452 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -0.969 -11.959 2.990 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -2.553 -11.224 4.460 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -2.886 -10.106 3.152 1.00 0.00 H new ATOM 924 N GLY A 64 0.502 -11.424 0.465 1.00 0.00 N ATOM 925 CA GLY A 64 1.662 -11.979 -0.206 1.00 0.00 C ATOM 926 C GLY A 64 2.108 -11.137 -1.385 1.00 0.00 C ATOM 927 O GLY A 64 3.302 -10.896 -1.568 1.00 0.00 O ATOM 0 H GLY A 64 0.680 -10.568 0.991 1.00 0.00 H new ATOM 0 HA2 GLY A 64 2.483 -12.065 0.506 1.00 0.00 H new ATOM 0 HA3 GLY A 64 1.431 -12.987 -0.550 1.00 0.00 H new ATOM 931 N ASP A 65 1.149 -10.690 -2.187 1.00 0.00 N ATOM 932 CA ASP A 65 1.449 -9.870 -3.355 1.00 0.00 C ATOM 933 C ASP A 65 2.582 -8.894 -3.057 1.00 0.00 C ATOM 934 O ASP A 65 2.489 -8.084 -2.136 1.00 0.00 O ATOM 935 CB ASP A 65 0.202 -9.104 -3.801 1.00 0.00 C ATOM 936 CG ASP A 65 -0.935 -10.026 -4.194 1.00 0.00 C ATOM 937 OD1 ASP A 65 -0.653 -11.165 -4.623 1.00 0.00 O ATOM 938 OD2 ASP A 65 -2.106 -9.610 -4.074 1.00 0.00 O ATOM 0 H ASP A 65 0.157 -10.882 -2.050 1.00 0.00 H new ATOM 0 HA ASP A 65 1.767 -10.531 -4.161 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -0.127 -8.450 -2.993 1.00 0.00 H new ATOM 0 HB3 ASP A 65 0.455 -8.464 -4.646 1.00 0.00 H new ATOM 943 N GLN A 66 3.651 -8.978 -3.843 1.00 0.00 N ATOM 944 CA GLN A 66 4.803 -8.103 -3.662 1.00 0.00 C ATOM 945 C GLN A 66 4.650 -6.826 -4.481 1.00 0.00 C ATOM 946 O GLN A 66 4.734 -6.850 -5.709 1.00 0.00 O ATOM 947 CB GLN A 66 6.089 -8.828 -4.061 1.00 0.00 C ATOM 948 CG GLN A 66 7.354 -8.056 -3.721 1.00 0.00 C ATOM 949 CD GLN A 66 8.602 -8.702 -4.288 1.00 0.00 C ATOM 950 OE1 GLN A 66 8.690 -9.926 -4.389 1.00 0.00 O ATOM 951 NE2 GLN A 66 9.577 -7.881 -4.661 1.00 0.00 N ATOM 0 H GLN A 66 3.743 -9.643 -4.611 1.00 0.00 H new ATOM 0 HA GLN A 66 4.860 -7.832 -2.608 1.00 0.00 H new ATOM 0 HB2 GLN A 66 6.120 -9.797 -3.562 1.00 0.00 H new ATOM 0 HB3 GLN A 66 6.069 -9.022 -5.133 1.00 0.00 H new ATOM 0 HG2 GLN A 66 7.269 -7.040 -4.105 1.00 0.00 H new ATOM 0 HG3 GLN A 66 7.449 -7.980 -2.638 1.00 0.00 H new ATOM 0 HE21 GLN A 66 9.461 -6.873 -4.559 1.00 0.00 H new ATOM 0 HE22 GLN A 66 10.441 -8.259 -5.049 1.00 0.00 H new ATOM 960 N VAL A 67 4.425 -5.711 -3.793 1.00 0.00 N ATOM 961 CA VAL A 67 4.261 -4.423 -4.457 1.00 0.00 C ATOM 962 C VAL A 67 5.608 -3.848 -4.882 1.00 0.00 C ATOM 963 O VAL A 67 6.417 -3.451 -4.044 1.00 0.00 O ATOM 964 CB VAL A 67 3.547 -3.408 -3.545 1.00 0.00 C ATOM 965 CG1 VAL A 67 3.379 -2.075 -4.257 1.00 0.00 C ATOM 966 CG2 VAL A 67 2.201 -3.954 -3.093 1.00 0.00 C ATOM 0 H VAL A 67 4.352 -5.674 -2.776 1.00 0.00 H new ATOM 0 HA VAL A 67 3.649 -4.599 -5.342 1.00 0.00 H new ATOM 0 HB VAL A 67 4.163 -3.244 -2.661 1.00 0.00 H new ATOM 0 HG11 VAL A 67 2.873 -1.371 -3.597 1.00 0.00 H new ATOM 0 HG12 VAL A 67 4.359 -1.680 -4.526 1.00 0.00 H new ATOM 0 HG13 VAL A 67 2.785 -2.217 -5.160 1.00 0.00 H new ATOM 0 HG21 VAL A 67 1.710 -3.224 -2.449 1.00 0.00 H new ATOM 0 HG22 VAL A 67 1.576 -4.148 -3.965 1.00 0.00 H new ATOM 0 HG23 VAL A 67 2.352 -4.882 -2.541 1.00 0.00 H new ATOM 976 N VAL A 68 5.841 -3.807 -6.189 1.00 0.00 N ATOM 977 CA VAL A 68 7.090 -3.279 -6.727 1.00 0.00 C ATOM 978 C VAL A 68 6.994 -1.776 -6.964 1.00 0.00 C ATOM 979 O VAL A 68 7.901 -1.022 -6.610 1.00 0.00 O ATOM 980 CB VAL A 68 7.470 -3.973 -8.048 1.00 0.00 C ATOM 981 CG1 VAL A 68 8.748 -3.376 -8.617 1.00 0.00 C ATOM 982 CG2 VAL A 68 7.619 -5.472 -7.838 1.00 0.00 C ATOM 0 H VAL A 68 5.182 -4.133 -6.896 1.00 0.00 H new ATOM 0 HA VAL A 68 7.864 -3.478 -5.985 1.00 0.00 H new ATOM 0 HB VAL A 68 6.669 -3.808 -8.769 1.00 0.00 H new ATOM 0 HG11 VAL A 68 9.001 -3.879 -9.550 1.00 0.00 H new ATOM 0 HG12 VAL A 68 8.600 -2.313 -8.806 1.00 0.00 H new ATOM 0 HG13 VAL A 68 9.561 -3.508 -7.903 1.00 0.00 H new ATOM 0 HG21 VAL A 68 7.888 -5.947 -8.782 1.00 0.00 H new ATOM 0 HG22 VAL A 68 8.400 -5.660 -7.102 1.00 0.00 H new ATOM 0 HG23 VAL A 68 6.676 -5.885 -7.480 1.00 0.00 H new ATOM 992 N LEU A 69 5.890 -1.347 -7.564 1.00 0.00 N ATOM 993 CA LEU A 69 5.674 0.068 -7.849 1.00 0.00 C ATOM 994 C LEU A 69 4.191 0.417 -7.783 1.00 0.00 C ATOM 995 O LEU A 69 3.333 -0.418 -8.072 1.00 0.00 O ATOM 996 CB LEU A 69 6.232 0.421 -9.229 1.00 0.00 C ATOM 997 CG LEU A 69 7.747 0.293 -9.394 1.00 0.00 C ATOM 998 CD1 LEU A 69 8.138 0.433 -10.856 1.00 0.00 C ATOM 999 CD2 LEU A 69 8.465 1.333 -8.546 1.00 0.00 C ATOM 0 H LEU A 69 5.130 -1.958 -7.863 1.00 0.00 H new ATOM 0 HA LEU A 69 6.199 0.650 -7.092 1.00 0.00 H new ATOM 0 HB2 LEU A 69 5.751 -0.220 -9.968 1.00 0.00 H new ATOM 0 HB3 LEU A 69 5.947 1.447 -9.463 1.00 0.00 H new ATOM 0 HG LEU A 69 8.048 -0.697 -9.052 1.00 0.00 H new ATOM 0 HD11 LEU A 69 9.220 0.339 -10.954 1.00 0.00 H new ATOM 0 HD12 LEU A 69 7.652 -0.349 -11.439 1.00 0.00 H new ATOM 0 HD13 LEU A 69 7.824 1.409 -11.225 1.00 0.00 H new ATOM 0 HD21 LEU A 69 9.542 1.227 -8.676 1.00 0.00 H new ATOM 0 HD22 LEU A 69 8.158 2.331 -8.858 1.00 0.00 H new ATOM 0 HD23 LEU A 69 8.210 1.186 -7.497 1.00 0.00 H new ATOM 1011 N ILE A 70 3.896 1.655 -7.402 1.00 0.00 N ATOM 1012 CA ILE A 70 2.517 2.115 -7.301 1.00 0.00 C ATOM 1013 C ILE A 70 2.270 3.316 -8.208 1.00 0.00 C ATOM 1014 O ILE A 70 2.929 4.347 -8.082 1.00 0.00 O ATOM 1015 CB ILE A 70 2.154 2.496 -5.853 1.00 0.00 C ATOM 1016 CG1 ILE A 70 2.252 1.271 -4.941 1.00 0.00 C ATOM 1017 CG2 ILE A 70 0.757 3.094 -5.797 1.00 0.00 C ATOM 1018 CD1 ILE A 70 2.334 1.618 -3.471 1.00 0.00 C ATOM 0 H ILE A 70 4.594 2.358 -7.158 1.00 0.00 H new ATOM 0 HA ILE A 70 1.884 1.286 -7.619 1.00 0.00 H new ATOM 0 HB ILE A 70 2.863 3.246 -5.501 1.00 0.00 H new ATOM 0 HG12 ILE A 70 1.384 0.633 -5.108 1.00 0.00 H new ATOM 0 HG13 ILE A 70 3.132 0.691 -5.219 1.00 0.00 H new ATOM 0 HG21 ILE A 70 0.515 3.358 -4.767 1.00 0.00 H new ATOM 0 HG22 ILE A 70 0.719 3.988 -6.419 1.00 0.00 H new ATOM 0 HG23 ILE A 70 0.034 2.365 -6.164 1.00 0.00 H new ATOM 0 HD11 ILE A 70 2.401 0.702 -2.884 1.00 0.00 H new ATOM 0 HD12 ILE A 70 3.218 2.230 -3.290 1.00 0.00 H new ATOM 0 HD13 ILE A 70 1.442 2.172 -3.178 1.00 0.00 H new ATOM 1030 N ASN A 71 1.314 3.175 -9.120 1.00 0.00 N ATOM 1031 CA ASN A 71 0.979 4.250 -10.048 1.00 0.00 C ATOM 1032 C ASN A 71 2.221 4.737 -10.788 1.00 0.00 C ATOM 1033 O ASN A 71 2.412 5.937 -10.977 1.00 0.00 O ATOM 1034 CB ASN A 71 0.328 5.414 -9.298 1.00 0.00 C ATOM 1035 CG ASN A 71 -1.181 5.281 -9.221 1.00 0.00 C ATOM 1036 OD1 ASN A 71 -1.916 6.129 -9.726 1.00 0.00 O ATOM 1037 ND2 ASN A 71 -1.649 4.213 -8.586 1.00 0.00 N ATOM 0 H ASN A 71 0.758 2.328 -9.237 1.00 0.00 H new ATOM 0 HA ASN A 71 0.273 3.858 -10.780 1.00 0.00 H new ATOM 0 HB2 ASN A 71 0.737 5.467 -8.289 1.00 0.00 H new ATOM 0 HB3 ASN A 71 0.583 6.350 -9.795 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -2.655 4.070 -8.502 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -1.002 3.535 -8.182 1.00 0.00 H new ATOM 1044 N GLY A 72 3.062 3.795 -11.205 1.00 0.00 N ATOM 1045 CA GLY A 72 4.275 4.148 -11.920 1.00 0.00 C ATOM 1046 C GLY A 72 5.143 5.119 -11.145 1.00 0.00 C ATOM 1047 O GLY A 72 5.795 5.983 -11.731 1.00 0.00 O ATOM 0 H GLY A 72 2.925 2.795 -11.061 1.00 0.00 H new ATOM 0 HA2 GLY A 72 4.846 3.243 -12.130 1.00 0.00 H new ATOM 0 HA3 GLY A 72 4.011 4.589 -12.881 1.00 0.00 H new ATOM 1051 N ARG A 73 5.151 4.978 -9.823 1.00 0.00 N ATOM 1052 CA ARG A 73 5.943 5.852 -8.967 1.00 0.00 C ATOM 1053 C ARG A 73 6.801 5.037 -8.003 1.00 0.00 C ATOM 1054 O ARG A 73 6.282 4.268 -7.193 1.00 0.00 O ATOM 1055 CB ARG A 73 5.031 6.796 -8.181 1.00 0.00 C ATOM 1056 CG ARG A 73 4.569 8.003 -8.981 1.00 0.00 C ATOM 1057 CD ARG A 73 5.641 9.081 -9.031 1.00 0.00 C ATOM 1058 NE ARG A 73 5.971 9.586 -7.700 1.00 0.00 N ATOM 1059 CZ ARG A 73 6.508 10.781 -7.480 1.00 0.00 C ATOM 1060 NH1 ARG A 73 6.773 11.590 -8.497 1.00 0.00 N ATOM 1061 NH2 ARG A 73 6.780 11.169 -6.241 1.00 0.00 N ATOM 0 H ARG A 73 4.618 4.267 -9.322 1.00 0.00 H new ATOM 0 HA ARG A 73 6.602 6.442 -9.604 1.00 0.00 H new ATOM 0 HB2 ARG A 73 4.157 6.242 -7.838 1.00 0.00 H new ATOM 0 HB3 ARG A 73 5.559 7.141 -7.292 1.00 0.00 H new ATOM 0 HG2 ARG A 73 4.315 7.694 -9.995 1.00 0.00 H new ATOM 0 HG3 ARG A 73 3.662 8.411 -8.535 1.00 0.00 H new ATOM 0 HD2 ARG A 73 6.539 8.678 -9.499 1.00 0.00 H new ATOM 0 HD3 ARG A 73 5.298 9.905 -9.657 1.00 0.00 H new ATOM 0 HE ARG A 73 5.779 8.988 -6.896 1.00 0.00 H new ATOM 0 HH11 ARG A 73 6.564 11.295 -9.451 1.00 0.00 H new ATOM 0 HH12 ARG A 73 7.185 12.507 -8.325 1.00 0.00 H new ATOM 0 HH21 ARG A 73 6.577 10.550 -5.456 1.00 0.00 H new ATOM 0 HH22 ARG A 73 7.192 12.087 -6.073 1.00 0.00 H new ATOM 1075 N ASP A 74 8.115 5.211 -8.097 1.00 0.00 N ATOM 1076 CA ASP A 74 9.044 4.492 -7.233 1.00 0.00 C ATOM 1077 C ASP A 74 8.592 4.553 -5.778 1.00 0.00 C ATOM 1078 O ASP A 74 8.479 5.633 -5.197 1.00 0.00 O ATOM 1079 CB ASP A 74 10.452 5.074 -7.367 1.00 0.00 C ATOM 1080 CG ASP A 74 11.124 4.671 -8.665 1.00 0.00 C ATOM 1081 OD1 ASP A 74 10.874 5.334 -9.694 1.00 0.00 O ATOM 1082 OD2 ASP A 74 11.901 3.694 -8.652 1.00 0.00 O ATOM 0 H ASP A 74 8.560 5.843 -8.762 1.00 0.00 H new ATOM 0 HA ASP A 74 9.059 3.448 -7.546 1.00 0.00 H new ATOM 0 HB2 ASP A 74 10.399 6.161 -7.311 1.00 0.00 H new ATOM 0 HB3 ASP A 74 11.061 4.741 -6.527 1.00 0.00 H new ATOM 1087 N ILE A 75 8.333 3.387 -5.195 1.00 0.00 N ATOM 1088 CA ILE A 75 7.893 3.309 -3.807 1.00 0.00 C ATOM 1089 C ILE A 75 8.925 2.592 -2.943 1.00 0.00 C ATOM 1090 O ILE A 75 9.087 2.905 -1.764 1.00 0.00 O ATOM 1091 CB ILE A 75 6.542 2.579 -3.686 1.00 0.00 C ATOM 1092 CG1 ILE A 75 6.659 1.151 -4.224 1.00 0.00 C ATOM 1093 CG2 ILE A 75 5.458 3.344 -4.430 1.00 0.00 C ATOM 1094 CD1 ILE A 75 7.065 0.141 -3.173 1.00 0.00 C ATOM 0 H ILE A 75 8.420 2.484 -5.662 1.00 0.00 H new ATOM 0 HA ILE A 75 7.776 4.334 -3.454 1.00 0.00 H new ATOM 0 HB ILE A 75 6.266 2.529 -2.633 1.00 0.00 H new ATOM 0 HG12 ILE A 75 5.702 0.853 -4.652 1.00 0.00 H new ATOM 0 HG13 ILE A 75 7.389 1.135 -5.033 1.00 0.00 H new ATOM 0 HG21 ILE A 75 4.509 2.816 -4.335 1.00 0.00 H new ATOM 0 HG22 ILE A 75 5.361 4.343 -4.005 1.00 0.00 H new ATOM 0 HG23 ILE A 75 5.726 3.422 -5.484 1.00 0.00 H new ATOM 0 HD11 ILE A 75 7.128 -0.849 -3.625 1.00 0.00 H new ATOM 0 HD12 ILE A 75 8.036 0.415 -2.761 1.00 0.00 H new ATOM 0 HD13 ILE A 75 6.323 0.129 -2.375 1.00 0.00 H new ATOM 1106 N ALA A 76 9.622 1.630 -3.538 1.00 0.00 N ATOM 1107 CA ALA A 76 10.642 0.872 -2.824 1.00 0.00 C ATOM 1108 C ALA A 76 11.548 1.795 -2.017 1.00 0.00 C ATOM 1109 O ALA A 76 11.826 1.538 -0.847 1.00 0.00 O ATOM 1110 CB ALA A 76 11.464 0.043 -3.801 1.00 0.00 C ATOM 0 H ALA A 76 9.499 1.357 -4.513 1.00 0.00 H new ATOM 0 HA ALA A 76 10.140 0.200 -2.128 1.00 0.00 H new ATOM 0 HB1 ALA A 76 12.222 -0.518 -3.254 1.00 0.00 H new ATOM 0 HB2 ALA A 76 10.810 -0.651 -4.330 1.00 0.00 H new ATOM 0 HB3 ALA A 76 11.949 0.703 -4.520 1.00 0.00 H new ATOM 1116 N GLU A 77 12.006 2.870 -2.652 1.00 0.00 N ATOM 1117 CA GLU A 77 12.883 3.830 -1.992 1.00 0.00 C ATOM 1118 C GLU A 77 12.178 4.487 -0.809 1.00 0.00 C ATOM 1119 O GLU A 77 12.814 4.862 0.177 1.00 0.00 O ATOM 1120 CB GLU A 77 13.343 4.900 -2.984 1.00 0.00 C ATOM 1121 CG GLU A 77 14.275 4.371 -4.061 1.00 0.00 C ATOM 1122 CD GLU A 77 15.670 4.089 -3.538 1.00 0.00 C ATOM 1123 OE1 GLU A 77 16.098 4.778 -2.588 1.00 0.00 O ATOM 1124 OE2 GLU A 77 16.334 3.179 -4.078 1.00 0.00 O ATOM 0 H GLU A 77 11.784 3.097 -3.621 1.00 0.00 H new ATOM 0 HA GLU A 77 13.754 3.291 -1.620 1.00 0.00 H new ATOM 0 HB2 GLU A 77 12.468 5.344 -3.459 1.00 0.00 H new ATOM 0 HB3 GLU A 77 13.848 5.697 -2.438 1.00 0.00 H new ATOM 0 HG2 GLU A 77 13.857 3.456 -4.481 1.00 0.00 H new ATOM 0 HG3 GLU A 77 14.335 5.096 -4.873 1.00 0.00 H new ATOM 1131 N HIS A 78 10.860 4.624 -0.915 1.00 0.00 N ATOM 1132 CA HIS A 78 10.067 5.235 0.146 1.00 0.00 C ATOM 1133 C HIS A 78 9.924 4.287 1.333 1.00 0.00 C ATOM 1134 O HIS A 78 10.185 3.089 1.219 1.00 0.00 O ATOM 1135 CB HIS A 78 8.686 5.625 -0.381 1.00 0.00 C ATOM 1136 CG HIS A 78 8.637 6.998 -0.977 1.00 0.00 C ATOM 1137 ND1 HIS A 78 7.888 7.308 -2.092 1.00 0.00 N ATOM 1138 CD2 HIS A 78 9.249 8.147 -0.605 1.00 0.00 C ATOM 1139 CE1 HIS A 78 8.042 8.588 -2.381 1.00 0.00 C ATOM 1140 NE2 HIS A 78 8.863 9.120 -1.493 1.00 0.00 N ATOM 0 H HIS A 78 10.319 4.320 -1.724 1.00 0.00 H new ATOM 0 HA HIS A 78 10.586 6.133 0.482 1.00 0.00 H new ATOM 0 HB2 HIS A 78 8.376 4.900 -1.134 1.00 0.00 H new ATOM 0 HB3 HIS A 78 7.965 5.566 0.435 1.00 0.00 H new ATOM 0 HD2 HIS A 78 9.917 8.274 0.234 1.00 0.00 H new ATOM 0 HE1 HIS A 78 7.576 9.111 -3.203 1.00 0.00 H new ATOM 0 HE2 HIS A 78 9.161 10.095 -1.471 1.00 0.00 H new ATOM 1149 N THR A 79 9.508 4.832 2.472 1.00 0.00 N ATOM 1150 CA THR A 79 9.331 4.035 3.680 1.00 0.00 C ATOM 1151 C THR A 79 7.858 3.739 3.933 1.00 0.00 C ATOM 1152 O THR A 79 6.982 4.508 3.534 1.00 0.00 O ATOM 1153 CB THR A 79 9.919 4.747 4.913 1.00 0.00 C ATOM 1154 OG1 THR A 79 9.518 6.122 4.922 1.00 0.00 O ATOM 1155 CG2 THR A 79 11.438 4.656 4.918 1.00 0.00 C ATOM 0 H THR A 79 9.287 5.822 2.583 1.00 0.00 H new ATOM 0 HA THR A 79 9.864 3.098 3.521 1.00 0.00 H new ATOM 0 HB THR A 79 9.539 4.252 5.807 1.00 0.00 H new ATOM 0 HG1 THR A 79 9.894 6.567 5.710 1.00 0.00 H new ATOM 0 HG21 THR A 79 11.830 5.166 5.798 1.00 0.00 H new ATOM 0 HG22 THR A 79 11.740 3.609 4.941 1.00 0.00 H new ATOM 0 HG23 THR A 79 11.834 5.128 4.019 1.00 0.00 H new ATOM 1163 N HIS A 80 7.589 2.620 4.598 1.00 0.00 N ATOM 1164 CA HIS A 80 6.220 2.223 4.905 1.00 0.00 C ATOM 1165 C HIS A 80 5.365 3.439 5.247 1.00 0.00 C ATOM 1166 O HIS A 80 4.414 3.761 4.535 1.00 0.00 O ATOM 1167 CB HIS A 80 6.203 1.230 6.068 1.00 0.00 C ATOM 1168 CG HIS A 80 4.846 1.036 6.670 1.00 0.00 C ATOM 1169 ND1 HIS A 80 4.153 -0.154 6.596 1.00 0.00 N ATOM 1170 CD2 HIS A 80 4.053 1.888 7.361 1.00 0.00 C ATOM 1171 CE1 HIS A 80 2.992 -0.025 7.214 1.00 0.00 C ATOM 1172 NE2 HIS A 80 2.907 1.205 7.687 1.00 0.00 N ATOM 0 H HIS A 80 8.301 1.972 4.935 1.00 0.00 H new ATOM 0 HA HIS A 80 5.801 1.743 4.021 1.00 0.00 H new ATOM 0 HB2 HIS A 80 6.577 0.268 5.719 1.00 0.00 H new ATOM 0 HB3 HIS A 80 6.888 1.577 6.841 1.00 0.00 H new ATOM 0 HD2 HIS A 80 4.279 2.914 7.610 1.00 0.00 H new ATOM 0 HE1 HIS A 80 2.241 -0.794 7.315 1.00 0.00 H new ATOM 0 HE2 HIS A 80 2.118 1.586 8.210 1.00 0.00 H new ATOM 1181 N ASP A 81 5.710 4.111 6.340 1.00 0.00 N ATOM 1182 CA ASP A 81 4.975 5.292 6.776 1.00 0.00 C ATOM 1183 C ASP A 81 4.548 6.138 5.581 1.00 0.00 C ATOM 1184 O ASP A 81 3.449 6.691 5.561 1.00 0.00 O ATOM 1185 CB ASP A 81 5.830 6.128 7.730 1.00 0.00 C ATOM 1186 CG ASP A 81 6.252 5.351 8.961 1.00 0.00 C ATOM 1187 OD1 ASP A 81 5.455 5.281 9.920 1.00 0.00 O ATOM 1188 OD2 ASP A 81 7.380 4.814 8.967 1.00 0.00 O ATOM 0 H ASP A 81 6.495 3.858 6.940 1.00 0.00 H new ATOM 0 HA ASP A 81 4.080 4.959 7.301 1.00 0.00 H new ATOM 0 HB2 ASP A 81 6.718 6.480 7.204 1.00 0.00 H new ATOM 0 HB3 ASP A 81 5.270 7.011 8.036 1.00 0.00 H new ATOM 1193 N GLN A 82 5.426 6.236 4.588 1.00 0.00 N ATOM 1194 CA GLN A 82 5.140 7.016 3.390 1.00 0.00 C ATOM 1195 C GLN A 82 4.255 6.232 2.427 1.00 0.00 C ATOM 1196 O GLN A 82 3.168 6.678 2.062 1.00 0.00 O ATOM 1197 CB GLN A 82 6.442 7.417 2.694 1.00 0.00 C ATOM 1198 CG GLN A 82 6.237 7.981 1.297 1.00 0.00 C ATOM 1199 CD GLN A 82 5.955 9.470 1.305 1.00 0.00 C ATOM 1200 OE1 GLN A 82 6.422 10.197 2.182 1.00 0.00 O ATOM 1201 NE2 GLN A 82 5.189 9.933 0.324 1.00 0.00 N ATOM 0 H GLN A 82 6.341 5.785 4.590 1.00 0.00 H new ATOM 0 HA GLN A 82 4.606 7.917 3.693 1.00 0.00 H new ATOM 0 HB2 GLN A 82 6.957 8.159 3.304 1.00 0.00 H new ATOM 0 HB3 GLN A 82 7.095 6.546 2.633 1.00 0.00 H new ATOM 0 HG2 GLN A 82 7.126 7.787 0.697 1.00 0.00 H new ATOM 0 HG3 GLN A 82 5.408 7.461 0.817 1.00 0.00 H new ATOM 0 HE21 GLN A 82 4.823 9.294 -0.382 1.00 0.00 H new ATOM 0 HE22 GLN A 82 4.967 10.927 0.277 1.00 0.00 H new ATOM 1210 N VAL A 83 4.729 5.059 2.018 1.00 0.00 N ATOM 1211 CA VAL A 83 3.981 4.211 1.097 1.00 0.00 C ATOM 1212 C VAL A 83 2.497 4.196 1.447 1.00 0.00 C ATOM 1213 O VAL A 83 1.639 4.253 0.566 1.00 0.00 O ATOM 1214 CB VAL A 83 4.514 2.766 1.105 1.00 0.00 C ATOM 1215 CG1 VAL A 83 3.605 1.857 0.292 1.00 0.00 C ATOM 1216 CG2 VAL A 83 5.939 2.722 0.575 1.00 0.00 C ATOM 0 H VAL A 83 5.627 4.674 2.310 1.00 0.00 H new ATOM 0 HA VAL A 83 4.112 4.633 0.101 1.00 0.00 H new ATOM 0 HB VAL A 83 4.522 2.405 2.133 1.00 0.00 H new ATOM 0 HG11 VAL A 83 3.998 0.840 0.309 1.00 0.00 H new ATOM 0 HG12 VAL A 83 2.603 1.866 0.721 1.00 0.00 H new ATOM 0 HG13 VAL A 83 3.562 2.212 -0.738 1.00 0.00 H new ATOM 0 HG21 VAL A 83 6.300 1.694 0.588 1.00 0.00 H new ATOM 0 HG22 VAL A 83 5.959 3.101 -0.447 1.00 0.00 H new ATOM 0 HG23 VAL A 83 6.580 3.340 1.204 1.00 0.00 H new ATOM 1226 N VAL A 84 2.201 4.118 2.741 1.00 0.00 N ATOM 1227 CA VAL A 84 0.820 4.096 3.209 1.00 0.00 C ATOM 1228 C VAL A 84 0.070 5.348 2.767 1.00 0.00 C ATOM 1229 O VAL A 84 -0.953 5.264 2.086 1.00 0.00 O ATOM 1230 CB VAL A 84 0.749 3.984 4.743 1.00 0.00 C ATOM 1231 CG1 VAL A 84 -0.697 4.002 5.214 1.00 0.00 C ATOM 1232 CG2 VAL A 84 1.458 2.724 5.218 1.00 0.00 C ATOM 0 H VAL A 84 2.899 4.069 3.483 1.00 0.00 H new ATOM 0 HA VAL A 84 0.350 3.218 2.766 1.00 0.00 H new ATOM 0 HB VAL A 84 1.257 4.845 5.177 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -0.727 3.922 6.301 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -1.168 4.935 4.906 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -1.234 3.162 4.773 1.00 0.00 H new ATOM 0 HG21 VAL A 84 1.398 2.661 6.305 1.00 0.00 H new ATOM 0 HG22 VAL A 84 0.980 1.849 4.777 1.00 0.00 H new ATOM 0 HG23 VAL A 84 2.504 2.758 4.914 1.00 0.00 H new ATOM 1242 N LEU A 85 0.586 6.508 3.157 1.00 0.00 N ATOM 1243 CA LEU A 85 -0.034 7.779 2.801 1.00 0.00 C ATOM 1244 C LEU A 85 -0.082 7.956 1.286 1.00 0.00 C ATOM 1245 O LEU A 85 -1.129 8.271 0.720 1.00 0.00 O ATOM 1246 CB LEU A 85 0.733 8.940 3.437 1.00 0.00 C ATOM 1247 CG LEU A 85 0.243 9.394 4.812 1.00 0.00 C ATOM 1248 CD1 LEU A 85 0.835 8.519 5.906 1.00 0.00 C ATOM 1249 CD2 LEU A 85 0.594 10.856 5.048 1.00 0.00 C ATOM 0 H LEU A 85 1.432 6.595 3.720 1.00 0.00 H new ATOM 0 HA LEU A 85 -1.056 7.775 3.181 1.00 0.00 H new ATOM 0 HB2 LEU A 85 1.781 8.653 3.523 1.00 0.00 H new ATOM 0 HB3 LEU A 85 0.691 9.792 2.759 1.00 0.00 H new ATOM 0 HG LEU A 85 -0.842 9.292 4.841 1.00 0.00 H new ATOM 0 HD11 LEU A 85 0.475 8.857 6.877 1.00 0.00 H new ATOM 0 HD12 LEU A 85 0.533 7.484 5.747 1.00 0.00 H new ATOM 0 HD13 LEU A 85 1.922 8.588 5.878 1.00 0.00 H new ATOM 0 HD21 LEU A 85 0.237 11.162 6.032 1.00 0.00 H new ATOM 0 HD22 LEU A 85 1.675 10.983 4.998 1.00 0.00 H new ATOM 0 HD23 LEU A 85 0.121 11.472 4.283 1.00 0.00 H new ATOM 1261 N PHE A 86 1.058 7.750 0.635 1.00 0.00 N ATOM 1262 CA PHE A 86 1.146 7.885 -0.814 1.00 0.00 C ATOM 1263 C PHE A 86 -0.118 7.358 -1.487 1.00 0.00 C ATOM 1264 O PHE A 86 -0.676 8.004 -2.375 1.00 0.00 O ATOM 1265 CB PHE A 86 2.370 7.136 -1.344 1.00 0.00 C ATOM 1266 CG PHE A 86 2.714 7.478 -2.765 1.00 0.00 C ATOM 1267 CD1 PHE A 86 2.974 8.789 -3.133 1.00 0.00 C ATOM 1268 CD2 PHE A 86 2.775 6.490 -3.734 1.00 0.00 C ATOM 1269 CE1 PHE A 86 3.291 9.107 -4.440 1.00 0.00 C ATOM 1270 CE2 PHE A 86 3.092 6.802 -5.043 1.00 0.00 C ATOM 1271 CZ PHE A 86 3.349 8.112 -5.397 1.00 0.00 C ATOM 0 H PHE A 86 1.934 7.489 1.088 1.00 0.00 H new ATOM 0 HA PHE A 86 1.247 8.944 -1.050 1.00 0.00 H new ATOM 0 HB2 PHE A 86 3.226 7.360 -0.708 1.00 0.00 H new ATOM 0 HB3 PHE A 86 2.190 6.064 -1.270 1.00 0.00 H new ATOM 0 HD1 PHE A 86 2.928 9.571 -2.390 1.00 0.00 H new ATOM 0 HD2 PHE A 86 2.573 5.464 -3.464 1.00 0.00 H new ATOM 0 HE1 PHE A 86 3.493 10.132 -4.713 1.00 0.00 H new ATOM 0 HE2 PHE A 86 3.139 6.022 -5.788 1.00 0.00 H new ATOM 0 HZ PHE A 86 3.595 8.358 -6.419 1.00 0.00 H new ATOM 1281 N ILE A 87 -0.562 6.181 -1.059 1.00 0.00 N ATOM 1282 CA ILE A 87 -1.759 5.567 -1.620 1.00 0.00 C ATOM 1283 C ILE A 87 -3.008 6.360 -1.251 1.00 0.00 C ATOM 1284 O ILE A 87 -3.803 6.726 -2.116 1.00 0.00 O ATOM 1285 CB ILE A 87 -1.925 4.114 -1.137 1.00 0.00 C ATOM 1286 CG1 ILE A 87 -0.684 3.291 -1.488 1.00 0.00 C ATOM 1287 CG2 ILE A 87 -3.171 3.492 -1.749 1.00 0.00 C ATOM 1288 CD1 ILE A 87 -0.519 2.053 -0.635 1.00 0.00 C ATOM 0 H ILE A 87 -0.111 5.634 -0.326 1.00 0.00 H new ATOM 0 HA ILE A 87 -1.637 5.569 -2.703 1.00 0.00 H new ATOM 0 HB ILE A 87 -2.039 4.118 -0.053 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -0.738 2.996 -2.536 1.00 0.00 H new ATOM 0 HG13 ILE A 87 0.201 3.918 -1.379 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -3.275 2.465 -1.398 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -4.048 4.067 -1.452 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -3.084 3.497 -2.836 1.00 0.00 H new ATOM 0 HD11 ILE A 87 0.381 1.519 -0.939 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -0.433 2.342 0.413 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -1.386 1.405 -0.762 1.00 0.00 H new ATOM 1300 N LYS A 88 -3.173 6.625 0.041 1.00 0.00 N ATOM 1301 CA LYS A 88 -4.323 7.378 0.526 1.00 0.00 C ATOM 1302 C LYS A 88 -4.478 8.689 -0.238 1.00 0.00 C ATOM 1303 O LYS A 88 -5.590 9.096 -0.572 1.00 0.00 O ATOM 1304 CB LYS A 88 -4.178 7.662 2.023 1.00 0.00 C ATOM 1305 CG LYS A 88 -4.570 6.490 2.906 1.00 0.00 C ATOM 1306 CD LYS A 88 -4.598 6.882 4.374 1.00 0.00 C ATOM 1307 CE LYS A 88 -3.196 6.951 4.959 1.00 0.00 C ATOM 1308 NZ LYS A 88 -3.217 6.975 6.448 1.00 0.00 N ATOM 0 H LYS A 88 -2.525 6.329 0.771 1.00 0.00 H new ATOM 0 HA LYS A 88 -5.216 6.775 0.361 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -3.144 7.935 2.234 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -4.794 8.523 2.282 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -5.552 6.121 2.608 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -3.865 5.672 2.760 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -5.087 7.850 4.484 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -5.192 6.159 4.934 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -2.617 6.093 4.618 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -2.691 7.843 4.588 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -2.243 7.022 6.808 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -3.747 7.808 6.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -3.676 6.112 6.803 1.00 0.00 H new ATOM 1322 N ALA A 89 -3.355 9.345 -0.513 1.00 0.00 N ATOM 1323 CA ALA A 89 -3.366 10.607 -1.241 1.00 0.00 C ATOM 1324 C ALA A 89 -4.355 10.564 -2.401 1.00 0.00 C ATOM 1325 O ALA A 89 -5.095 11.519 -2.634 1.00 0.00 O ATOM 1326 CB ALA A 89 -1.969 10.936 -1.747 1.00 0.00 C ATOM 0 H ALA A 89 -2.426 9.023 -0.242 1.00 0.00 H new ATOM 0 HA ALA A 89 -3.686 11.391 -0.555 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -1.992 11.881 -2.289 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -1.286 11.019 -0.902 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -1.627 10.144 -2.413 1.00 0.00 H new ATOM 1332 N SER A 90 -4.361 9.449 -3.126 1.00 0.00 N ATOM 1333 CA SER A 90 -5.256 9.283 -4.265 1.00 0.00 C ATOM 1334 C SER A 90 -6.617 9.914 -3.982 1.00 0.00 C ATOM 1335 O SER A 90 -7.231 10.513 -4.866 1.00 0.00 O ATOM 1336 CB SER A 90 -5.427 7.799 -4.594 1.00 0.00 C ATOM 1337 OG SER A 90 -5.882 7.621 -5.924 1.00 0.00 O ATOM 0 H SER A 90 -3.756 8.648 -2.944 1.00 0.00 H new ATOM 0 HA SER A 90 -4.812 9.788 -5.122 1.00 0.00 H new ATOM 0 HB2 SER A 90 -4.477 7.281 -4.459 1.00 0.00 H new ATOM 0 HB3 SER A 90 -6.137 7.349 -3.900 1.00 0.00 H new ATOM 0 HG SER A 90 -6.459 8.372 -6.176 1.00 0.00 H new ATOM 1343 N CYS A 91 -7.081 9.773 -2.746 1.00 0.00 N ATOM 1344 CA CYS A 91 -8.370 10.328 -2.346 1.00 0.00 C ATOM 1345 C CYS A 91 -8.544 11.744 -2.886 1.00 0.00 C ATOM 1346 O CYS A 91 -9.588 12.082 -3.441 1.00 0.00 O ATOM 1347 CB CYS A 91 -8.496 10.331 -0.822 1.00 0.00 C ATOM 1348 SG CYS A 91 -10.001 11.123 -0.207 1.00 0.00 S ATOM 0 H CYS A 91 -6.585 9.280 -2.004 1.00 0.00 H new ATOM 0 HA CYS A 91 -9.155 9.700 -2.767 1.00 0.00 H new ATOM 0 HB2 CYS A 91 -8.467 9.302 -0.464 1.00 0.00 H new ATOM 0 HB3 CYS A 91 -7.631 10.840 -0.398 1.00 0.00 H new ATOM 0 HG CYS A 91 -10.018 11.074 1.092 1.00 0.00 H new ATOM 1354 N GLU A 92 -7.513 12.567 -2.717 1.00 0.00 N ATOM 1355 CA GLU A 92 -7.554 13.947 -3.185 1.00 0.00 C ATOM 1356 C GLU A 92 -8.354 14.059 -4.480 1.00 0.00 C ATOM 1357 O GLU A 92 -9.066 15.038 -4.699 1.00 0.00 O ATOM 1358 CB GLU A 92 -6.135 14.478 -3.401 1.00 0.00 C ATOM 1359 CG GLU A 92 -5.439 13.878 -4.611 1.00 0.00 C ATOM 1360 CD GLU A 92 -4.196 14.649 -5.011 1.00 0.00 C ATOM 1361 OE1 GLU A 92 -3.524 15.198 -4.113 1.00 0.00 O ATOM 1362 OE2 GLU A 92 -3.896 14.703 -6.222 1.00 0.00 O ATOM 0 H GLU A 92 -6.641 12.302 -2.260 1.00 0.00 H new ATOM 0 HA GLU A 92 -8.047 14.548 -2.421 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -6.175 15.561 -3.515 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -5.540 14.273 -2.511 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -5.167 12.845 -4.394 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -6.134 13.855 -5.451 1.00 0.00 H new ATOM 1369 N ARG A 93 -8.229 13.048 -5.335 1.00 0.00 N ATOM 1370 CA ARG A 93 -8.937 13.033 -6.608 1.00 0.00 C ATOM 1371 C ARG A 93 -9.849 11.814 -6.709 1.00 0.00 C ATOM 1372 O ARG A 93 -9.470 10.708 -6.321 1.00 0.00 O ATOM 1373 CB ARG A 93 -7.942 13.037 -7.770 1.00 0.00 C ATOM 1374 CG ARG A 93 -6.994 11.849 -7.763 1.00 0.00 C ATOM 1375 CD ARG A 93 -5.721 12.147 -8.540 1.00 0.00 C ATOM 1376 NE ARG A 93 -5.931 12.074 -9.984 1.00 0.00 N ATOM 1377 CZ ARG A 93 -4.958 11.841 -10.857 1.00 0.00 C ATOM 1378 NH1 ARG A 93 -3.714 11.659 -10.435 1.00 0.00 N ATOM 1379 NH2 ARG A 93 -5.228 11.788 -12.155 1.00 0.00 N ATOM 0 H ARG A 93 -7.644 12.229 -5.168 1.00 0.00 H new ATOM 0 HA ARG A 93 -9.552 13.931 -6.663 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -8.494 13.045 -8.710 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -7.359 13.957 -7.735 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -6.742 11.590 -6.735 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -7.492 10.982 -8.197 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -5.360 13.141 -8.276 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -4.945 11.438 -8.250 1.00 0.00 H new ATOM 0 HE ARG A 93 -6.877 12.209 -10.341 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -3.503 11.698 -9.438 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -2.968 11.480 -11.108 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -6.184 11.926 -12.483 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -4.480 11.609 -12.825 1.00 0.00 H new ATOM 1393 N HIS A 94 -11.053 12.022 -7.233 1.00 0.00 N ATOM 1394 CA HIS A 94 -12.019 10.940 -7.384 1.00 0.00 C ATOM 1395 C HIS A 94 -12.036 10.425 -8.821 1.00 0.00 C ATOM 1396 O HIS A 94 -11.906 9.225 -9.062 1.00 0.00 O ATOM 1397 CB HIS A 94 -13.416 11.415 -6.983 1.00 0.00 C ATOM 1398 CG HIS A 94 -13.448 12.142 -5.675 1.00 0.00 C ATOM 1399 ND1 HIS A 94 -13.713 13.491 -5.570 1.00 0.00 N ATOM 1400 CD2 HIS A 94 -13.249 11.701 -4.411 1.00 0.00 C ATOM 1401 CE1 HIS A 94 -13.674 13.848 -4.299 1.00 0.00 C ATOM 1402 NE2 HIS A 94 -13.394 12.780 -3.574 1.00 0.00 N ATOM 0 H HIS A 94 -11.383 12.930 -7.560 1.00 0.00 H new ATOM 0 HA HIS A 94 -11.719 10.123 -6.727 1.00 0.00 H new ATOM 0 HB2 HIS A 94 -13.806 12.069 -7.763 1.00 0.00 H new ATOM 0 HB3 HIS A 94 -14.082 10.554 -6.927 1.00 0.00 H new ATOM 0 HD2 HIS A 94 -13.019 10.688 -4.115 1.00 0.00 H new ATOM 0 HE1 HIS A 94 -13.842 14.844 -3.917 1.00 0.00 H new ATOM 0 HE2 HIS A 94 -13.301 12.760 -2.558 1.00 0.00 H new ATOM 1411 N SER A 95 -12.199 11.341 -9.770 1.00 0.00 N ATOM 1412 CA SER A 95 -12.238 10.978 -11.182 1.00 0.00 C ATOM 1413 C SER A 95 -10.946 10.284 -11.601 1.00 0.00 C ATOM 1414 O SER A 95 -9.990 10.931 -12.028 1.00 0.00 O ATOM 1415 CB SER A 95 -12.464 12.222 -12.044 1.00 0.00 C ATOM 1416 OG SER A 95 -13.832 12.594 -12.053 1.00 0.00 O ATOM 0 H SER A 95 -12.306 12.339 -9.587 1.00 0.00 H new ATOM 0 HA SER A 95 -13.067 10.286 -11.331 1.00 0.00 H new ATOM 0 HB2 SER A 95 -11.862 13.047 -11.663 1.00 0.00 H new ATOM 0 HB3 SER A 95 -12.130 12.028 -13.063 1.00 0.00 H new ATOM 0 HG SER A 95 -13.950 13.392 -12.609 1.00 0.00 H new ATOM 1422 N GLY A 96 -10.924 8.961 -11.476 1.00 0.00 N ATOM 1423 CA GLY A 96 -9.745 8.199 -11.845 1.00 0.00 C ATOM 1424 C GLY A 96 -9.705 6.836 -11.183 1.00 0.00 C ATOM 1425 O GLY A 96 -10.613 6.475 -10.436 1.00 0.00 O ATOM 0 H GLY A 96 -11.702 8.403 -11.125 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -9.721 8.075 -12.928 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -8.852 8.760 -11.569 1.00 0.00 H new ATOM 1429 N GLU A 97 -8.649 6.077 -11.459 1.00 0.00 N ATOM 1430 CA GLU A 97 -8.495 4.745 -10.886 1.00 0.00 C ATOM 1431 C GLU A 97 -7.108 4.573 -10.274 1.00 0.00 C ATOM 1432 O GLU A 97 -6.240 5.434 -10.422 1.00 0.00 O ATOM 1433 CB GLU A 97 -8.730 3.676 -11.954 1.00 0.00 C ATOM 1434 CG GLU A 97 -7.703 3.699 -13.074 1.00 0.00 C ATOM 1435 CD GLU A 97 -7.497 2.335 -13.704 1.00 0.00 C ATOM 1436 OE1 GLU A 97 -7.474 1.334 -12.959 1.00 0.00 O ATOM 1437 OE2 GLU A 97 -7.358 2.270 -14.944 1.00 0.00 O ATOM 0 H GLU A 97 -7.888 6.362 -12.076 1.00 0.00 H new ATOM 0 HA GLU A 97 -9.238 4.629 -10.097 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -8.718 2.694 -11.482 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -9.724 3.813 -12.381 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -8.023 4.405 -13.841 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -6.752 4.062 -12.683 1.00 0.00 H new ATOM 1444 N LEU A 98 -6.907 3.455 -9.585 1.00 0.00 N ATOM 1445 CA LEU A 98 -5.626 3.168 -8.949 1.00 0.00 C ATOM 1446 C LEU A 98 -4.964 1.949 -9.583 1.00 0.00 C ATOM 1447 O LEU A 98 -5.596 0.907 -9.757 1.00 0.00 O ATOM 1448 CB LEU A 98 -5.819 2.935 -7.449 1.00 0.00 C ATOM 1449 CG LEU A 98 -4.553 2.989 -6.593 1.00 0.00 C ATOM 1450 CD1 LEU A 98 -4.216 4.427 -6.230 1.00 0.00 C ATOM 1451 CD2 LEU A 98 -4.722 2.146 -5.338 1.00 0.00 C ATOM 0 H LEU A 98 -7.615 2.732 -9.453 1.00 0.00 H new ATOM 0 HA LEU A 98 -4.975 4.030 -9.096 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -6.520 3.680 -7.073 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -6.286 1.960 -7.310 1.00 0.00 H new ATOM 0 HG LEU A 98 -3.727 2.579 -7.173 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -3.312 4.446 -5.621 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -4.052 5.003 -7.141 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -5.042 4.863 -5.668 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -3.812 2.196 -4.741 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -5.560 2.526 -4.754 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -4.915 1.111 -5.618 1.00 0.00 H new ATOM 1463 N MET A 99 -3.687 2.086 -9.925 1.00 0.00 N ATOM 1464 CA MET A 99 -2.939 0.993 -10.537 1.00 0.00 C ATOM 1465 C MET A 99 -1.751 0.595 -9.668 1.00 0.00 C ATOM 1466 O MET A 99 -1.008 1.450 -9.183 1.00 0.00 O ATOM 1467 CB MET A 99 -2.454 1.397 -11.931 1.00 0.00 C ATOM 1468 CG MET A 99 -3.582 1.657 -12.915 1.00 0.00 C ATOM 1469 SD MET A 99 -2.989 2.256 -14.509 1.00 0.00 S ATOM 1470 CE MET A 99 -3.661 1.012 -15.610 1.00 0.00 C ATOM 0 H MET A 99 -3.149 2.942 -9.789 1.00 0.00 H new ATOM 0 HA MET A 99 -3.605 0.135 -10.627 1.00 0.00 H new ATOM 0 HB2 MET A 99 -1.842 2.295 -11.848 1.00 0.00 H new ATOM 0 HB3 MET A 99 -1.813 0.609 -12.326 1.00 0.00 H new ATOM 0 HG2 MET A 99 -4.148 0.737 -13.064 1.00 0.00 H new ATOM 0 HG3 MET A 99 -4.269 2.388 -12.489 1.00 0.00 H new ATOM 0 HE1 MET A 99 -3.471 1.300 -16.644 1.00 0.00 H new ATOM 0 HE2 MET A 99 -3.186 0.052 -15.408 1.00 0.00 H new ATOM 0 HE3 MET A 99 -4.736 0.926 -15.449 1.00 0.00 H new ATOM 1480 N LEU A 100 -1.576 -0.708 -9.474 1.00 0.00 N ATOM 1481 CA LEU A 100 -0.477 -1.220 -8.663 1.00 0.00 C ATOM 1482 C LEU A 100 0.241 -2.361 -9.376 1.00 0.00 C ATOM 1483 O LEU A 100 -0.393 -3.292 -9.875 1.00 0.00 O ATOM 1484 CB LEU A 100 -0.998 -1.698 -7.306 1.00 0.00 C ATOM 1485 CG LEU A 100 -1.864 -0.704 -6.532 1.00 0.00 C ATOM 1486 CD1 LEU A 100 -2.832 -1.439 -5.618 1.00 0.00 C ATOM 1487 CD2 LEU A 100 -0.993 0.252 -5.731 1.00 0.00 C ATOM 0 H LEU A 100 -2.181 -1.429 -9.867 1.00 0.00 H new ATOM 0 HA LEU A 100 0.235 -0.409 -8.507 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -1.576 -2.609 -7.462 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -0.143 -1.965 -6.685 1.00 0.00 H new ATOM 0 HG LEU A 100 -2.443 -0.122 -7.248 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -3.440 -0.716 -5.075 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -3.479 -2.082 -6.215 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -2.271 -2.047 -4.908 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -1.627 0.952 -5.187 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -0.387 -0.314 -5.024 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -0.341 0.804 -6.408 1.00 0.00 H new ATOM 1499 N LEU A 101 1.566 -2.285 -9.419 1.00 0.00 N ATOM 1500 CA LEU A 101 2.372 -3.313 -10.069 1.00 0.00 C ATOM 1501 C LEU A 101 2.933 -4.293 -9.044 1.00 0.00 C ATOM 1502 O LEU A 101 3.882 -3.980 -8.325 1.00 0.00 O ATOM 1503 CB LEU A 101 3.515 -2.671 -10.857 1.00 0.00 C ATOM 1504 CG LEU A 101 4.178 -3.552 -11.916 1.00 0.00 C ATOM 1505 CD1 LEU A 101 3.179 -3.927 -13.000 1.00 0.00 C ATOM 1506 CD2 LEU A 101 5.383 -2.846 -12.519 1.00 0.00 C ATOM 0 H LEU A 101 2.106 -1.522 -9.011 1.00 0.00 H new ATOM 0 HA LEU A 101 1.730 -3.863 -10.757 1.00 0.00 H new ATOM 0 HB2 LEU A 101 3.134 -1.774 -11.346 1.00 0.00 H new ATOM 0 HB3 LEU A 101 4.280 -2.348 -10.151 1.00 0.00 H new ATOM 0 HG LEU A 101 4.522 -4.468 -11.436 1.00 0.00 H new ATOM 0 HD11 LEU A 101 3.669 -4.554 -13.745 1.00 0.00 H new ATOM 0 HD12 LEU A 101 2.348 -4.474 -12.555 1.00 0.00 H new ATOM 0 HD13 LEU A 101 2.804 -3.022 -13.478 1.00 0.00 H new ATOM 0 HD21 LEU A 101 5.842 -3.488 -13.271 1.00 0.00 H new ATOM 0 HD22 LEU A 101 5.063 -1.914 -12.984 1.00 0.00 H new ATOM 0 HD23 LEU A 101 6.108 -2.630 -11.735 1.00 0.00 H new ATOM 1518 N VAL A 102 2.342 -5.483 -8.985 1.00 0.00 N ATOM 1519 CA VAL A 102 2.785 -6.511 -8.051 1.00 0.00 C ATOM 1520 C VAL A 102 3.490 -7.649 -8.781 1.00 0.00 C ATOM 1521 O VAL A 102 3.292 -7.848 -9.979 1.00 0.00 O ATOM 1522 CB VAL A 102 1.604 -7.085 -7.246 1.00 0.00 C ATOM 1523 CG1 VAL A 102 0.846 -5.970 -6.542 1.00 0.00 C ATOM 1524 CG2 VAL A 102 0.678 -7.880 -8.154 1.00 0.00 C ATOM 0 H VAL A 102 1.555 -5.758 -9.573 1.00 0.00 H new ATOM 0 HA VAL A 102 3.485 -6.035 -7.364 1.00 0.00 H new ATOM 0 HB VAL A 102 1.998 -7.760 -6.486 1.00 0.00 H new ATOM 0 HG11 VAL A 102 0.015 -6.394 -5.978 1.00 0.00 H new ATOM 0 HG12 VAL A 102 1.517 -5.447 -5.861 1.00 0.00 H new ATOM 0 HG13 VAL A 102 0.461 -5.268 -7.282 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -0.151 -8.279 -7.569 1.00 0.00 H new ATOM 0 HG22 VAL A 102 0.290 -7.229 -8.937 1.00 0.00 H new ATOM 0 HG23 VAL A 102 1.231 -8.703 -8.607 1.00 0.00 H new ATOM 1534 N ARG A 103 4.313 -8.394 -8.049 1.00 0.00 N ATOM 1535 CA ARG A 103 5.048 -9.512 -8.627 1.00 0.00 C ATOM 1536 C ARG A 103 4.300 -10.824 -8.411 1.00 0.00 C ATOM 1537 O ARG A 103 3.813 -11.117 -7.319 1.00 0.00 O ATOM 1538 CB ARG A 103 6.446 -9.603 -8.013 1.00 0.00 C ATOM 1539 CG ARG A 103 7.421 -10.428 -8.837 1.00 0.00 C ATOM 1540 CD ARG A 103 8.778 -10.528 -8.158 1.00 0.00 C ATOM 1541 NE ARG A 103 9.714 -11.347 -8.924 1.00 0.00 N ATOM 1542 CZ ARG A 103 10.409 -10.895 -9.961 1.00 0.00 C ATOM 1543 NH1 ARG A 103 10.274 -9.636 -10.355 1.00 0.00 N ATOM 1544 NH2 ARG A 103 11.241 -11.702 -10.607 1.00 0.00 N ATOM 0 H ARG A 103 4.487 -8.243 -7.055 1.00 0.00 H new ATOM 0 HA ARG A 103 5.140 -9.338 -9.699 1.00 0.00 H new ATOM 0 HB2 ARG A 103 6.847 -8.597 -7.892 1.00 0.00 H new ATOM 0 HB3 ARG A 103 6.368 -10.037 -7.016 1.00 0.00 H new ATOM 0 HG2 ARG A 103 7.015 -11.428 -8.990 1.00 0.00 H new ATOM 0 HG3 ARG A 103 7.538 -9.977 -9.823 1.00 0.00 H new ATOM 0 HD2 ARG A 103 9.193 -9.528 -8.028 1.00 0.00 H new ATOM 0 HD3 ARG A 103 8.655 -10.954 -7.162 1.00 0.00 H new ATOM 0 HE ARG A 103 9.841 -12.320 -8.647 1.00 0.00 H new ATOM 0 HH11 ARG A 103 9.635 -9.013 -9.861 1.00 0.00 H new ATOM 0 HH12 ARG A 103 10.809 -9.291 -11.152 1.00 0.00 H new ATOM 0 HH21 ARG A 103 11.347 -12.671 -10.307 1.00 0.00 H new ATOM 0 HH22 ARG A 103 11.774 -11.353 -11.404 1.00 0.00 H new ATOM 1558 N PRO A 104 4.204 -11.634 -9.476 1.00 0.00 N ATOM 1559 CA PRO A 104 3.517 -12.928 -9.428 1.00 0.00 C ATOM 1560 C PRO A 104 4.273 -13.955 -8.592 1.00 0.00 C ATOM 1561 O PRO A 104 5.477 -14.142 -8.762 1.00 0.00 O ATOM 1562 CB PRO A 104 3.473 -13.361 -10.895 1.00 0.00 C ATOM 1563 CG PRO A 104 4.624 -12.660 -11.532 1.00 0.00 C ATOM 1564 CD PRO A 104 4.761 -11.349 -10.809 1.00 0.00 C ATOM 0 HA PRO A 104 2.534 -12.851 -8.963 1.00 0.00 H new ATOM 0 HB2 PRO A 104 3.566 -14.443 -10.991 1.00 0.00 H new ATOM 0 HB3 PRO A 104 2.530 -13.079 -11.363 1.00 0.00 H new ATOM 0 HG2 PRO A 104 5.536 -13.250 -11.446 1.00 0.00 H new ATOM 0 HG3 PRO A 104 4.445 -12.502 -12.596 1.00 0.00 H new ATOM 0 HD2 PRO A 104 5.802 -11.030 -10.750 1.00 0.00 H new ATOM 0 HD3 PRO A 104 4.212 -10.553 -11.312 1.00 0.00 H new ATOM 1572 N ASN A 105 3.557 -14.618 -7.689 1.00 0.00 N ATOM 1573 CA ASN A 105 4.161 -15.627 -6.827 1.00 0.00 C ATOM 1574 C ASN A 105 3.685 -17.025 -7.208 1.00 0.00 C ATOM 1575 O ASN A 105 2.744 -17.554 -6.617 1.00 0.00 O ATOM 1576 CB ASN A 105 3.824 -15.343 -5.361 1.00 0.00 C ATOM 1577 CG ASN A 105 4.747 -14.309 -4.745 1.00 0.00 C ATOM 1578 OD1 ASN A 105 4.871 -13.193 -5.249 1.00 0.00 O ATOM 1579 ND2 ASN A 105 5.401 -14.678 -3.650 1.00 0.00 N ATOM 0 H ASN A 105 2.559 -14.475 -7.536 1.00 0.00 H new ATOM 0 HA ASN A 105 5.242 -15.582 -6.960 1.00 0.00 H new ATOM 0 HB2 ASN A 105 2.794 -14.995 -5.289 1.00 0.00 H new ATOM 0 HB3 ASN A 105 3.888 -16.269 -4.790 1.00 0.00 H new ATOM 0 HD21 ASN A 105 6.037 -14.026 -3.192 1.00 0.00 H new ATOM 0 HD22 ASN A 105 5.267 -15.614 -3.267 1.00 0.00 H new ATOM 1586 N ALA A 106 4.341 -17.618 -8.200 1.00 0.00 N ATOM 1587 CA ALA A 106 3.987 -18.955 -8.658 1.00 0.00 C ATOM 1588 C ALA A 106 4.327 -20.005 -7.606 1.00 0.00 C ATOM 1589 O ALA A 106 5.496 -20.319 -7.383 1.00 0.00 O ATOM 1590 CB ALA A 106 4.695 -19.269 -9.968 1.00 0.00 C ATOM 0 H ALA A 106 5.121 -17.193 -8.702 1.00 0.00 H new ATOM 0 HA ALA A 106 2.910 -18.981 -8.824 1.00 0.00 H new ATOM 0 HB1 ALA A 106 4.421 -20.271 -10.298 1.00 0.00 H new ATOM 0 HB2 ALA A 106 4.398 -18.543 -10.725 1.00 0.00 H new ATOM 0 HB3 ALA A 106 5.774 -19.218 -9.820 1.00 0.00 H new ATOM 1596 N VAL A 107 3.298 -20.544 -6.960 1.00 0.00 N ATOM 1597 CA VAL A 107 3.488 -21.559 -5.931 1.00 0.00 C ATOM 1598 C VAL A 107 2.150 -22.099 -5.437 1.00 0.00 C ATOM 1599 O VAL A 107 1.151 -21.379 -5.408 1.00 0.00 O ATOM 1600 CB VAL A 107 4.278 -21.002 -4.732 1.00 0.00 C ATOM 1601 CG1 VAL A 107 3.531 -19.840 -4.094 1.00 0.00 C ATOM 1602 CG2 VAL A 107 4.544 -22.099 -3.713 1.00 0.00 C ATOM 0 H VAL A 107 2.324 -20.294 -7.131 1.00 0.00 H new ATOM 0 HA VAL A 107 4.057 -22.369 -6.387 1.00 0.00 H new ATOM 0 HB VAL A 107 5.238 -20.632 -5.092 1.00 0.00 H new ATOM 0 HG11 VAL A 107 4.104 -19.459 -3.249 1.00 0.00 H new ATOM 0 HG12 VAL A 107 3.397 -19.046 -4.829 1.00 0.00 H new ATOM 0 HG13 VAL A 107 2.556 -20.181 -3.747 1.00 0.00 H new ATOM 0 HG21 VAL A 107 5.103 -21.687 -2.873 1.00 0.00 H new ATOM 0 HG22 VAL A 107 3.596 -22.501 -3.356 1.00 0.00 H new ATOM 0 HG23 VAL A 107 5.124 -22.896 -4.179 1.00 0.00 H new ATOM 1612 N TYR A 108 2.138 -23.369 -5.049 1.00 0.00 N ATOM 1613 CA TYR A 108 0.922 -24.007 -4.558 1.00 0.00 C ATOM 1614 C TYR A 108 1.217 -24.878 -3.341 1.00 0.00 C ATOM 1615 O TYR A 108 1.947 -25.865 -3.433 1.00 0.00 O ATOM 1616 CB TYR A 108 0.282 -24.851 -5.661 1.00 0.00 C ATOM 1617 CG TYR A 108 1.189 -25.937 -6.195 1.00 0.00 C ATOM 1618 CD1 TYR A 108 2.359 -25.620 -6.875 1.00 0.00 C ATOM 1619 CD2 TYR A 108 0.876 -27.279 -6.021 1.00 0.00 C ATOM 1620 CE1 TYR A 108 3.190 -26.609 -7.365 1.00 0.00 C ATOM 1621 CE2 TYR A 108 1.702 -28.274 -6.506 1.00 0.00 C ATOM 1622 CZ TYR A 108 2.857 -27.934 -7.178 1.00 0.00 C ATOM 1623 OH TYR A 108 3.682 -28.923 -7.664 1.00 0.00 O ATOM 0 H TYR A 108 2.957 -23.977 -5.065 1.00 0.00 H new ATOM 0 HA TYR A 108 0.226 -23.223 -4.260 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -0.629 -25.308 -5.275 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -0.012 -24.198 -6.483 1.00 0.00 H new ATOM 0 HD1 TYR A 108 2.623 -24.583 -7.023 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -0.029 -27.549 -5.497 1.00 0.00 H new ATOM 0 HE1 TYR A 108 4.095 -26.346 -7.892 1.00 0.00 H new ATOM 0 HE2 TYR A 108 1.445 -29.313 -6.360 1.00 0.00 H new ATOM 0 HH TYR A 108 3.304 -29.801 -7.447 1.00 0.00 H new ATOM 1633 N ASP A 109 0.644 -24.507 -2.202 1.00 0.00 N ATOM 1634 CA ASP A 109 0.843 -25.254 -0.966 1.00 0.00 C ATOM 1635 C ASP A 109 -0.289 -24.985 0.020 1.00 0.00 C ATOM 1636 O ASP A 109 -0.846 -23.888 0.058 1.00 0.00 O ATOM 1637 CB ASP A 109 2.186 -24.887 -0.333 1.00 0.00 C ATOM 1638 CG ASP A 109 3.364 -25.326 -1.179 1.00 0.00 C ATOM 1639 OD1 ASP A 109 3.460 -26.533 -1.482 1.00 0.00 O ATOM 1640 OD2 ASP A 109 4.192 -24.462 -1.538 1.00 0.00 O ATOM 0 H ASP A 109 0.037 -23.692 -2.109 1.00 0.00 H new ATOM 0 HA ASP A 109 0.844 -26.317 -1.209 1.00 0.00 H new ATOM 0 HB2 ASP A 109 2.231 -23.808 -0.184 1.00 0.00 H new ATOM 0 HB3 ASP A 109 2.258 -25.348 0.652 1.00 0.00 H new ATOM 1645 N VAL A 110 -0.626 -25.995 0.816 1.00 0.00 N ATOM 1646 CA VAL A 110 -1.692 -25.867 1.803 1.00 0.00 C ATOM 1647 C VAL A 110 -1.135 -25.907 3.222 1.00 0.00 C ATOM 1648 O VAL A 110 -0.284 -26.736 3.543 1.00 0.00 O ATOM 1649 CB VAL A 110 -2.741 -26.984 1.644 1.00 0.00 C ATOM 1650 CG1 VAL A 110 -3.819 -26.861 2.710 1.00 0.00 C ATOM 1651 CG2 VAL A 110 -3.351 -26.947 0.251 1.00 0.00 C ATOM 0 H VAL A 110 -0.177 -26.910 0.797 1.00 0.00 H new ATOM 0 HA VAL A 110 -2.169 -24.903 1.630 1.00 0.00 H new ATOM 0 HB VAL A 110 -2.244 -27.946 1.773 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -4.551 -27.659 2.581 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -3.365 -26.941 3.698 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -4.315 -25.895 2.616 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -4.090 -27.743 0.156 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -3.833 -25.983 0.091 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -2.567 -27.089 -0.493 1.00 0.00 H new ATOM 1661 N VAL A 111 -1.622 -25.005 4.068 1.00 0.00 N ATOM 1662 CA VAL A 111 -1.175 -24.937 5.454 1.00 0.00 C ATOM 1663 C VAL A 111 -2.259 -24.354 6.354 1.00 0.00 C ATOM 1664 O VAL A 111 -3.114 -23.594 5.899 1.00 0.00 O ATOM 1665 CB VAL A 111 0.102 -24.087 5.591 1.00 0.00 C ATOM 1666 CG1 VAL A 111 -0.175 -22.641 5.209 1.00 0.00 C ATOM 1667 CG2 VAL A 111 0.653 -24.177 7.006 1.00 0.00 C ATOM 0 H VAL A 111 -2.326 -24.311 3.818 1.00 0.00 H new ATOM 0 HA VAL A 111 -0.958 -25.959 5.766 1.00 0.00 H new ATOM 0 HB VAL A 111 0.854 -24.481 4.907 1.00 0.00 H new ATOM 0 HG11 VAL A 111 0.739 -22.056 5.312 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -0.519 -22.597 4.176 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -0.943 -22.232 5.865 1.00 0.00 H new ATOM 0 HG21 VAL A 111 1.555 -23.570 7.084 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -0.093 -23.811 7.711 1.00 0.00 H new ATOM 0 HG23 VAL A 111 0.892 -25.215 7.238 1.00 0.00 H new ATOM 1677 N GLU A 112 -2.217 -24.715 7.632 1.00 0.00 N ATOM 1678 CA GLU A 112 -3.196 -24.227 8.596 1.00 0.00 C ATOM 1679 C GLU A 112 -2.548 -23.274 9.596 1.00 0.00 C ATOM 1680 O GLU A 112 -1.625 -23.651 10.318 1.00 0.00 O ATOM 1681 CB GLU A 112 -3.843 -25.399 9.337 1.00 0.00 C ATOM 1682 CG GLU A 112 -5.090 -25.014 10.116 1.00 0.00 C ATOM 1683 CD GLU A 112 -6.338 -25.012 9.255 1.00 0.00 C ATOM 1684 OE1 GLU A 112 -6.363 -24.274 8.248 1.00 0.00 O ATOM 1685 OE2 GLU A 112 -7.289 -25.749 9.588 1.00 0.00 O ATOM 0 H GLU A 112 -1.516 -25.344 8.024 1.00 0.00 H new ATOM 0 HA GLU A 112 -3.966 -23.683 8.049 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -4.100 -26.176 8.617 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -3.115 -25.830 10.024 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -5.226 -25.709 10.944 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -4.951 -24.024 10.551 1.00 0.00 H new ATOM 1692 N GLU A 113 -3.038 -22.039 9.631 1.00 0.00 N ATOM 1693 CA GLU A 113 -2.506 -21.032 10.542 1.00 0.00 C ATOM 1694 C GLU A 113 -3.634 -20.273 11.234 1.00 0.00 C ATOM 1695 O GLU A 113 -4.180 -19.316 10.685 1.00 0.00 O ATOM 1696 CB GLU A 113 -1.607 -20.053 9.785 1.00 0.00 C ATOM 1697 CG GLU A 113 -0.148 -20.477 9.738 1.00 0.00 C ATOM 1698 CD GLU A 113 0.454 -20.648 11.119 1.00 0.00 C ATOM 1699 OE1 GLU A 113 0.604 -19.632 11.830 1.00 0.00 O ATOM 1700 OE2 GLU A 113 0.776 -21.797 11.488 1.00 0.00 O ATOM 0 H GLU A 113 -3.802 -21.712 9.040 1.00 0.00 H new ATOM 0 HA GLU A 113 -1.916 -21.543 11.303 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -1.978 -19.946 8.766 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -1.676 -19.072 10.255 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -0.064 -21.416 9.190 1.00 0.00 H new ATOM 0 HG3 GLU A 113 0.425 -19.733 9.185 1.00 0.00 H new ATOM 1707 N SER A 114 -3.978 -20.708 12.442 1.00 0.00 N ATOM 1708 CA SER A 114 -5.044 -20.073 13.208 1.00 0.00 C ATOM 1709 C SER A 114 -4.530 -18.830 13.928 1.00 0.00 C ATOM 1710 O SER A 114 -3.340 -18.714 14.215 1.00 0.00 O ATOM 1711 CB SER A 114 -5.629 -21.058 14.222 1.00 0.00 C ATOM 1712 OG SER A 114 -4.647 -21.470 15.157 1.00 0.00 O ATOM 0 H SER A 114 -3.534 -21.497 12.911 1.00 0.00 H new ATOM 0 HA SER A 114 -5.827 -19.771 12.512 1.00 0.00 H new ATOM 0 HB2 SER A 114 -6.463 -20.592 14.747 1.00 0.00 H new ATOM 0 HB3 SER A 114 -6.027 -21.928 13.700 1.00 0.00 H new ATOM 0 HG SER A 114 -5.046 -22.098 15.795 1.00 0.00 H new ATOM 1718 N GLY A 115 -5.438 -17.903 14.216 1.00 0.00 N ATOM 1719 CA GLY A 115 -5.058 -16.680 14.900 1.00 0.00 C ATOM 1720 C GLY A 115 -6.125 -16.199 15.863 1.00 0.00 C ATOM 1721 O GLY A 115 -6.969 -15.369 15.524 1.00 0.00 O ATOM 0 H GLY A 115 -6.430 -17.977 13.988 1.00 0.00 H new ATOM 0 HA2 GLY A 115 -4.129 -16.846 15.445 1.00 0.00 H new ATOM 0 HA3 GLY A 115 -4.860 -15.902 14.163 1.00 0.00 H new ATOM 1725 N PRO A 116 -6.098 -16.728 17.095 1.00 0.00 N ATOM 1726 CA PRO A 116 -7.064 -16.362 18.135 1.00 0.00 C ATOM 1727 C PRO A 116 -6.865 -14.936 18.637 1.00 0.00 C ATOM 1728 O PRO A 116 -7.560 -14.485 19.547 1.00 0.00 O ATOM 1729 CB PRO A 116 -6.779 -17.367 19.254 1.00 0.00 C ATOM 1730 CG PRO A 116 -5.357 -17.763 19.053 1.00 0.00 C ATOM 1731 CD PRO A 116 -5.121 -17.723 17.569 1.00 0.00 C ATOM 0 HA PRO A 116 -8.089 -16.392 17.766 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -6.930 -16.919 20.236 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -7.443 -18.229 19.191 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -4.685 -17.081 19.573 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -5.170 -18.760 19.451 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -4.099 -17.427 17.332 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -5.285 -18.698 17.110 1.00 0.00 H new ATOM 1739 N SER A 117 -5.912 -14.230 18.036 1.00 0.00 N ATOM 1740 CA SER A 117 -5.619 -12.856 18.424 1.00 0.00 C ATOM 1741 C SER A 117 -6.544 -11.879 17.705 1.00 0.00 C ATOM 1742 O SER A 117 -6.443 -11.690 16.492 1.00 0.00 O ATOM 1743 CB SER A 117 -4.160 -12.516 18.115 1.00 0.00 C ATOM 1744 OG SER A 117 -3.276 -13.306 18.891 1.00 0.00 O ATOM 0 H SER A 117 -5.330 -14.588 17.278 1.00 0.00 H new ATOM 0 HA SER A 117 -5.786 -12.765 19.497 1.00 0.00 H new ATOM 0 HB2 SER A 117 -3.962 -12.678 17.055 1.00 0.00 H new ATOM 0 HB3 SER A 117 -3.979 -11.460 18.315 1.00 0.00 H new ATOM 0 HG SER A 117 -2.350 -13.070 18.673 1.00 0.00 H new ATOM 1750 N SER A 118 -7.446 -11.262 18.461 1.00 0.00 N ATOM 1751 CA SER A 118 -8.393 -10.307 17.896 1.00 0.00 C ATOM 1752 C SER A 118 -8.019 -8.879 18.280 1.00 0.00 C ATOM 1753 O SER A 118 -7.741 -8.045 17.420 1.00 0.00 O ATOM 1754 CB SER A 118 -9.812 -10.621 18.373 1.00 0.00 C ATOM 1755 OG SER A 118 -10.779 -10.093 17.481 1.00 0.00 O ATOM 0 H SER A 118 -7.541 -11.406 19.466 1.00 0.00 H new ATOM 0 HA SER A 118 -8.355 -10.394 16.810 1.00 0.00 H new ATOM 0 HB2 SER A 118 -9.940 -11.700 18.456 1.00 0.00 H new ATOM 0 HB3 SER A 118 -9.965 -10.204 19.368 1.00 0.00 H new ATOM 0 HG SER A 118 -11.677 -10.309 17.807 1.00 0.00 H new ATOM 1761 N GLY A 119 -8.015 -8.605 19.581 1.00 0.00 N ATOM 1762 CA GLY A 119 -7.674 -7.277 20.059 1.00 0.00 C ATOM 1763 C GLY A 119 -8.210 -7.006 21.451 1.00 0.00 C ATOM 1764 O GLY A 119 -7.609 -6.255 22.219 1.00 0.00 O ATOM 0 H GLY A 119 -8.242 -9.279 20.313 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -6.590 -7.163 20.062 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -8.071 -6.533 19.369 1.00 0.00 H new TER 1768 GLY A 119