USER MOD reduce.3.24.130724 H: found=0, std=0, add=846, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 846 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 66 MET CE :methyl -179:sc= -0.414 (180deg=-0.337) USER MOD Set 1.2: A 90 MET CE :methyl 158:sc= -0.527 (180deg=-0.168) USER MOD Single : A 2 SER OG : rot -13:sc= 0.594 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot -97:sc= 1.16 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 23 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 GLN : amide:sc= -0.0748 X(o=-0.075,f=0) USER MOD Single : A 28 HIS : no HD1:sc= -0.388 X(o=-0.39,f=-0.56) USER MOD Single : A 30 TYR OH : rot -64:sc= -0.0926 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 THR OG1 : rot 150:sc= -0.27 USER MOD Single : A 36 GLN : amide:sc= -0.114 K(o=-0.11,f=-1.9!) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 ASN : amide:sc= -0.116 X(o=-0.12,f=-0.2) USER MOD Single : A 46 MET CE :methyl 145:sc= -0.0857 (180deg=-2.08!) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 52 LYS NZ :NH3+ 166:sc=-0.00282 (180deg=-0.134) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 180:sc= -0.968 USER MOD Single : A 71 MET CE :methyl -161:sc= -0.565 (180deg=-1.39!) USER MOD Single : A 76 THR OG1 : rot -89:sc= 1.26 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 87 GLN : amide:sc= -0.126 K(o=-0.13,f=-0.97!) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 GLN : amide:sc= -0.375 X(o=-0.37,f=-0.37) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 18 N SER A 2 0.706 -1.944 -1.711 1.00 0.00 N ATOM 19 CA SER A 2 0.172 -3.058 -2.487 1.00 0.00 C ATOM 20 C SER A 2 -1.274 -3.348 -2.096 1.00 0.00 C ATOM 21 O SER A 2 -1.638 -3.278 -0.921 1.00 0.00 O ATOM 22 CB SER A 2 1.029 -4.308 -2.280 1.00 0.00 C ATOM 23 OG SER A 2 1.623 -4.312 -0.993 1.00 0.00 O ATOM 0 HA SER A 2 0.196 -2.780 -3.541 1.00 0.00 H new ATOM 0 HB2 SER A 2 0.413 -5.199 -2.403 1.00 0.00 H new ATOM 0 HB3 SER A 2 1.806 -4.350 -3.043 1.00 0.00 H new ATOM 0 HG SER A 2 1.536 -3.423 -0.590 1.00 0.00 H new ATOM 29 N LEU A 3 -2.094 -3.675 -3.088 1.00 0.00 N ATOM 30 CA LEU A 3 -3.501 -3.977 -2.850 1.00 0.00 C ATOM 31 C LEU A 3 -3.804 -5.440 -3.156 1.00 0.00 C ATOM 32 O LEU A 3 -3.259 -6.014 -4.099 1.00 0.00 O ATOM 33 CB LEU A 3 -4.389 -3.071 -3.705 1.00 0.00 C ATOM 34 CG LEU A 3 -4.608 -1.653 -3.177 1.00 0.00 C ATOM 35 CD1 LEU A 3 -4.787 -0.676 -4.329 1.00 0.00 C ATOM 36 CD2 LEU A 3 -5.812 -1.610 -2.248 1.00 0.00 C ATOM 0 H LEU A 3 -1.809 -3.738 -4.065 1.00 0.00 H new ATOM 0 HA LEU A 3 -3.713 -3.794 -1.797 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -3.952 -3.003 -4.701 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -5.362 -3.550 -3.816 1.00 0.00 H new ATOM 0 HG LEU A 3 -3.725 -1.357 -2.610 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -4.942 0.328 -3.934 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -3.896 -0.686 -4.956 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -5.652 -0.969 -4.924 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -5.953 -0.593 -1.882 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -6.702 -1.927 -2.791 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -5.645 -2.280 -1.404 1.00 0.00 H new ATOM 48 N LYS A 4 -4.677 -6.039 -2.354 1.00 0.00 N ATOM 49 CA LYS A 4 -5.056 -7.434 -2.540 1.00 0.00 C ATOM 50 C LYS A 4 -5.689 -7.648 -3.911 1.00 0.00 C ATOM 51 O LYS A 4 -5.519 -8.701 -4.526 1.00 0.00 O ATOM 52 CB LYS A 4 -6.031 -7.870 -1.443 1.00 0.00 C ATOM 53 CG LYS A 4 -5.462 -8.922 -0.507 1.00 0.00 C ATOM 54 CD LYS A 4 -5.873 -8.668 0.934 1.00 0.00 C ATOM 55 CE LYS A 4 -4.780 -9.082 1.907 1.00 0.00 C ATOM 56 NZ LYS A 4 -4.797 -10.549 2.168 1.00 0.00 N ATOM 0 H LYS A 4 -5.136 -5.579 -1.568 1.00 0.00 H new ATOM 0 HA LYS A 4 -4.153 -8.041 -2.477 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -6.323 -6.997 -0.860 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -6.937 -8.260 -1.907 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -5.806 -9.909 -0.816 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -4.375 -8.926 -0.581 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -6.099 -7.610 1.068 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -6.787 -9.220 1.155 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -3.808 -8.796 1.505 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -4.907 -8.544 2.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -4.037 -10.792 2.836 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -5.715 -10.819 2.575 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -4.650 -11.062 1.275 1.00 0.00 H new ATOM 70 N SER A 5 -6.418 -6.643 -4.385 1.00 0.00 N ATOM 71 CA SER A 5 -7.078 -6.723 -5.682 1.00 0.00 C ATOM 72 C SER A 5 -6.061 -6.948 -6.796 1.00 0.00 C ATOM 73 O SER A 5 -6.403 -7.428 -7.877 1.00 0.00 O ATOM 74 CB SER A 5 -7.873 -5.444 -5.953 1.00 0.00 C ATOM 75 OG SER A 5 -7.023 -4.311 -5.980 1.00 0.00 O ATOM 0 H SER A 5 -6.566 -5.764 -3.890 1.00 0.00 H new ATOM 0 HA SER A 5 -7.763 -7.571 -5.662 1.00 0.00 H new ATOM 0 HB2 SER A 5 -8.397 -5.532 -6.905 1.00 0.00 H new ATOM 0 HB3 SER A 5 -8.633 -5.314 -5.182 1.00 0.00 H new ATOM 0 HG SER A 5 -7.039 -3.869 -5.105 1.00 0.00 H new ATOM 81 N ASP A 6 -4.808 -6.599 -6.524 1.00 0.00 N ATOM 82 CA ASP A 6 -3.739 -6.764 -7.502 1.00 0.00 C ATOM 83 C ASP A 6 -3.676 -8.204 -8.001 1.00 0.00 C ATOM 84 O ASP A 6 -3.523 -8.450 -9.197 1.00 0.00 O ATOM 85 CB ASP A 6 -2.395 -6.363 -6.892 1.00 0.00 C ATOM 86 CG ASP A 6 -1.393 -5.918 -7.940 1.00 0.00 C ATOM 87 OD1 ASP A 6 -1.666 -6.115 -9.142 1.00 0.00 O ATOM 88 OD2 ASP A 6 -0.336 -5.373 -7.557 1.00 0.00 O ATOM 0 H ASP A 6 -4.508 -6.200 -5.634 1.00 0.00 H new ATOM 0 HA ASP A 6 -3.953 -6.114 -8.350 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -2.551 -5.556 -6.176 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -1.985 -7.207 -6.337 1.00 0.00 H new ATOM 93 N GLU A 7 -3.794 -9.151 -7.076 1.00 0.00 N ATOM 94 CA GLU A 7 -3.748 -10.567 -7.423 1.00 0.00 C ATOM 95 C GLU A 7 -4.859 -10.922 -8.408 1.00 0.00 C ATOM 96 O GLU A 7 -4.626 -11.611 -9.401 1.00 0.00 O ATOM 97 CB GLU A 7 -3.873 -11.427 -6.164 1.00 0.00 C ATOM 98 CG GLU A 7 -2.611 -12.204 -5.830 1.00 0.00 C ATOM 99 CD GLU A 7 -2.428 -13.426 -6.709 1.00 0.00 C ATOM 100 OE1 GLU A 7 -2.186 -13.255 -7.922 1.00 0.00 O ATOM 101 OE2 GLU A 7 -2.527 -14.555 -6.183 1.00 0.00 O ATOM 0 H GLU A 7 -3.922 -8.964 -6.082 1.00 0.00 H new ATOM 0 HA GLU A 7 -2.788 -10.768 -7.898 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -4.129 -10.786 -5.320 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -4.698 -12.128 -6.293 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -1.746 -11.550 -5.940 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -2.646 -12.514 -4.786 1.00 0.00 H new ATOM 108 N VAL A 8 -6.067 -10.446 -8.124 1.00 0.00 N ATOM 109 CA VAL A 8 -7.214 -10.712 -8.983 1.00 0.00 C ATOM 110 C VAL A 8 -6.934 -10.289 -10.421 1.00 0.00 C ATOM 111 O VAL A 8 -7.163 -11.052 -11.360 1.00 0.00 O ATOM 112 CB VAL A 8 -8.474 -9.981 -8.481 1.00 0.00 C ATOM 113 CG1 VAL A 8 -9.595 -10.084 -9.504 1.00 0.00 C ATOM 114 CG2 VAL A 8 -8.914 -10.541 -7.137 1.00 0.00 C ATOM 0 H VAL A 8 -6.276 -9.874 -7.306 1.00 0.00 H new ATOM 0 HA VAL A 8 -7.390 -11.787 -8.951 1.00 0.00 H new ATOM 0 HB VAL A 8 -8.233 -8.926 -8.348 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -10.476 -9.562 -9.132 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -9.274 -9.631 -10.442 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -9.839 -11.133 -9.672 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -9.805 -10.013 -6.797 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -9.138 -11.603 -7.241 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -8.114 -10.409 -6.408 1.00 0.00 H new ATOM 124 N PHE A 9 -6.436 -9.068 -10.586 1.00 0.00 N ATOM 125 CA PHE A 9 -6.124 -8.542 -11.910 1.00 0.00 C ATOM 126 C PHE A 9 -5.087 -9.415 -12.611 1.00 0.00 C ATOM 127 O PHE A 9 -5.185 -9.671 -13.811 1.00 0.00 O ATOM 128 CB PHE A 9 -5.609 -7.105 -11.803 1.00 0.00 C ATOM 129 CG PHE A 9 -6.704 -6.080 -11.728 1.00 0.00 C ATOM 130 CD1 PHE A 9 -7.767 -6.116 -12.616 1.00 0.00 C ATOM 131 CD2 PHE A 9 -6.670 -5.080 -10.769 1.00 0.00 C ATOM 132 CE1 PHE A 9 -8.776 -5.175 -12.550 1.00 0.00 C ATOM 133 CE2 PHE A 9 -7.677 -4.136 -10.698 1.00 0.00 C ATOM 134 CZ PHE A 9 -8.731 -4.183 -11.590 1.00 0.00 C ATOM 0 H PHE A 9 -6.240 -8.424 -9.820 1.00 0.00 H new ATOM 0 HA PHE A 9 -7.039 -8.549 -12.502 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -4.980 -7.018 -10.917 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -4.978 -6.889 -12.665 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -7.807 -6.889 -13.369 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -5.848 -5.038 -10.070 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -9.599 -5.215 -13.248 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -7.640 -3.362 -9.946 1.00 0.00 H new ATOM 0 HZ PHE A 9 -9.518 -3.446 -11.537 1.00 0.00 H new ATOM 144 N ALA A 10 -4.094 -9.868 -11.854 1.00 0.00 N ATOM 145 CA ALA A 10 -3.039 -10.713 -12.401 1.00 0.00 C ATOM 146 C ALA A 10 -3.608 -12.023 -12.935 1.00 0.00 C ATOM 147 O ALA A 10 -3.265 -12.458 -14.034 1.00 0.00 O ATOM 148 CB ALA A 10 -1.980 -10.987 -11.343 1.00 0.00 C ATOM 0 H ALA A 10 -3.997 -9.664 -10.859 1.00 0.00 H new ATOM 0 HA ALA A 10 -2.576 -10.182 -13.233 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -1.199 -11.619 -11.765 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -1.545 -10.044 -11.011 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -2.437 -11.494 -10.493 1.00 0.00 H new ATOM 154 N LYS A 11 -4.478 -12.649 -12.150 1.00 0.00 N ATOM 155 CA LYS A 11 -5.095 -13.910 -12.543 1.00 0.00 C ATOM 156 C LYS A 11 -6.050 -13.706 -13.715 1.00 0.00 C ATOM 157 O LYS A 11 -6.037 -14.473 -14.678 1.00 0.00 O ATOM 158 CB LYS A 11 -5.846 -14.525 -11.360 1.00 0.00 C ATOM 159 CG LYS A 11 -5.063 -14.493 -10.059 1.00 0.00 C ATOM 160 CD LYS A 11 -5.140 -15.823 -9.329 1.00 0.00 C ATOM 161 CE LYS A 11 -3.903 -16.672 -9.585 1.00 0.00 C ATOM 162 NZ LYS A 11 -3.362 -17.256 -8.327 1.00 0.00 N ATOM 0 H LYS A 11 -4.772 -12.303 -11.237 1.00 0.00 H new ATOM 0 HA LYS A 11 -4.304 -14.591 -12.856 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -6.787 -13.992 -11.221 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -6.097 -15.559 -11.598 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -4.021 -14.251 -10.266 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -5.453 -13.702 -9.418 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -5.246 -15.646 -8.259 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -6.028 -16.366 -9.652 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -4.150 -17.474 -10.281 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -3.136 -16.062 -10.062 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -2.520 -17.827 -8.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -3.102 -16.491 -7.673 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -4.085 -17.859 -7.885 1.00 0.00 H new ATOM 176 N ILE A 12 -6.875 -12.669 -13.626 1.00 0.00 N ATOM 177 CA ILE A 12 -7.834 -12.364 -14.680 1.00 0.00 C ATOM 178 C ILE A 12 -7.126 -12.045 -15.992 1.00 0.00 C ATOM 179 O ILE A 12 -7.514 -12.533 -17.053 1.00 0.00 O ATOM 180 CB ILE A 12 -8.736 -11.176 -14.295 1.00 0.00 C ATOM 181 CG1 ILE A 12 -9.644 -11.556 -13.123 1.00 0.00 C ATOM 182 CG2 ILE A 12 -9.564 -10.730 -15.490 1.00 0.00 C ATOM 183 CD1 ILE A 12 -10.427 -10.389 -12.563 1.00 0.00 C ATOM 0 H ILE A 12 -6.899 -12.026 -12.835 1.00 0.00 H new ATOM 0 HA ILE A 12 -8.452 -13.252 -14.810 1.00 0.00 H new ATOM 0 HB ILE A 12 -8.103 -10.344 -13.986 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -10.341 -12.328 -13.449 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -9.036 -11.990 -12.329 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -10.196 -9.890 -15.202 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -8.900 -10.424 -16.299 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -10.190 -11.556 -15.827 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -11.049 -10.731 -11.736 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -9.736 -9.625 -12.206 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -11.061 -9.968 -13.343 1.00 0.00 H new ATOM 195 N ALA A 13 -6.084 -11.225 -15.912 1.00 0.00 N ATOM 196 CA ALA A 13 -5.318 -10.844 -17.092 1.00 0.00 C ATOM 197 C ALA A 13 -4.847 -12.073 -17.861 1.00 0.00 C ATOM 198 O ALA A 13 -5.010 -12.158 -19.078 1.00 0.00 O ATOM 199 CB ALA A 13 -4.130 -9.980 -16.695 1.00 0.00 C ATOM 0 H ALA A 13 -5.750 -10.811 -15.041 1.00 0.00 H new ATOM 0 HA ALA A 13 -5.970 -10.266 -17.747 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -3.567 -9.703 -17.587 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -4.486 -9.079 -16.196 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -3.484 -10.538 -16.017 1.00 0.00 H new ATOM 205 N LYS A 14 -4.260 -13.025 -17.143 1.00 0.00 N ATOM 206 CA LYS A 14 -3.765 -14.251 -17.757 1.00 0.00 C ATOM 207 C LYS A 14 -4.869 -14.951 -18.543 1.00 0.00 C ATOM 208 O LYS A 14 -4.624 -15.510 -19.612 1.00 0.00 O ATOM 209 CB LYS A 14 -3.210 -15.194 -16.686 1.00 0.00 C ATOM 210 CG LYS A 14 -1.920 -14.704 -16.053 1.00 0.00 C ATOM 211 CD LYS A 14 -0.702 -15.319 -16.722 1.00 0.00 C ATOM 212 CE LYS A 14 0.462 -15.446 -15.752 1.00 0.00 C ATOM 213 NZ LYS A 14 0.991 -16.838 -15.700 1.00 0.00 N ATOM 0 H LYS A 14 -4.116 -12.971 -16.135 1.00 0.00 H new ATOM 0 HA LYS A 14 -2.965 -13.984 -18.448 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -3.960 -15.326 -15.906 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -3.037 -16.174 -17.131 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -1.867 -13.618 -16.127 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -1.917 -14.952 -14.992 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -0.959 -16.303 -17.114 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -0.404 -14.705 -17.572 1.00 0.00 H new ATOM 0 HE2 LYS A 14 1.259 -14.765 -16.050 1.00 0.00 H new ATOM 0 HE3 LYS A 14 0.140 -15.142 -14.756 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 1.783 -16.883 -15.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 0.237 -17.485 -15.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 1.322 -17.119 -16.645 1.00 0.00 H new ATOM 227 N ARG A 15 -6.085 -14.914 -18.008 1.00 0.00 N ATOM 228 CA ARG A 15 -7.226 -15.544 -18.660 1.00 0.00 C ATOM 229 C ARG A 15 -7.573 -14.827 -19.962 1.00 0.00 C ATOM 230 O ARG A 15 -8.052 -15.444 -20.914 1.00 0.00 O ATOM 231 CB ARG A 15 -8.438 -15.544 -17.727 1.00 0.00 C ATOM 232 CG ARG A 15 -8.230 -16.353 -16.457 1.00 0.00 C ATOM 233 CD ARG A 15 -8.327 -17.847 -16.727 1.00 0.00 C ATOM 234 NE ARG A 15 -7.021 -18.498 -16.679 1.00 0.00 N ATOM 235 CZ ARG A 15 -6.844 -19.804 -16.845 1.00 0.00 C ATOM 236 NH1 ARG A 15 -7.885 -20.594 -17.070 1.00 0.00 N ATOM 237 NH2 ARG A 15 -5.624 -20.322 -16.788 1.00 0.00 N ATOM 0 H ARG A 15 -6.305 -14.454 -17.125 1.00 0.00 H new ATOM 0 HA ARG A 15 -6.956 -16.574 -18.893 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -8.678 -14.516 -17.457 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -9.299 -15.942 -18.264 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -7.253 -16.121 -16.032 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -8.976 -16.067 -15.715 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -8.988 -18.306 -15.992 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -8.777 -18.010 -17.706 1.00 0.00 H new ATOM 0 HE ARG A 15 -6.199 -17.918 -16.509 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -8.824 -20.199 -17.116 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -7.746 -21.597 -17.197 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -4.821 -19.717 -16.617 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -5.489 -21.325 -16.916 1.00 0.00 H new ATOM 251 N LEU A 16 -7.327 -13.522 -19.996 1.00 0.00 N ATOM 252 CA LEU A 16 -7.614 -12.720 -21.180 1.00 0.00 C ATOM 253 C LEU A 16 -6.783 -13.191 -22.370 1.00 0.00 C ATOM 254 O LEU A 16 -7.136 -12.941 -23.522 1.00 0.00 O ATOM 255 CB LEU A 16 -7.333 -11.243 -20.900 1.00 0.00 C ATOM 256 CG LEU A 16 -7.995 -10.659 -19.651 1.00 0.00 C ATOM 257 CD1 LEU A 16 -7.843 -9.146 -19.624 1.00 0.00 C ATOM 258 CD2 LEU A 16 -9.464 -11.051 -19.594 1.00 0.00 C ATOM 0 H LEU A 16 -6.929 -12.997 -19.217 1.00 0.00 H new ATOM 0 HA LEU A 16 -8.669 -12.842 -21.425 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -6.255 -11.109 -20.812 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -7.657 -10.662 -21.764 1.00 0.00 H new ATOM 0 HG LEU A 16 -7.496 -11.069 -18.773 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -8.320 -8.748 -18.728 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -6.784 -8.887 -19.617 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -8.316 -8.717 -20.508 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -9.919 -10.627 -18.699 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -9.977 -10.670 -20.477 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -9.550 -12.137 -19.565 1.00 0.00 H new ATOM 270 N GLU A 17 -5.679 -13.873 -22.082 1.00 0.00 N ATOM 271 CA GLU A 17 -4.799 -14.379 -23.128 1.00 0.00 C ATOM 272 C GLU A 17 -5.370 -15.651 -23.751 1.00 0.00 C ATOM 273 O GLU A 17 -4.913 -16.099 -24.802 1.00 0.00 O ATOM 274 CB GLU A 17 -3.405 -14.656 -22.564 1.00 0.00 C ATOM 275 CG GLU A 17 -2.878 -13.546 -21.670 1.00 0.00 C ATOM 276 CD GLU A 17 -1.475 -13.819 -21.165 1.00 0.00 C ATOM 277 OE1 GLU A 17 -1.083 -15.004 -21.111 1.00 0.00 O ATOM 278 OE2 GLU A 17 -0.768 -12.847 -20.824 1.00 0.00 O ATOM 0 H GLU A 17 -5.373 -14.088 -21.133 1.00 0.00 H new ATOM 0 HA GLU A 17 -4.724 -13.617 -23.903 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -3.430 -15.587 -21.997 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -2.711 -14.805 -23.391 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -2.885 -12.606 -22.222 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -3.548 -13.421 -20.819 1.00 0.00 H new ATOM 285 N SER A 18 -6.371 -16.227 -23.093 1.00 0.00 N ATOM 286 CA SER A 18 -7.001 -17.449 -23.578 1.00 0.00 C ATOM 287 C SER A 18 -8.220 -17.127 -24.437 1.00 0.00 C ATOM 288 O SER A 18 -8.695 -17.969 -25.200 1.00 0.00 O ATOM 289 CB SER A 18 -7.412 -18.338 -22.402 1.00 0.00 C ATOM 290 OG SER A 18 -6.520 -19.429 -22.252 1.00 0.00 O ATOM 0 H SER A 18 -6.763 -15.867 -22.223 1.00 0.00 H new ATOM 0 HA SER A 18 -6.276 -17.983 -24.192 1.00 0.00 H new ATOM 0 HB2 SER A 18 -7.429 -17.749 -21.485 1.00 0.00 H new ATOM 0 HB3 SER A 18 -8.424 -18.711 -22.560 1.00 0.00 H new ATOM 0 HG SER A 18 -6.803 -19.981 -21.493 1.00 0.00 H new ATOM 296 N ILE A 19 -8.721 -15.904 -24.307 1.00 0.00 N ATOM 297 CA ILE A 19 -9.884 -15.470 -25.071 1.00 0.00 C ATOM 298 C ILE A 19 -9.628 -15.579 -26.570 1.00 0.00 C ATOM 299 O ILE A 19 -8.526 -15.304 -27.044 1.00 0.00 O ATOM 300 CB ILE A 19 -10.271 -14.018 -24.732 1.00 0.00 C ATOM 301 CG1 ILE A 19 -10.450 -13.855 -23.221 1.00 0.00 C ATOM 302 CG2 ILE A 19 -11.543 -13.624 -25.467 1.00 0.00 C ATOM 303 CD1 ILE A 19 -10.823 -12.449 -22.805 1.00 0.00 C ATOM 0 H ILE A 19 -8.340 -15.196 -23.680 1.00 0.00 H new ATOM 0 HA ILE A 19 -10.707 -16.130 -24.796 1.00 0.00 H new ATOM 0 HB ILE A 19 -9.467 -13.357 -25.057 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -11.222 -14.544 -22.878 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -9.524 -14.140 -22.721 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -11.804 -12.596 -25.217 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -11.383 -13.707 -26.542 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -12.355 -14.287 -25.169 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -10.933 -12.407 -21.721 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -10.040 -11.758 -23.117 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -11.764 -12.168 -23.277 1.00 0.00 H new ATOM 315 N ASP A 20 -10.655 -15.979 -27.313 1.00 0.00 N ATOM 316 CA ASP A 20 -10.543 -16.121 -28.760 1.00 0.00 C ATOM 317 C ASP A 20 -11.553 -15.228 -29.473 1.00 0.00 C ATOM 318 O ASP A 20 -12.620 -14.912 -28.947 1.00 0.00 O ATOM 319 CB ASP A 20 -10.755 -17.580 -29.168 1.00 0.00 C ATOM 320 CG ASP A 20 -9.553 -18.161 -29.885 1.00 0.00 C ATOM 321 OD1 ASP A 20 -8.415 -17.909 -29.436 1.00 0.00 O ATOM 322 OD2 ASP A 20 -9.749 -18.867 -30.897 1.00 0.00 O ATOM 0 H ASP A 20 -11.574 -16.211 -26.937 1.00 0.00 H new ATOM 0 HA ASP A 20 -9.540 -15.812 -29.055 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -10.967 -18.175 -28.280 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -11.629 -17.650 -29.815 1.00 0.00 H new ATOM 327 N PRO A 21 -11.210 -14.810 -30.701 1.00 0.00 N ATOM 328 CA PRO A 21 -12.073 -13.947 -31.513 1.00 0.00 C ATOM 329 C PRO A 21 -13.322 -14.672 -32.002 1.00 0.00 C ATOM 330 O PRO A 21 -14.337 -14.045 -32.304 1.00 0.00 O ATOM 331 CB PRO A 21 -11.179 -13.564 -32.695 1.00 0.00 C ATOM 332 CG PRO A 21 -10.190 -14.673 -32.797 1.00 0.00 C ATOM 333 CD PRO A 21 -9.954 -15.148 -31.390 1.00 0.00 C ATOM 0 HA PRO A 21 -12.444 -13.092 -30.947 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -11.758 -13.464 -33.613 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -10.685 -12.608 -32.524 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -10.572 -15.480 -33.422 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -9.262 -14.328 -33.253 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -9.752 -16.219 -31.356 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -9.099 -14.648 -30.935 1.00 0.00 H new ATOM 341 N ALA A 22 -13.241 -15.996 -32.078 1.00 0.00 N ATOM 342 CA ALA A 22 -14.366 -16.806 -32.528 1.00 0.00 C ATOM 343 C ALA A 22 -15.586 -16.594 -31.639 1.00 0.00 C ATOM 344 O ALA A 22 -16.672 -16.281 -32.124 1.00 0.00 O ATOM 345 CB ALA A 22 -13.979 -18.278 -32.555 1.00 0.00 C ATOM 0 H ALA A 22 -12.408 -16.531 -31.834 1.00 0.00 H new ATOM 0 HA ALA A 22 -14.627 -16.491 -33.538 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -14.829 -18.871 -32.893 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -13.142 -18.422 -33.238 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -13.689 -18.596 -31.554 1.00 0.00 H new ATOM 351 N ASN A 23 -15.399 -16.766 -30.334 1.00 0.00 N ATOM 352 CA ASN A 23 -16.486 -16.595 -29.377 1.00 0.00 C ATOM 353 C ASN A 23 -16.377 -15.249 -28.666 1.00 0.00 C ATOM 354 O ASN A 23 -15.422 -14.999 -27.931 1.00 0.00 O ATOM 355 CB ASN A 23 -16.473 -17.729 -28.350 1.00 0.00 C ATOM 356 CG ASN A 23 -17.770 -18.515 -28.341 1.00 0.00 C ATOM 357 OD1 ASN A 23 -18.574 -18.398 -27.416 1.00 0.00 O ATOM 358 ND2 ASN A 23 -17.978 -19.323 -29.374 1.00 0.00 N ATOM 0 H ASN A 23 -14.505 -17.024 -29.915 1.00 0.00 H new ATOM 0 HA ASN A 23 -17.428 -16.622 -29.926 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -15.644 -18.403 -28.567 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -16.295 -17.315 -27.358 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -18.832 -19.878 -29.423 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -17.284 -19.388 -30.118 1.00 0.00 H new ATOM 365 N ARG A 24 -17.362 -14.386 -28.891 1.00 0.00 N ATOM 366 CA ARG A 24 -17.377 -13.065 -28.273 1.00 0.00 C ATOM 367 C ARG A 24 -18.620 -12.284 -28.690 1.00 0.00 C ATOM 368 O ARG A 24 -18.720 -11.819 -29.825 1.00 0.00 O ATOM 369 CB ARG A 24 -16.119 -12.285 -28.657 1.00 0.00 C ATOM 370 CG ARG A 24 -15.131 -12.121 -27.513 1.00 0.00 C ATOM 371 CD ARG A 24 -13.696 -12.094 -28.015 1.00 0.00 C ATOM 372 NE ARG A 24 -13.320 -10.780 -28.528 1.00 0.00 N ATOM 373 CZ ARG A 24 -12.067 -10.423 -28.786 1.00 0.00 C ATOM 374 NH1 ARG A 24 -11.075 -11.278 -28.581 1.00 0.00 N ATOM 375 NH2 ARG A 24 -11.804 -9.208 -29.252 1.00 0.00 N ATOM 0 H ARG A 24 -18.160 -14.577 -29.497 1.00 0.00 H new ATOM 0 HA ARG A 24 -17.398 -13.197 -27.191 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -15.624 -12.795 -29.483 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -16.410 -11.299 -29.019 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -15.346 -11.198 -26.974 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -15.254 -12.940 -26.804 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -13.023 -12.373 -27.204 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -13.573 -12.839 -28.801 1.00 0.00 H new ATOM 0 HE ARG A 24 -14.060 -10.099 -28.698 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -11.273 -12.213 -28.224 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -10.114 -11.001 -28.780 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -12.565 -8.548 -29.412 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -10.841 -8.935 -29.450 1.00 0.00 H new ATOM 389 N GLN A 25 -19.563 -12.145 -27.763 1.00 0.00 N ATOM 390 CA GLN A 25 -20.799 -11.421 -28.036 1.00 0.00 C ATOM 391 C GLN A 25 -20.590 -9.917 -27.903 1.00 0.00 C ATOM 392 O GLN A 25 -21.209 -9.128 -28.618 1.00 0.00 O ATOM 393 CB GLN A 25 -21.904 -11.880 -27.082 1.00 0.00 C ATOM 394 CG GLN A 25 -22.222 -13.363 -27.188 1.00 0.00 C ATOM 395 CD GLN A 25 -22.392 -14.021 -25.832 1.00 0.00 C ATOM 396 OE1 GLN A 25 -23.447 -14.577 -25.527 1.00 0.00 O ATOM 397 NE2 GLN A 25 -21.350 -13.962 -25.010 1.00 0.00 N ATOM 0 H GLN A 25 -19.495 -12.523 -26.818 1.00 0.00 H new ATOM 0 HA GLN A 25 -21.099 -11.638 -29.061 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -21.606 -11.653 -26.058 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -22.809 -11.307 -27.285 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -23.135 -13.495 -27.769 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -21.422 -13.864 -27.733 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -20.494 -13.491 -25.304 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -21.405 -14.388 -24.085 1.00 0.00 H new ATOM 406 N VAL A 26 -19.713 -9.525 -26.984 1.00 0.00 N ATOM 407 CA VAL A 26 -19.421 -8.114 -26.758 1.00 0.00 C ATOM 408 C VAL A 26 -18.130 -7.940 -25.966 1.00 0.00 C ATOM 409 O VAL A 26 -17.808 -8.753 -25.101 1.00 0.00 O ATOM 410 CB VAL A 26 -20.570 -7.417 -26.006 1.00 0.00 C ATOM 411 CG1 VAL A 26 -20.558 -7.804 -24.535 1.00 0.00 C ATOM 412 CG2 VAL A 26 -20.474 -5.907 -26.170 1.00 0.00 C ATOM 0 H VAL A 26 -19.192 -10.165 -26.384 1.00 0.00 H new ATOM 0 HA VAL A 26 -19.307 -7.653 -27.739 1.00 0.00 H new ATOM 0 HB VAL A 26 -21.516 -7.747 -26.435 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -21.377 -7.302 -24.020 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -20.678 -8.883 -24.442 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -19.610 -7.505 -24.088 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -21.293 -5.430 -25.632 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -19.523 -5.557 -25.767 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -20.536 -5.651 -27.228 1.00 0.00 H new ATOM 422 N GLU A 27 -17.396 -6.874 -26.269 1.00 0.00 N ATOM 423 CA GLU A 27 -16.139 -6.594 -25.584 1.00 0.00 C ATOM 424 C GLU A 27 -15.756 -5.124 -25.732 1.00 0.00 C ATOM 425 O GLU A 27 -15.583 -4.624 -26.844 1.00 0.00 O ATOM 426 CB GLU A 27 -15.023 -7.482 -26.138 1.00 0.00 C ATOM 427 CG GLU A 27 -14.926 -8.835 -25.453 1.00 0.00 C ATOM 428 CD GLU A 27 -13.551 -9.460 -25.588 1.00 0.00 C ATOM 429 OE1 GLU A 27 -12.715 -8.902 -26.330 1.00 0.00 O ATOM 430 OE2 GLU A 27 -13.311 -10.507 -24.951 1.00 0.00 O ATOM 0 H GLU A 27 -17.649 -6.191 -26.983 1.00 0.00 H new ATOM 0 HA GLU A 27 -16.274 -6.812 -24.525 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -15.187 -7.635 -27.205 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -14.071 -6.962 -26.034 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -15.167 -8.721 -24.396 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -15.670 -9.508 -25.879 1.00 0.00 H new ATOM 437 N HIS A 28 -15.624 -4.437 -24.601 1.00 0.00 N ATOM 438 CA HIS A 28 -15.261 -3.024 -24.604 1.00 0.00 C ATOM 439 C HIS A 28 -14.325 -2.702 -23.442 1.00 0.00 C ATOM 440 O HIS A 28 -14.105 -3.532 -22.561 1.00 0.00 O ATOM 441 CB HIS A 28 -16.515 -2.153 -24.520 1.00 0.00 C ATOM 442 CG HIS A 28 -17.030 -1.716 -25.856 1.00 0.00 C ATOM 443 ND1 HIS A 28 -16.272 -0.999 -26.758 1.00 0.00 N ATOM 444 CD2 HIS A 28 -18.236 -1.899 -26.443 1.00 0.00 C ATOM 445 CE1 HIS A 28 -16.989 -0.759 -27.841 1.00 0.00 C ATOM 446 NE2 HIS A 28 -18.185 -1.295 -27.675 1.00 0.00 N ATOM 0 H HIS A 28 -15.763 -4.835 -23.672 1.00 0.00 H new ATOM 0 HA HIS A 28 -14.741 -2.809 -25.538 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -17.298 -2.706 -24.001 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -16.295 -1.271 -23.918 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -19.081 -2.423 -26.021 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -16.655 -0.217 -28.713 1.00 0.00 H new ATOM 0 HE2 HIS A 28 -18.947 -1.265 -28.352 1.00 0.00 H new ATOM 454 N VAL A 29 -13.776 -1.491 -23.449 1.00 0.00 N ATOM 455 CA VAL A 29 -12.865 -1.059 -22.397 1.00 0.00 C ATOM 456 C VAL A 29 -13.620 -0.743 -21.111 1.00 0.00 C ATOM 457 O VAL A 29 -14.667 -0.096 -21.137 1.00 0.00 O ATOM 458 CB VAL A 29 -12.060 0.182 -22.825 1.00 0.00 C ATOM 459 CG1 VAL A 29 -10.950 0.471 -21.826 1.00 0.00 C ATOM 460 CG2 VAL A 29 -11.493 -0.008 -24.224 1.00 0.00 C ATOM 0 H VAL A 29 -13.947 -0.792 -24.172 1.00 0.00 H new ATOM 0 HA VAL A 29 -12.176 -1.885 -22.217 1.00 0.00 H new ATOM 0 HB VAL A 29 -12.732 1.040 -22.843 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -10.393 1.351 -22.146 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -11.384 0.654 -20.843 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -10.277 -0.385 -21.772 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -10.927 0.878 -24.511 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -10.836 -0.878 -24.235 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -12.309 -0.161 -24.930 1.00 0.00 H new ATOM 470 N TYR A 30 -13.082 -1.203 -19.987 1.00 0.00 N ATOM 471 CA TYR A 30 -13.706 -0.971 -18.690 1.00 0.00 C ATOM 472 C TYR A 30 -12.751 -0.244 -17.748 1.00 0.00 C ATOM 473 O TYR A 30 -11.535 -0.265 -17.940 1.00 0.00 O ATOM 474 CB TYR A 30 -14.145 -2.297 -18.066 1.00 0.00 C ATOM 475 CG TYR A 30 -15.364 -2.902 -18.725 1.00 0.00 C ATOM 476 CD1 TYR A 30 -16.644 -2.499 -18.365 1.00 0.00 C ATOM 477 CD2 TYR A 30 -15.236 -3.877 -19.707 1.00 0.00 C ATOM 478 CE1 TYR A 30 -17.761 -3.050 -18.964 1.00 0.00 C ATOM 479 CE2 TYR A 30 -16.347 -4.432 -20.312 1.00 0.00 C ATOM 480 CZ TYR A 30 -17.607 -4.015 -19.937 1.00 0.00 C ATOM 481 OH TYR A 30 -18.716 -4.566 -20.536 1.00 0.00 O ATOM 0 H TYR A 30 -12.215 -1.739 -19.948 1.00 0.00 H new ATOM 0 HA TYR A 30 -14.583 -0.343 -18.845 1.00 0.00 H new ATOM 0 HB2 TYR A 30 -13.320 -3.007 -18.125 1.00 0.00 H new ATOM 0 HB3 TYR A 30 -14.355 -2.139 -17.008 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -16.768 -1.742 -17.604 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -14.251 -4.207 -20.002 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -18.749 -2.727 -18.672 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -16.230 -5.188 -21.074 1.00 0.00 H new ATOM 0 HH TYR A 30 -19.241 -5.053 -19.867 1.00 0.00 H new ATOM 491 N LYS A 31 -13.311 0.398 -16.728 1.00 0.00 N ATOM 492 CA LYS A 31 -12.511 1.130 -15.753 1.00 0.00 C ATOM 493 C LYS A 31 -12.748 0.596 -14.344 1.00 0.00 C ATOM 494 O LYS A 31 -13.888 0.368 -13.939 1.00 0.00 O ATOM 495 CB LYS A 31 -12.846 2.623 -15.807 1.00 0.00 C ATOM 496 CG LYS A 31 -11.745 3.470 -16.421 1.00 0.00 C ATOM 497 CD LYS A 31 -11.326 4.598 -15.493 1.00 0.00 C ATOM 498 CE LYS A 31 -12.371 5.702 -15.450 1.00 0.00 C ATOM 499 NZ LYS A 31 -12.092 6.688 -14.369 1.00 0.00 N ATOM 0 H LYS A 31 -14.316 0.426 -16.555 1.00 0.00 H new ATOM 0 HA LYS A 31 -11.459 0.990 -16.004 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -13.762 2.761 -16.381 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -13.046 2.979 -14.796 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -10.883 2.842 -16.644 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -12.090 3.886 -17.368 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -11.169 4.205 -14.489 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -10.374 5.010 -15.826 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -12.397 6.215 -16.411 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -13.357 5.263 -15.296 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -12.827 7.424 -14.373 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -12.092 6.204 -13.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -11.162 7.126 -14.530 1.00 0.00 H new ATOM 513 N PHE A 32 -11.664 0.399 -13.601 1.00 0.00 N ATOM 514 CA PHE A 32 -11.755 -0.107 -12.236 1.00 0.00 C ATOM 515 C PHE A 32 -11.169 0.893 -11.244 1.00 0.00 C ATOM 516 O PHE A 32 -10.091 1.445 -11.466 1.00 0.00 O ATOM 517 CB PHE A 32 -11.024 -1.447 -12.118 1.00 0.00 C ATOM 518 CG PHE A 32 -11.613 -2.529 -12.978 1.00 0.00 C ATOM 519 CD1 PHE A 32 -11.356 -2.567 -14.339 1.00 0.00 C ATOM 520 CD2 PHE A 32 -12.423 -3.508 -12.425 1.00 0.00 C ATOM 521 CE1 PHE A 32 -11.898 -3.561 -15.132 1.00 0.00 C ATOM 522 CE2 PHE A 32 -12.967 -4.504 -13.213 1.00 0.00 C ATOM 523 CZ PHE A 32 -12.703 -4.531 -14.568 1.00 0.00 C ATOM 0 H PHE A 32 -10.713 0.582 -13.921 1.00 0.00 H new ATOM 0 HA PHE A 32 -12.809 -0.252 -11.998 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -9.978 -1.306 -12.390 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -11.042 -1.771 -11.077 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -10.726 -1.812 -14.785 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -12.632 -3.492 -11.365 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -11.692 -3.579 -16.192 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -13.598 -5.260 -12.770 1.00 0.00 H new ATOM 0 HZ PHE A 32 -13.125 -5.310 -15.186 1.00 0.00 H new ATOM 533 N ARG A 33 -11.888 1.123 -10.150 1.00 0.00 N ATOM 534 CA ARG A 33 -11.441 2.058 -9.125 1.00 0.00 C ATOM 535 C ARG A 33 -11.277 1.354 -7.781 1.00 0.00 C ATOM 536 O ARG A 33 -12.234 0.802 -7.238 1.00 0.00 O ATOM 537 CB ARG A 33 -12.436 3.213 -8.990 1.00 0.00 C ATOM 538 CG ARG A 33 -12.415 4.175 -10.166 1.00 0.00 C ATOM 539 CD ARG A 33 -13.591 5.139 -10.118 1.00 0.00 C ATOM 540 NE ARG A 33 -13.300 6.391 -10.811 1.00 0.00 N ATOM 541 CZ ARG A 33 -14.235 7.258 -11.184 1.00 0.00 C ATOM 542 NH1 ARG A 33 -15.513 7.010 -10.932 1.00 0.00 N ATOM 543 NH2 ARG A 33 -13.891 8.376 -11.811 1.00 0.00 N ATOM 0 H ARG A 33 -12.782 0.675 -9.951 1.00 0.00 H new ATOM 0 HA ARG A 33 -10.472 2.455 -9.428 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -13.441 2.805 -8.883 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -12.217 3.765 -8.076 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -11.481 4.738 -10.161 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -12.443 3.612 -11.099 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -14.464 4.669 -10.570 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -13.845 5.350 -9.079 1.00 0.00 H new ATOM 0 HE ARG A 33 -12.326 6.612 -11.020 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -15.781 6.152 -10.450 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -16.228 7.678 -11.220 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -12.909 8.570 -12.007 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -14.609 9.042 -12.097 1.00 0.00 H new ATOM 557 N ILE A 34 -10.058 1.377 -7.252 1.00 0.00 N ATOM 558 CA ILE A 34 -9.770 0.742 -5.972 1.00 0.00 C ATOM 559 C ILE A 34 -9.725 1.770 -4.846 1.00 0.00 C ATOM 560 O ILE A 34 -8.899 2.683 -4.855 1.00 0.00 O ATOM 561 CB ILE A 34 -8.431 -0.019 -6.011 1.00 0.00 C ATOM 562 CG1 ILE A 34 -8.579 -1.315 -6.810 1.00 0.00 C ATOM 563 CG2 ILE A 34 -7.949 -0.314 -4.598 1.00 0.00 C ATOM 564 CD1 ILE A 34 -9.588 -2.276 -6.221 1.00 0.00 C ATOM 0 H ILE A 34 -9.255 1.828 -7.690 1.00 0.00 H new ATOM 0 HA ILE A 34 -10.576 0.034 -5.782 1.00 0.00 H new ATOM 0 HB ILE A 34 -7.688 0.607 -6.505 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -8.874 -1.071 -7.831 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -7.609 -1.809 -6.868 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -7.002 -0.852 -4.641 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -7.810 0.623 -4.058 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -8.690 -0.924 -4.081 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -9.641 -3.172 -6.839 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -9.284 -2.549 -5.211 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -10.568 -1.800 -6.188 1.00 0.00 H new ATOM 576 N THR A 35 -10.620 1.614 -3.875 1.00 0.00 N ATOM 577 CA THR A 35 -10.683 2.527 -2.740 1.00 0.00 C ATOM 578 C THR A 35 -10.120 1.879 -1.481 1.00 0.00 C ATOM 579 O THR A 35 -10.296 0.681 -1.257 1.00 0.00 O ATOM 580 CB THR A 35 -12.128 2.985 -2.467 1.00 0.00 C ATOM 581 OG1 THR A 35 -12.943 1.857 -2.129 1.00 0.00 O ATOM 582 CG2 THR A 35 -12.710 3.691 -3.682 1.00 0.00 C ATOM 0 H THR A 35 -11.311 0.864 -3.852 1.00 0.00 H new ATOM 0 HA THR A 35 -10.078 3.396 -2.999 1.00 0.00 H new ATOM 0 HB THR A 35 -12.113 3.685 -1.632 1.00 0.00 H new ATOM 0 HG1 THR A 35 -13.660 2.141 -1.525 1.00 0.00 H new ATOM 0 HG21 THR A 35 -13.731 4.005 -3.466 1.00 0.00 H new ATOM 0 HG22 THR A 35 -12.104 4.565 -3.920 1.00 0.00 H new ATOM 0 HG23 THR A 35 -12.713 3.009 -4.532 1.00 0.00 H new ATOM 590 N GLN A 36 -9.444 2.677 -0.661 1.00 0.00 N ATOM 591 CA GLN A 36 -8.856 2.179 0.577 1.00 0.00 C ATOM 592 C GLN A 36 -9.714 2.560 1.779 1.00 0.00 C ATOM 593 O GLN A 36 -9.782 3.728 2.161 1.00 0.00 O ATOM 594 CB GLN A 36 -7.440 2.730 0.751 1.00 0.00 C ATOM 595 CG GLN A 36 -6.498 1.772 1.462 1.00 0.00 C ATOM 596 CD GLN A 36 -5.444 2.491 2.282 1.00 0.00 C ATOM 597 OE1 GLN A 36 -5.340 3.717 2.242 1.00 0.00 O ATOM 598 NE2 GLN A 36 -4.655 1.729 3.030 1.00 0.00 N ATOM 0 H GLN A 36 -9.290 3.671 -0.831 1.00 0.00 H new ATOM 0 HA GLN A 36 -8.810 1.092 0.517 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -7.029 2.970 -0.230 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -7.488 3.663 1.313 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -7.076 1.117 2.114 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -6.008 1.136 0.725 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -4.777 0.716 3.032 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -3.927 2.156 3.602 1.00 0.00 H new ATOM 607 N GLY A 37 -10.369 1.566 2.371 1.00 0.00 N ATOM 608 CA GLY A 37 -11.215 1.818 3.524 1.00 0.00 C ATOM 609 C GLY A 37 -12.577 2.358 3.136 1.00 0.00 C ATOM 610 O GLY A 37 -13.602 1.889 3.630 1.00 0.00 O ATOM 0 H GLY A 37 -10.329 0.591 2.073 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -11.341 0.893 4.087 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -10.720 2.529 4.185 1.00 0.00 H new ATOM 614 N GLY A 38 -12.589 3.349 2.250 1.00 0.00 N ATOM 615 CA GLY A 38 -13.841 3.939 1.813 1.00 0.00 C ATOM 616 C GLY A 38 -13.634 5.120 0.886 1.00 0.00 C ATOM 617 O GLY A 38 -14.574 5.856 0.586 1.00 0.00 O ATOM 0 H GLY A 38 -11.754 3.754 1.827 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -14.437 3.182 1.304 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -14.411 4.261 2.685 1.00 0.00 H new ATOM 621 N LYS A 39 -12.399 5.305 0.433 1.00 0.00 N ATOM 622 CA LYS A 39 -12.069 6.405 -0.465 1.00 0.00 C ATOM 623 C LYS A 39 -11.154 5.934 -1.591 1.00 0.00 C ATOM 624 O LYS A 39 -10.304 5.066 -1.392 1.00 0.00 O ATOM 625 CB LYS A 39 -11.397 7.540 0.311 1.00 0.00 C ATOM 626 CG LYS A 39 -11.549 8.900 -0.346 1.00 0.00 C ATOM 627 CD LYS A 39 -11.006 10.011 0.538 1.00 0.00 C ATOM 628 CE LYS A 39 -11.246 11.381 -0.078 1.00 0.00 C ATOM 629 NZ LYS A 39 -11.050 12.476 0.912 1.00 0.00 N ATOM 0 H LYS A 39 -11.609 4.706 0.673 1.00 0.00 H new ATOM 0 HA LYS A 39 -12.997 6.772 -0.904 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -11.819 7.582 1.315 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -10.336 7.315 0.420 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -11.024 8.904 -1.301 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -12.601 9.086 -0.560 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -11.481 9.963 1.518 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -9.937 9.863 0.695 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -10.567 11.525 -0.918 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -12.260 11.428 -0.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -11.223 13.393 0.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -11.715 12.353 1.702 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -10.075 12.447 1.273 1.00 0.00 H new ATOM 643 N VAL A 40 -11.334 6.512 -2.775 1.00 0.00 N ATOM 644 CA VAL A 40 -10.523 6.153 -3.932 1.00 0.00 C ATOM 645 C VAL A 40 -9.044 6.413 -3.668 1.00 0.00 C ATOM 646 O VAL A 40 -8.668 7.474 -3.170 1.00 0.00 O ATOM 647 CB VAL A 40 -10.955 6.936 -5.185 1.00 0.00 C ATOM 648 CG1 VAL A 40 -9.909 6.809 -6.282 1.00 0.00 C ATOM 649 CG2 VAL A 40 -12.313 6.452 -5.673 1.00 0.00 C ATOM 0 H VAL A 40 -12.034 7.231 -2.958 1.00 0.00 H new ATOM 0 HA VAL A 40 -10.676 5.088 -4.108 1.00 0.00 H new ATOM 0 HB VAL A 40 -11.043 7.990 -4.921 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -10.232 7.369 -7.159 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -8.959 7.208 -5.927 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -9.785 5.759 -6.547 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -12.603 7.016 -6.559 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -12.254 5.392 -5.921 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -13.056 6.601 -4.889 1.00 0.00 H new ATOM 659 N VAL A 41 -8.208 5.437 -4.008 1.00 0.00 N ATOM 660 CA VAL A 41 -6.768 5.560 -3.810 1.00 0.00 C ATOM 661 C VAL A 41 -6.007 5.223 -5.087 1.00 0.00 C ATOM 662 O VAL A 41 -4.800 5.449 -5.182 1.00 0.00 O ATOM 663 CB VAL A 41 -6.277 4.642 -2.675 1.00 0.00 C ATOM 664 CG1 VAL A 41 -6.618 5.240 -1.318 1.00 0.00 C ATOM 665 CG2 VAL A 41 -6.876 3.251 -2.819 1.00 0.00 C ATOM 0 H VAL A 41 -8.503 4.553 -4.422 1.00 0.00 H new ATOM 0 HA VAL A 41 -6.573 6.597 -3.538 1.00 0.00 H new ATOM 0 HB VAL A 41 -5.193 4.556 -2.745 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -6.263 4.577 -0.529 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -6.137 6.213 -1.218 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -7.698 5.359 -1.234 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -6.519 2.615 -2.009 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -7.963 3.317 -2.776 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -6.576 2.823 -3.775 1.00 0.00 H new ATOM 675 N LYS A 42 -6.720 4.682 -6.069 1.00 0.00 N ATOM 676 CA LYS A 42 -6.114 4.315 -7.343 1.00 0.00 C ATOM 677 C LYS A 42 -7.176 3.866 -8.342 1.00 0.00 C ATOM 678 O LYS A 42 -8.271 3.461 -7.956 1.00 0.00 O ATOM 679 CB LYS A 42 -5.085 3.201 -7.139 1.00 0.00 C ATOM 680 CG LYS A 42 -4.098 3.067 -8.286 1.00 0.00 C ATOM 681 CD LYS A 42 -3.119 1.930 -8.049 1.00 0.00 C ATOM 682 CE LYS A 42 -1.983 2.355 -7.131 1.00 0.00 C ATOM 683 NZ LYS A 42 -0.768 1.516 -7.328 1.00 0.00 N ATOM 0 H LYS A 42 -7.719 4.488 -6.007 1.00 0.00 H new ATOM 0 HA LYS A 42 -5.612 5.195 -7.745 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -4.535 3.391 -6.217 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -5.608 2.254 -7.009 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -4.640 2.894 -9.215 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -3.550 4.001 -8.406 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -3.644 1.081 -7.611 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -2.711 1.595 -9.003 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -1.737 3.400 -7.318 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -2.309 2.285 -6.093 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -0.017 1.837 -6.685 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -0.996 0.522 -7.125 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -0.442 1.603 -8.312 1.00 0.00 H new ATOM 697 N ASN A 43 -6.842 3.939 -9.626 1.00 0.00 N ATOM 698 CA ASN A 43 -7.768 3.538 -10.680 1.00 0.00 C ATOM 699 C ASN A 43 -7.030 2.825 -11.809 1.00 0.00 C ATOM 700 O ASN A 43 -6.061 3.348 -12.359 1.00 0.00 O ATOM 701 CB ASN A 43 -8.506 4.760 -11.230 1.00 0.00 C ATOM 702 CG ASN A 43 -7.565 5.897 -11.577 1.00 0.00 C ATOM 703 OD1 ASN A 43 -6.994 5.934 -12.668 1.00 0.00 O ATOM 704 ND2 ASN A 43 -7.398 6.831 -10.648 1.00 0.00 N ATOM 0 H ASN A 43 -5.938 4.272 -9.962 1.00 0.00 H new ATOM 0 HA ASN A 43 -8.493 2.847 -10.250 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -9.067 4.472 -12.119 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -9.232 5.105 -10.493 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -6.776 7.620 -10.824 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -7.892 6.759 -9.758 1.00 0.00 H new ATOM 711 N TRP A 44 -7.496 1.628 -12.148 1.00 0.00 N ATOM 712 CA TRP A 44 -6.881 0.843 -13.213 1.00 0.00 C ATOM 713 C TRP A 44 -7.759 0.833 -14.459 1.00 0.00 C ATOM 714 O TRP A 44 -8.960 1.096 -14.386 1.00 0.00 O ATOM 715 CB TRP A 44 -6.632 -0.590 -12.738 1.00 0.00 C ATOM 716 CG TRP A 44 -5.444 -0.717 -11.833 1.00 0.00 C ATOM 717 CD1 TRP A 44 -5.418 -0.517 -10.482 1.00 0.00 C ATOM 718 CD2 TRP A 44 -4.111 -1.072 -12.213 1.00 0.00 C ATOM 719 NE1 TRP A 44 -4.149 -0.726 -10.000 1.00 0.00 N ATOM 720 CE2 TRP A 44 -3.328 -1.068 -11.042 1.00 0.00 C ATOM 721 CE3 TRP A 44 -3.502 -1.394 -13.429 1.00 0.00 C ATOM 722 CZ2 TRP A 44 -1.970 -1.373 -11.054 1.00 0.00 C ATOM 723 CZ3 TRP A 44 -2.153 -1.696 -13.439 1.00 0.00 C ATOM 724 CH2 TRP A 44 -1.399 -1.685 -12.258 1.00 0.00 C ATOM 0 H TRP A 44 -8.296 1.180 -11.702 1.00 0.00 H new ATOM 0 HA TRP A 44 -5.928 1.306 -13.468 1.00 0.00 H new ATOM 0 HB2 TRP A 44 -7.518 -0.951 -12.216 1.00 0.00 H new ATOM 0 HB3 TRP A 44 -6.489 -1.233 -13.606 1.00 0.00 H new ATOM 0 HD1 TRP A 44 -6.270 -0.236 -9.881 1.00 0.00 H new ATOM 0 HE1 TRP A 44 -3.864 -0.640 -9.024 1.00 0.00 H new ATOM 0 HE3 TRP A 44 -4.075 -1.407 -14.344 1.00 0.00 H new ATOM 0 HZ2 TRP A 44 -1.387 -1.364 -10.145 1.00 0.00 H new ATOM 0 HZ3 TRP A 44 -1.672 -1.945 -14.373 1.00 0.00 H new ATOM 0 HH2 TRP A 44 -0.347 -1.927 -12.299 1.00 0.00 H new ATOM 735 N VAL A 45 -7.154 0.528 -15.602 1.00 0.00 N ATOM 736 CA VAL A 45 -7.882 0.483 -16.865 1.00 0.00 C ATOM 737 C VAL A 45 -7.716 -0.870 -17.547 1.00 0.00 C ATOM 738 O VAL A 45 -6.607 -1.394 -17.648 1.00 0.00 O ATOM 739 CB VAL A 45 -7.409 1.591 -17.825 1.00 0.00 C ATOM 740 CG1 VAL A 45 -5.908 1.494 -18.054 1.00 0.00 C ATOM 741 CG2 VAL A 45 -8.164 1.511 -19.143 1.00 0.00 C ATOM 0 H VAL A 45 -6.161 0.308 -15.680 1.00 0.00 H new ATOM 0 HA VAL A 45 -8.934 0.641 -16.630 1.00 0.00 H new ATOM 0 HB VAL A 45 -7.621 2.558 -17.369 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -5.592 2.285 -18.735 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -5.387 1.604 -17.103 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -5.668 0.524 -18.489 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -7.817 2.301 -19.809 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -7.985 0.541 -19.606 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -9.231 1.634 -18.959 1.00 0.00 H new ATOM 751 N MET A 46 -8.827 -1.431 -18.014 1.00 0.00 N ATOM 752 CA MET A 46 -8.804 -2.724 -18.688 1.00 0.00 C ATOM 753 C MET A 46 -8.911 -2.550 -20.200 1.00 0.00 C ATOM 754 O MET A 46 -9.905 -2.028 -20.705 1.00 0.00 O ATOM 755 CB MET A 46 -9.946 -3.607 -18.182 1.00 0.00 C ATOM 756 CG MET A 46 -10.006 -4.968 -18.857 1.00 0.00 C ATOM 757 SD MET A 46 -10.813 -6.215 -17.835 1.00 0.00 S ATOM 758 CE MET A 46 -12.537 -5.831 -18.128 1.00 0.00 C ATOM 0 H MET A 46 -9.753 -1.011 -17.938 1.00 0.00 H new ATOM 0 HA MET A 46 -7.854 -3.207 -18.462 1.00 0.00 H new ATOM 0 HB2 MET A 46 -9.836 -3.748 -17.107 1.00 0.00 H new ATOM 0 HB3 MET A 46 -10.892 -3.090 -18.341 1.00 0.00 H new ATOM 0 HG2 MET A 46 -10.541 -4.877 -19.802 1.00 0.00 H new ATOM 0 HG3 MET A 46 -8.994 -5.297 -19.093 1.00 0.00 H new ATOM 0 HE1 MET A 46 -13.119 -6.752 -18.132 1.00 0.00 H new ATOM 0 HE2 MET A 46 -12.903 -5.174 -17.339 1.00 0.00 H new ATOM 0 HE3 MET A 46 -12.640 -5.332 -19.092 1.00 0.00 H new ATOM 768 N ASP A 47 -7.883 -2.990 -20.916 1.00 0.00 N ATOM 769 CA ASP A 47 -7.862 -2.884 -22.370 1.00 0.00 C ATOM 770 C ASP A 47 -8.478 -4.122 -23.014 1.00 0.00 C ATOM 771 O ASP A 47 -7.956 -5.230 -22.880 1.00 0.00 O ATOM 772 CB ASP A 47 -6.429 -2.694 -22.869 1.00 0.00 C ATOM 773 CG ASP A 47 -6.338 -1.688 -24.000 1.00 0.00 C ATOM 774 OD1 ASP A 47 -6.941 -1.937 -25.065 1.00 0.00 O ATOM 775 OD2 ASP A 47 -5.663 -0.653 -23.821 1.00 0.00 O ATOM 0 H ASP A 47 -7.052 -3.424 -20.513 1.00 0.00 H new ATOM 0 HA ASP A 47 -8.455 -2.015 -22.654 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -5.800 -2.364 -22.042 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -6.035 -3.653 -23.207 1.00 0.00 H new ATOM 780 N LEU A 48 -9.591 -3.927 -23.713 1.00 0.00 N ATOM 781 CA LEU A 48 -10.280 -5.029 -24.377 1.00 0.00 C ATOM 782 C LEU A 48 -9.881 -5.112 -25.847 1.00 0.00 C ATOM 783 O LEU A 48 -10.072 -6.141 -26.496 1.00 0.00 O ATOM 784 CB LEU A 48 -11.795 -4.855 -24.257 1.00 0.00 C ATOM 785 CG LEU A 48 -12.509 -5.825 -23.314 1.00 0.00 C ATOM 786 CD1 LEU A 48 -12.223 -7.265 -23.713 1.00 0.00 C ATOM 787 CD2 LEU A 48 -12.088 -5.575 -21.873 1.00 0.00 C ATOM 0 H LEU A 48 -10.035 -3.017 -23.835 1.00 0.00 H new ATOM 0 HA LEU A 48 -9.987 -5.957 -23.887 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -11.998 -3.838 -23.922 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -12.232 -4.957 -25.250 1.00 0.00 H new ATOM 0 HG LEU A 48 -13.583 -5.654 -23.393 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -12.739 -7.941 -23.031 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -12.575 -7.437 -24.730 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -11.150 -7.450 -23.664 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -12.606 -6.274 -21.216 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -11.012 -5.718 -21.778 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -12.345 -4.554 -21.591 1.00 0.00 H new ATOM 799 N LYS A 49 -9.325 -4.023 -26.367 1.00 0.00 N ATOM 800 CA LYS A 49 -8.896 -3.973 -27.759 1.00 0.00 C ATOM 801 C LYS A 49 -7.553 -4.675 -27.940 1.00 0.00 C ATOM 802 O LYS A 49 -7.328 -5.355 -28.941 1.00 0.00 O ATOM 803 CB LYS A 49 -8.791 -2.521 -28.230 1.00 0.00 C ATOM 804 CG LYS A 49 -8.023 -2.356 -29.530 1.00 0.00 C ATOM 805 CD LYS A 49 -8.720 -3.058 -30.683 1.00 0.00 C ATOM 806 CE LYS A 49 -7.719 -3.628 -31.676 1.00 0.00 C ATOM 807 NZ LYS A 49 -8.287 -3.712 -33.050 1.00 0.00 N ATOM 0 H LYS A 49 -9.161 -3.163 -25.844 1.00 0.00 H new ATOM 0 HA LYS A 49 -9.642 -4.491 -28.362 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -9.795 -2.116 -28.357 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -8.305 -1.930 -27.453 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -7.917 -1.296 -29.759 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -7.017 -2.758 -29.413 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -9.347 -3.861 -30.296 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -9.380 -2.356 -31.192 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -6.826 -3.004 -31.690 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -7.409 -4.621 -31.350 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -7.574 -4.105 -33.697 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -9.125 -4.328 -33.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -8.559 -2.761 -33.372 1.00 0.00 H new ATOM 821 N ASN A 50 -6.666 -4.506 -26.965 1.00 0.00 N ATOM 822 CA ASN A 50 -5.347 -5.124 -27.017 1.00 0.00 C ATOM 823 C ASN A 50 -5.277 -6.337 -26.094 1.00 0.00 C ATOM 824 O ASN A 50 -4.360 -7.153 -26.191 1.00 0.00 O ATOM 825 CB ASN A 50 -4.269 -4.110 -26.627 1.00 0.00 C ATOM 826 CG ASN A 50 -3.153 -4.030 -27.650 1.00 0.00 C ATOM 827 OD1 ASN A 50 -3.321 -3.456 -28.726 1.00 0.00 O ATOM 828 ND2 ASN A 50 -2.004 -4.609 -27.318 1.00 0.00 N ATOM 0 H ASN A 50 -6.837 -3.946 -26.130 1.00 0.00 H new ATOM 0 HA ASN A 50 -5.170 -5.457 -28.040 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -4.724 -3.126 -26.512 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -3.851 -4.383 -25.658 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -1.217 -4.589 -27.966 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -1.909 -5.074 -26.415 1.00 0.00 H new ATOM 835 N VAL A 51 -6.253 -6.449 -25.199 1.00 0.00 N ATOM 836 CA VAL A 51 -6.305 -7.562 -24.259 1.00 0.00 C ATOM 837 C VAL A 51 -5.147 -7.500 -23.269 1.00 0.00 C ATOM 838 O VAL A 51 -4.449 -8.490 -23.049 1.00 0.00 O ATOM 839 CB VAL A 51 -6.267 -8.917 -24.991 1.00 0.00 C ATOM 840 CG1 VAL A 51 -6.657 -10.044 -24.048 1.00 0.00 C ATOM 841 CG2 VAL A 51 -7.179 -8.889 -26.208 1.00 0.00 C ATOM 0 H VAL A 51 -7.019 -5.782 -25.105 1.00 0.00 H new ATOM 0 HA VAL A 51 -7.247 -7.475 -23.718 1.00 0.00 H new ATOM 0 HB VAL A 51 -5.248 -9.098 -25.333 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -6.625 -10.993 -24.583 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -5.960 -10.075 -23.210 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -7.666 -9.873 -23.674 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -7.141 -9.854 -26.714 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -8.202 -8.686 -25.891 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -6.849 -8.107 -26.892 1.00 0.00 H new ATOM 851 N LYS A 52 -4.948 -6.329 -22.673 1.00 0.00 N ATOM 852 CA LYS A 52 -3.875 -6.135 -21.705 1.00 0.00 C ATOM 853 C LYS A 52 -4.306 -5.175 -20.601 1.00 0.00 C ATOM 854 O LYS A 52 -5.074 -4.242 -20.840 1.00 0.00 O ATOM 855 CB LYS A 52 -2.622 -5.600 -22.400 1.00 0.00 C ATOM 856 CG LYS A 52 -1.488 -5.272 -21.444 1.00 0.00 C ATOM 857 CD LYS A 52 -0.288 -4.698 -22.178 1.00 0.00 C ATOM 858 CE LYS A 52 0.985 -4.833 -21.355 1.00 0.00 C ATOM 859 NZ LYS A 52 1.469 -6.240 -21.309 1.00 0.00 N ATOM 0 H LYS A 52 -5.516 -5.499 -22.844 1.00 0.00 H new ATOM 0 HA LYS A 52 -3.647 -7.101 -21.255 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -2.274 -6.338 -23.123 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -2.883 -4.703 -22.961 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -1.835 -4.557 -20.698 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -1.191 -6.173 -20.908 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -0.163 -5.212 -23.131 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -0.467 -3.647 -22.404 1.00 0.00 H new ATOM 0 HE2 LYS A 52 1.761 -4.196 -21.779 1.00 0.00 H new ATOM 0 HE3 LYS A 52 0.801 -4.479 -20.341 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 2.445 -6.260 -20.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 0.857 -6.797 -20.679 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 1.443 -6.647 -22.266 1.00 0.00 H new ATOM 873 N LEU A 53 -3.807 -5.408 -19.392 1.00 0.00 N ATOM 874 CA LEU A 53 -4.139 -4.562 -18.251 1.00 0.00 C ATOM 875 C LEU A 53 -3.052 -3.519 -18.011 1.00 0.00 C ATOM 876 O LEU A 53 -1.863 -3.838 -17.998 1.00 0.00 O ATOM 877 CB LEU A 53 -4.328 -5.416 -16.996 1.00 0.00 C ATOM 878 CG LEU A 53 -5.746 -5.469 -16.427 1.00 0.00 C ATOM 879 CD1 LEU A 53 -6.696 -6.118 -17.422 1.00 0.00 C ATOM 880 CD2 LEU A 53 -5.763 -6.219 -15.103 1.00 0.00 C ATOM 0 H LEU A 53 -3.171 -6.176 -19.177 1.00 0.00 H new ATOM 0 HA LEU A 53 -5.071 -4.043 -18.474 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -4.011 -6.434 -17.222 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -3.661 -5.039 -16.221 1.00 0.00 H new ATOM 0 HG LEU A 53 -6.083 -4.448 -16.247 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -7.701 -6.147 -17.000 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -6.707 -5.539 -18.345 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -6.362 -7.134 -17.635 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -6.781 -6.246 -14.713 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -5.406 -7.237 -15.257 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -5.115 -5.711 -14.389 1.00 0.00 H new ATOM 892 N VAL A 54 -3.468 -2.271 -17.820 1.00 0.00 N ATOM 893 CA VAL A 54 -2.530 -1.182 -17.578 1.00 0.00 C ATOM 894 C VAL A 54 -3.095 -0.184 -16.573 1.00 0.00 C ATOM 895 O VAL A 54 -4.298 -0.161 -16.317 1.00 0.00 O ATOM 896 CB VAL A 54 -2.182 -0.440 -18.882 1.00 0.00 C ATOM 897 CG1 VAL A 54 -0.870 0.315 -18.733 1.00 0.00 C ATOM 898 CG2 VAL A 54 -2.117 -1.414 -20.048 1.00 0.00 C ATOM 0 H VAL A 54 -4.448 -1.989 -17.828 1.00 0.00 H new ATOM 0 HA VAL A 54 -1.623 -1.630 -17.171 1.00 0.00 H new ATOM 0 HB VAL A 54 -2.969 0.285 -19.088 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -0.641 0.833 -19.664 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -0.958 1.042 -17.926 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -0.070 -0.388 -18.502 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -1.870 -0.872 -20.961 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -1.351 -2.165 -19.853 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -3.083 -1.904 -20.167 1.00 0.00 H new ATOM 908 N GLU A 55 -2.218 0.640 -16.008 1.00 0.00 N ATOM 909 CA GLU A 55 -2.630 1.641 -15.031 1.00 0.00 C ATOM 910 C GLU A 55 -2.847 2.996 -15.698 1.00 0.00 C ATOM 911 O GLU A 55 -1.892 3.660 -16.102 1.00 0.00 O ATOM 912 CB GLU A 55 -1.582 1.767 -13.923 1.00 0.00 C ATOM 913 CG GLU A 55 -0.151 1.756 -14.435 1.00 0.00 C ATOM 914 CD GLU A 55 0.778 2.601 -13.586 1.00 0.00 C ATOM 915 OE1 GLU A 55 0.650 2.561 -12.345 1.00 0.00 O ATOM 916 OE2 GLU A 55 1.635 3.302 -14.165 1.00 0.00 O ATOM 0 H GLU A 55 -1.218 0.634 -16.210 1.00 0.00 H new ATOM 0 HA GLU A 55 -3.574 1.316 -14.593 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -1.755 2.692 -13.374 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -1.712 0.948 -13.216 1.00 0.00 H new ATOM 0 HG2 GLU A 55 0.215 0.730 -14.457 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -0.133 2.123 -15.461 1.00 0.00 H new ATOM 923 N SER A 56 -4.108 3.399 -15.810 1.00 0.00 N ATOM 924 CA SER A 56 -4.452 4.673 -16.432 1.00 0.00 C ATOM 925 C SER A 56 -5.757 5.221 -15.863 1.00 0.00 C ATOM 926 O SER A 56 -6.464 4.532 -15.127 1.00 0.00 O ATOM 927 CB SER A 56 -4.573 4.508 -17.948 1.00 0.00 C ATOM 928 OG SER A 56 -4.424 5.752 -18.610 1.00 0.00 O ATOM 0 H SER A 56 -4.909 2.862 -15.478 1.00 0.00 H new ATOM 0 HA SER A 56 -3.654 5.383 -16.213 1.00 0.00 H new ATOM 0 HB2 SER A 56 -3.814 3.811 -18.303 1.00 0.00 H new ATOM 0 HB3 SER A 56 -5.543 4.076 -18.194 1.00 0.00 H new ATOM 0 HG SER A 56 -4.504 5.619 -19.578 1.00 0.00 H new ATOM 934 N ASP A 57 -6.068 6.465 -16.208 1.00 0.00 N ATOM 935 CA ASP A 57 -7.288 7.107 -15.733 1.00 0.00 C ATOM 936 C ASP A 57 -8.242 7.387 -16.891 1.00 0.00 C ATOM 937 O ASP A 57 -9.263 8.053 -16.720 1.00 0.00 O ATOM 938 CB ASP A 57 -6.954 8.410 -15.005 1.00 0.00 C ATOM 939 CG ASP A 57 -7.956 8.738 -13.915 1.00 0.00 C ATOM 940 OD1 ASP A 57 -9.140 8.956 -14.244 1.00 0.00 O ATOM 941 OD2 ASP A 57 -7.555 8.778 -12.733 1.00 0.00 O ATOM 0 H ASP A 57 -5.493 7.049 -16.815 1.00 0.00 H new ATOM 0 HA ASP A 57 -7.780 6.427 -15.037 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -5.958 8.334 -14.568 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -6.924 9.228 -15.725 1.00 0.00 H new ATOM 946 N ASP A 58 -7.900 6.876 -18.068 1.00 0.00 N ATOM 947 CA ASP A 58 -8.725 7.070 -19.255 1.00 0.00 C ATOM 948 C ASP A 58 -10.173 6.679 -18.980 1.00 0.00 C ATOM 949 O ASP A 58 -10.461 5.957 -18.025 1.00 0.00 O ATOM 950 CB ASP A 58 -8.175 6.252 -20.424 1.00 0.00 C ATOM 951 CG ASP A 58 -8.769 6.671 -21.754 1.00 0.00 C ATOM 952 OD1 ASP A 58 -8.391 7.748 -22.260 1.00 0.00 O ATOM 953 OD2 ASP A 58 -9.612 5.921 -22.289 1.00 0.00 O ATOM 0 H ASP A 58 -7.057 6.324 -18.226 1.00 0.00 H new ATOM 0 HA ASP A 58 -8.697 8.127 -19.518 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -7.091 6.362 -20.463 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -8.382 5.196 -20.254 1.00 0.00 H new ATOM 958 N ALA A 59 -11.081 7.161 -19.822 1.00 0.00 N ATOM 959 CA ALA A 59 -12.500 6.861 -19.670 1.00 0.00 C ATOM 960 C ALA A 59 -12.897 5.649 -20.506 1.00 0.00 C ATOM 961 O ALA A 59 -12.424 5.476 -21.629 1.00 0.00 O ATOM 962 CB ALA A 59 -13.339 8.069 -20.056 1.00 0.00 C ATOM 0 H ALA A 59 -10.860 7.761 -20.617 1.00 0.00 H new ATOM 0 HA ALA A 59 -12.686 6.624 -18.623 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -14.396 7.831 -19.938 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -13.083 8.911 -19.413 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -13.141 8.333 -21.095 1.00 0.00 H new ATOM 968 N ALA A 60 -13.767 4.812 -19.951 1.00 0.00 N ATOM 969 CA ALA A 60 -14.228 3.617 -20.647 1.00 0.00 C ATOM 970 C ALA A 60 -15.748 3.607 -20.772 1.00 0.00 C ATOM 971 O ALA A 60 -16.426 4.511 -20.284 1.00 0.00 O ATOM 972 CB ALA A 60 -13.748 2.367 -19.924 1.00 0.00 C ATOM 0 H ALA A 60 -14.167 4.939 -19.021 1.00 0.00 H new ATOM 0 HA ALA A 60 -13.807 3.626 -21.652 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -14.100 1.482 -20.455 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -12.659 2.361 -19.891 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -14.142 2.361 -18.908 1.00 0.00 H new ATOM 978 N GLU A 61 -16.276 2.580 -21.431 1.00 0.00 N ATOM 979 CA GLU A 61 -17.716 2.455 -21.622 1.00 0.00 C ATOM 980 C GLU A 61 -18.445 2.459 -20.281 1.00 0.00 C ATOM 981 O GLU A 61 -19.634 2.770 -20.209 1.00 0.00 O ATOM 982 CB GLU A 61 -18.042 1.172 -22.388 1.00 0.00 C ATOM 983 CG GLU A 61 -17.925 1.317 -23.896 1.00 0.00 C ATOM 984 CD GLU A 61 -19.263 1.569 -24.563 1.00 0.00 C ATOM 985 OE1 GLU A 61 -19.808 2.681 -24.400 1.00 0.00 O ATOM 986 OE2 GLU A 61 -19.765 0.654 -25.250 1.00 0.00 O ATOM 0 H GLU A 61 -15.728 1.823 -21.841 1.00 0.00 H new ATOM 0 HA GLU A 61 -18.055 3.312 -22.203 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -17.372 0.380 -22.055 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -19.056 0.858 -22.139 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -17.248 2.139 -24.127 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -17.481 0.412 -24.311 1.00 0.00 H new ATOM 993 N ALA A 62 -17.723 2.111 -19.221 1.00 0.00 N ATOM 994 CA ALA A 62 -18.299 2.076 -17.882 1.00 0.00 C ATOM 995 C ALA A 62 -17.211 2.112 -16.815 1.00 0.00 C ATOM 996 O ALA A 62 -16.045 1.827 -17.091 1.00 0.00 O ATOM 997 CB ALA A 62 -19.165 0.836 -17.713 1.00 0.00 C ATOM 0 H ALA A 62 -16.738 1.849 -19.263 1.00 0.00 H new ATOM 0 HA ALA A 62 -18.922 2.962 -17.758 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -19.589 0.822 -16.709 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -19.971 0.852 -18.447 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -18.556 -0.056 -17.862 1.00 0.00 H new ATOM 1003 N THR A 63 -17.598 2.467 -15.593 1.00 0.00 N ATOM 1004 CA THR A 63 -16.655 2.543 -14.485 1.00 0.00 C ATOM 1005 C THR A 63 -17.155 1.751 -13.282 1.00 0.00 C ATOM 1006 O THR A 63 -18.292 1.925 -12.840 1.00 0.00 O ATOM 1007 CB THR A 63 -16.406 4.002 -14.058 1.00 0.00 C ATOM 1008 OG1 THR A 63 -15.941 4.767 -15.175 1.00 0.00 O ATOM 1009 CG2 THR A 63 -15.386 4.069 -12.931 1.00 0.00 C ATOM 0 H THR A 63 -18.558 2.706 -15.347 1.00 0.00 H new ATOM 0 HA THR A 63 -15.718 2.111 -14.837 1.00 0.00 H new ATOM 0 HB THR A 63 -17.348 4.418 -13.700 1.00 0.00 H new ATOM 0 HG1 THR A 63 -15.787 5.694 -14.895 1.00 0.00 H new ATOM 0 HG21 THR A 63 -15.226 5.109 -12.646 1.00 0.00 H new ATOM 0 HG22 THR A 63 -15.756 3.510 -12.072 1.00 0.00 H new ATOM 0 HG23 THR A 63 -14.444 3.636 -13.267 1.00 0.00 H new ATOM 1017 N LEU A 64 -16.300 0.881 -12.755 1.00 0.00 N ATOM 1018 CA LEU A 64 -16.656 0.063 -11.601 1.00 0.00 C ATOM 1019 C LEU A 64 -15.789 0.414 -10.396 1.00 0.00 C ATOM 1020 O LEU A 64 -14.598 0.104 -10.362 1.00 0.00 O ATOM 1021 CB LEU A 64 -16.503 -1.422 -11.938 1.00 0.00 C ATOM 1022 CG LEU A 64 -17.708 -2.086 -12.606 1.00 0.00 C ATOM 1023 CD1 LEU A 64 -17.354 -2.541 -14.013 1.00 0.00 C ATOM 1024 CD2 LEU A 64 -18.200 -3.259 -11.771 1.00 0.00 C ATOM 0 H LEU A 64 -15.356 0.724 -13.108 1.00 0.00 H new ATOM 0 HA LEU A 64 -17.696 0.268 -11.349 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -15.640 -1.538 -12.593 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -16.280 -1.962 -11.018 1.00 0.00 H new ATOM 0 HG LEU A 64 -18.512 -1.353 -12.675 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -18.223 -3.011 -14.473 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -17.050 -1.680 -14.608 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -16.535 -3.259 -13.968 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -19.058 -3.720 -12.261 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -17.401 -3.994 -11.670 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -18.494 -2.904 -10.783 1.00 0.00 H new ATOM 1036 N THR A 65 -16.396 1.062 -9.406 1.00 0.00 N ATOM 1037 CA THR A 65 -15.681 1.455 -8.199 1.00 0.00 C ATOM 1038 C THR A 65 -16.089 0.590 -7.012 1.00 0.00 C ATOM 1039 O THR A 65 -17.276 0.441 -6.720 1.00 0.00 O ATOM 1040 CB THR A 65 -15.933 2.934 -7.852 1.00 0.00 C ATOM 1041 OG1 THR A 65 -15.885 3.731 -9.041 1.00 0.00 O ATOM 1042 CG2 THR A 65 -14.902 3.440 -6.855 1.00 0.00 C ATOM 0 H THR A 65 -17.381 1.325 -9.417 1.00 0.00 H new ATOM 0 HA THR A 65 -14.619 1.313 -8.401 1.00 0.00 H new ATOM 0 HB THR A 65 -16.922 3.014 -7.400 1.00 0.00 H new ATOM 0 HG1 THR A 65 -16.048 4.670 -8.812 1.00 0.00 H new ATOM 0 HG21 THR A 65 -15.101 4.487 -6.626 1.00 0.00 H new ATOM 0 HG22 THR A 65 -14.961 2.850 -5.940 1.00 0.00 H new ATOM 0 HG23 THR A 65 -13.904 3.346 -7.284 1.00 0.00 H new ATOM 1050 N MET A 66 -15.099 0.023 -6.330 1.00 0.00 N ATOM 1051 CA MET A 66 -15.357 -0.826 -5.173 1.00 0.00 C ATOM 1052 C MET A 66 -14.110 -0.954 -4.304 1.00 0.00 C ATOM 1053 O MET A 66 -12.988 -0.833 -4.793 1.00 0.00 O ATOM 1054 CB MET A 66 -15.823 -2.212 -5.623 1.00 0.00 C ATOM 1055 CG MET A 66 -14.763 -2.992 -6.384 1.00 0.00 C ATOM 1056 SD MET A 66 -15.456 -4.352 -7.343 1.00 0.00 S ATOM 1057 CE MET A 66 -15.934 -3.500 -8.844 1.00 0.00 C ATOM 0 H MET A 66 -14.111 0.136 -6.559 1.00 0.00 H new ATOM 0 HA MET A 66 -16.145 -0.360 -4.581 1.00 0.00 H new ATOM 0 HB2 MET A 66 -16.127 -2.786 -4.748 1.00 0.00 H new ATOM 0 HB3 MET A 66 -16.705 -2.103 -6.254 1.00 0.00 H new ATOM 0 HG2 MET A 66 -14.230 -2.316 -7.052 1.00 0.00 H new ATOM 0 HG3 MET A 66 -14.031 -3.386 -5.679 1.00 0.00 H new ATOM 0 HE1 MET A 66 -16.397 -4.207 -9.532 1.00 0.00 H new ATOM 0 HE2 MET A 66 -16.645 -2.710 -8.603 1.00 0.00 H new ATOM 0 HE3 MET A 66 -15.051 -3.063 -9.311 1.00 0.00 H new ATOM 1067 N GLU A 67 -14.316 -1.198 -3.013 1.00 0.00 N ATOM 1068 CA GLU A 67 -13.207 -1.341 -2.077 1.00 0.00 C ATOM 1069 C GLU A 67 -12.318 -2.520 -2.462 1.00 0.00 C ATOM 1070 O GLU A 67 -12.769 -3.464 -3.111 1.00 0.00 O ATOM 1071 CB GLU A 67 -13.734 -1.528 -0.653 1.00 0.00 C ATOM 1072 CG GLU A 67 -14.005 -0.221 0.073 1.00 0.00 C ATOM 1073 CD GLU A 67 -15.295 0.438 -0.376 1.00 0.00 C ATOM 1074 OE1 GLU A 67 -16.267 -0.291 -0.662 1.00 0.00 O ATOM 1075 OE2 GLU A 67 -15.331 1.685 -0.441 1.00 0.00 O ATOM 0 H GLU A 67 -15.240 -1.301 -2.592 1.00 0.00 H new ATOM 0 HA GLU A 67 -12.610 -0.430 -2.119 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -14.654 -2.111 -0.689 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -13.011 -2.109 -0.080 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -14.051 -0.408 1.146 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -13.174 0.463 -0.096 1.00 0.00 H new ATOM 1082 N ASP A 68 -11.054 -2.457 -2.058 1.00 0.00 N ATOM 1083 CA ASP A 68 -10.101 -3.519 -2.360 1.00 0.00 C ATOM 1084 C ASP A 68 -10.687 -4.886 -2.022 1.00 0.00 C ATOM 1085 O ASP A 68 -10.603 -5.822 -2.818 1.00 0.00 O ATOM 1086 CB ASP A 68 -8.801 -3.302 -1.585 1.00 0.00 C ATOM 1087 CG ASP A 68 -7.639 -4.075 -2.176 1.00 0.00 C ATOM 1088 OD1 ASP A 68 -7.530 -4.124 -3.419 1.00 0.00 O ATOM 1089 OD2 ASP A 68 -6.837 -4.629 -1.395 1.00 0.00 O ATOM 0 H ASP A 68 -10.665 -1.682 -1.521 1.00 0.00 H new ATOM 0 HA ASP A 68 -9.887 -3.489 -3.428 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -8.560 -2.239 -1.576 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -8.945 -3.605 -0.548 1.00 0.00 H new ATOM 1094 N ASP A 69 -11.278 -4.995 -0.837 1.00 0.00 N ATOM 1095 CA ASP A 69 -11.878 -6.248 -0.394 1.00 0.00 C ATOM 1096 C ASP A 69 -12.925 -6.732 -1.392 1.00 0.00 C ATOM 1097 O ASP A 69 -13.077 -7.934 -1.613 1.00 0.00 O ATOM 1098 CB ASP A 69 -12.514 -6.073 0.986 1.00 0.00 C ATOM 1099 CG ASP A 69 -13.149 -7.352 1.497 1.00 0.00 C ATOM 1100 OD1 ASP A 69 -12.410 -8.331 1.724 1.00 0.00 O ATOM 1101 OD2 ASP A 69 -14.387 -7.372 1.667 1.00 0.00 O ATOM 0 H ASP A 69 -11.354 -4.231 -0.166 1.00 0.00 H new ATOM 0 HA ASP A 69 -11.089 -6.998 -0.330 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -11.754 -5.740 1.693 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -13.270 -5.289 0.938 1.00 0.00 H new ATOM 1106 N ILE A 70 -13.645 -5.790 -1.991 1.00 0.00 N ATOM 1107 CA ILE A 70 -14.678 -6.121 -2.965 1.00 0.00 C ATOM 1108 C ILE A 70 -14.077 -6.792 -4.196 1.00 0.00 C ATOM 1109 O ILE A 70 -14.520 -7.863 -4.609 1.00 0.00 O ATOM 1110 CB ILE A 70 -15.458 -4.869 -3.406 1.00 0.00 C ATOM 1111 CG1 ILE A 70 -15.704 -3.947 -2.210 1.00 0.00 C ATOM 1112 CG2 ILE A 70 -16.775 -5.267 -4.055 1.00 0.00 C ATOM 1113 CD1 ILE A 70 -16.280 -4.659 -1.007 1.00 0.00 C ATOM 0 H ILE A 70 -13.532 -4.791 -1.819 1.00 0.00 H new ATOM 0 HA ILE A 70 -15.364 -6.812 -2.475 1.00 0.00 H new ATOM 0 HB ILE A 70 -14.862 -4.328 -4.141 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -14.764 -3.474 -1.926 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -16.384 -3.150 -2.510 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -17.315 -4.371 -4.361 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -16.577 -5.888 -4.929 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -17.378 -5.828 -3.341 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -16.428 -3.944 -0.198 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -17.236 -5.109 -1.274 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -15.591 -5.438 -0.681 1.00 0.00 H new ATOM 1125 N MET A 71 -13.066 -6.155 -4.776 1.00 0.00 N ATOM 1126 CA MET A 71 -12.402 -6.692 -5.958 1.00 0.00 C ATOM 1127 C MET A 71 -11.901 -8.110 -5.703 1.00 0.00 C ATOM 1128 O MET A 71 -12.054 -8.994 -6.546 1.00 0.00 O ATOM 1129 CB MET A 71 -11.234 -5.792 -6.367 1.00 0.00 C ATOM 1130 CG MET A 71 -10.777 -6.004 -7.801 1.00 0.00 C ATOM 1131 SD MET A 71 -10.307 -4.465 -8.615 1.00 0.00 S ATOM 1132 CE MET A 71 -11.844 -3.551 -8.524 1.00 0.00 C ATOM 0 H MET A 71 -12.688 -5.266 -4.447 1.00 0.00 H new ATOM 0 HA MET A 71 -13.129 -6.723 -6.770 1.00 0.00 H new ATOM 0 HB2 MET A 71 -11.526 -4.750 -6.238 1.00 0.00 H new ATOM 0 HB3 MET A 71 -10.394 -5.973 -5.696 1.00 0.00 H new ATOM 0 HG2 MET A 71 -9.929 -6.689 -7.811 1.00 0.00 H new ATOM 0 HG3 MET A 71 -11.578 -6.480 -8.367 1.00 0.00 H new ATOM 0 HE1 MET A 71 -11.831 -2.744 -9.257 1.00 0.00 H new ATOM 0 HE2 MET A 71 -12.678 -4.220 -8.736 1.00 0.00 H new ATOM 0 HE3 MET A 71 -11.959 -3.132 -7.524 1.00 0.00 H new ATOM 1142 N PHE A 72 -11.302 -8.320 -4.535 1.00 0.00 N ATOM 1143 CA PHE A 72 -10.777 -9.631 -4.170 1.00 0.00 C ATOM 1144 C PHE A 72 -11.894 -10.669 -4.118 1.00 0.00 C ATOM 1145 O PHE A 72 -11.712 -11.814 -4.532 1.00 0.00 O ATOM 1146 CB PHE A 72 -10.068 -9.561 -2.817 1.00 0.00 C ATOM 1147 CG PHE A 72 -8.855 -10.443 -2.729 1.00 0.00 C ATOM 1148 CD1 PHE A 72 -7.838 -10.339 -3.664 1.00 0.00 C ATOM 1149 CD2 PHE A 72 -8.732 -11.375 -1.711 1.00 0.00 C ATOM 1150 CE1 PHE A 72 -6.721 -11.150 -3.586 1.00 0.00 C ATOM 1151 CE2 PHE A 72 -7.618 -12.188 -1.628 1.00 0.00 C ATOM 1152 CZ PHE A 72 -6.610 -12.075 -2.566 1.00 0.00 C ATOM 0 H PHE A 72 -11.168 -7.600 -3.825 1.00 0.00 H new ATOM 0 HA PHE A 72 -10.060 -9.933 -4.933 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -9.772 -8.530 -2.624 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -10.770 -9.843 -2.033 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -7.919 -9.616 -4.463 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -9.516 -11.467 -0.974 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -5.936 -11.060 -4.322 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -7.535 -12.911 -0.830 1.00 0.00 H new ATOM 0 HZ PHE A 72 -5.737 -12.708 -2.502 1.00 0.00 H new ATOM 1162 N ALA A 73 -13.051 -10.260 -3.607 1.00 0.00 N ATOM 1163 CA ALA A 73 -14.198 -11.152 -3.502 1.00 0.00 C ATOM 1164 C ALA A 73 -14.715 -11.548 -4.882 1.00 0.00 C ATOM 1165 O ALA A 73 -14.902 -12.730 -5.169 1.00 0.00 O ATOM 1166 CB ALA A 73 -15.305 -10.496 -2.690 1.00 0.00 C ATOM 0 H ALA A 73 -13.218 -9.316 -3.259 1.00 0.00 H new ATOM 0 HA ALA A 73 -13.875 -12.059 -2.990 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -16.156 -11.174 -2.620 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -14.937 -10.271 -1.689 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -15.616 -9.573 -3.179 1.00 0.00 H new ATOM 1172 N ILE A 74 -14.942 -10.551 -5.731 1.00 0.00 N ATOM 1173 CA ILE A 74 -15.437 -10.796 -7.080 1.00 0.00 C ATOM 1174 C ILE A 74 -14.369 -11.458 -7.945 1.00 0.00 C ATOM 1175 O ILE A 74 -14.671 -12.035 -8.988 1.00 0.00 O ATOM 1176 CB ILE A 74 -15.894 -9.491 -7.757 1.00 0.00 C ATOM 1177 CG1 ILE A 74 -16.965 -8.799 -6.911 1.00 0.00 C ATOM 1178 CG2 ILE A 74 -16.419 -9.776 -9.156 1.00 0.00 C ATOM 1179 CD1 ILE A 74 -17.106 -7.322 -7.204 1.00 0.00 C ATOM 0 H ILE A 74 -14.791 -9.567 -5.509 1.00 0.00 H new ATOM 0 HA ILE A 74 -16.292 -11.466 -6.986 1.00 0.00 H new ATOM 0 HB ILE A 74 -15.037 -8.823 -7.841 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -17.924 -9.288 -7.082 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -16.724 -8.930 -5.856 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -16.738 -8.844 -9.622 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -15.630 -10.229 -9.755 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -17.266 -10.459 -9.095 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -17.883 -6.897 -6.568 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -16.159 -6.820 -7.005 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -17.378 -7.183 -8.250 1.00 0.00 H new ATOM 1191 N GLY A 75 -13.119 -11.371 -7.502 1.00 0.00 N ATOM 1192 CA GLY A 75 -12.025 -11.968 -8.246 1.00 0.00 C ATOM 1193 C GLY A 75 -11.823 -13.431 -7.907 1.00 0.00 C ATOM 1194 O GLY A 75 -11.530 -14.245 -8.784 1.00 0.00 O ATOM 0 H GLY A 75 -12.844 -10.898 -6.641 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -12.220 -11.869 -9.314 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -11.106 -11.420 -8.037 1.00 0.00 H new ATOM 1198 N THR A 76 -11.979 -13.769 -6.631 1.00 0.00 N ATOM 1199 CA THR A 76 -11.810 -15.144 -6.178 1.00 0.00 C ATOM 1200 C THR A 76 -13.145 -15.879 -6.142 1.00 0.00 C ATOM 1201 O THR A 76 -13.321 -16.827 -5.378 1.00 0.00 O ATOM 1202 CB THR A 76 -11.168 -15.199 -4.779 1.00 0.00 C ATOM 1203 OG1 THR A 76 -11.903 -14.372 -3.870 1.00 0.00 O ATOM 1204 CG2 THR A 76 -9.718 -14.741 -4.830 1.00 0.00 C ATOM 0 H THR A 76 -12.222 -13.109 -5.893 1.00 0.00 H new ATOM 0 HA THR A 76 -11.148 -15.634 -6.893 1.00 0.00 H new ATOM 0 HB THR A 76 -11.194 -16.232 -4.432 1.00 0.00 H new ATOM 0 HG1 THR A 76 -11.542 -13.461 -3.891 1.00 0.00 H new ATOM 0 HG21 THR A 76 -9.286 -14.789 -3.830 1.00 0.00 H new ATOM 0 HG22 THR A 76 -9.155 -15.390 -5.500 1.00 0.00 H new ATOM 0 HG23 THR A 76 -9.673 -13.715 -5.196 1.00 0.00 H new ATOM 1212 N GLY A 77 -14.082 -15.436 -6.974 1.00 0.00 N ATOM 1213 CA GLY A 77 -15.389 -16.065 -7.021 1.00 0.00 C ATOM 1214 C GLY A 77 -16.039 -16.156 -5.654 1.00 0.00 C ATOM 1215 O GLY A 77 -16.924 -16.982 -5.434 1.00 0.00 O ATOM 0 H GLY A 77 -13.960 -14.653 -7.616 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -16.037 -15.500 -7.691 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -15.292 -17.066 -7.441 1.00 0.00 H new ATOM 1219 N ALA A 78 -15.596 -15.307 -4.733 1.00 0.00 N ATOM 1220 CA ALA A 78 -16.140 -15.295 -3.381 1.00 0.00 C ATOM 1221 C ALA A 78 -17.574 -14.776 -3.370 1.00 0.00 C ATOM 1222 O ALA A 78 -18.523 -15.545 -3.212 1.00 0.00 O ATOM 1223 CB ALA A 78 -15.264 -14.451 -2.467 1.00 0.00 C ATOM 0 H ALA A 78 -14.862 -14.619 -4.899 1.00 0.00 H new ATOM 0 HA ALA A 78 -16.150 -16.320 -3.011 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -15.682 -14.451 -1.460 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -14.257 -14.868 -2.442 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -15.224 -13.429 -2.843 1.00 0.00 H new ATOM 1229 N LEU A 79 -17.725 -13.467 -3.539 1.00 0.00 N ATOM 1230 CA LEU A 79 -19.044 -12.844 -3.548 1.00 0.00 C ATOM 1231 C LEU A 79 -19.373 -12.285 -4.929 1.00 0.00 C ATOM 1232 O LEU A 79 -18.507 -11.780 -5.643 1.00 0.00 O ATOM 1233 CB LEU A 79 -19.110 -11.727 -2.505 1.00 0.00 C ATOM 1234 CG LEU A 79 -19.510 -12.152 -1.092 1.00 0.00 C ATOM 1235 CD1 LEU A 79 -19.202 -11.046 -0.094 1.00 0.00 C ATOM 1236 CD2 LEU A 79 -20.986 -12.519 -1.043 1.00 0.00 C ATOM 0 H LEU A 79 -16.951 -12.817 -3.672 1.00 0.00 H new ATOM 0 HA LEU A 79 -19.781 -13.608 -3.300 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -18.133 -11.245 -2.455 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -19.819 -10.975 -2.851 1.00 0.00 H new ATOM 0 HG LEU A 79 -18.927 -13.032 -0.820 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -19.494 -11.367 0.906 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -18.134 -10.830 -0.109 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -19.758 -10.148 -0.363 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -21.253 -12.819 -0.030 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -21.585 -11.657 -1.336 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -21.179 -13.344 -1.728 1.00 0.00 H new ATOM 1248 N PRO A 80 -20.654 -12.376 -5.315 1.00 0.00 N ATOM 1249 CA PRO A 80 -21.127 -11.882 -6.611 1.00 0.00 C ATOM 1250 C PRO A 80 -21.108 -10.360 -6.694 1.00 0.00 C ATOM 1251 O PRO A 80 -21.532 -9.673 -5.766 1.00 0.00 O ATOM 1252 CB PRO A 80 -22.565 -12.403 -6.686 1.00 0.00 C ATOM 1253 CG PRO A 80 -22.981 -12.571 -5.265 1.00 0.00 C ATOM 1254 CD PRO A 80 -21.740 -12.966 -4.514 1.00 0.00 C ATOM 0 HA PRO A 80 -20.493 -12.219 -7.431 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -23.214 -11.700 -7.208 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -22.616 -13.347 -7.228 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -23.399 -11.646 -4.869 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -23.753 -13.335 -5.172 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -21.745 -12.577 -3.496 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -21.642 -14.049 -4.441 1.00 0.00 H new ATOM 1262 N ALA A 81 -20.613 -9.839 -7.812 1.00 0.00 N ATOM 1263 CA ALA A 81 -20.540 -8.398 -8.017 1.00 0.00 C ATOM 1264 C ALA A 81 -21.926 -7.764 -7.957 1.00 0.00 C ATOM 1265 O ALA A 81 -22.069 -6.588 -7.625 1.00 0.00 O ATOM 1266 CB ALA A 81 -19.873 -8.087 -9.349 1.00 0.00 C ATOM 0 H ALA A 81 -20.256 -10.394 -8.590 1.00 0.00 H new ATOM 0 HA ALA A 81 -19.939 -7.972 -7.214 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -19.825 -7.007 -9.489 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -18.864 -8.499 -9.355 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -20.452 -8.532 -10.158 1.00 0.00 H new ATOM 1272 N LYS A 82 -22.946 -8.552 -8.282 1.00 0.00 N ATOM 1273 CA LYS A 82 -24.322 -8.069 -8.264 1.00 0.00 C ATOM 1274 C LYS A 82 -24.778 -7.777 -6.839 1.00 0.00 C ATOM 1275 O LYS A 82 -25.186 -6.659 -6.526 1.00 0.00 O ATOM 1276 CB LYS A 82 -25.253 -9.099 -8.908 1.00 0.00 C ATOM 1277 CG LYS A 82 -24.678 -9.740 -10.159 1.00 0.00 C ATOM 1278 CD LYS A 82 -25.765 -10.377 -11.010 1.00 0.00 C ATOM 1279 CE LYS A 82 -25.506 -11.859 -11.228 1.00 0.00 C ATOM 1280 NZ LYS A 82 -26.556 -12.487 -12.077 1.00 0.00 N ATOM 0 H LYS A 82 -22.845 -9.528 -8.561 1.00 0.00 H new ATOM 0 HA LYS A 82 -24.363 -7.142 -8.836 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -25.477 -9.879 -8.180 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -26.198 -8.616 -9.159 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -24.150 -8.987 -10.745 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -23.945 -10.496 -9.877 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -26.732 -10.243 -10.526 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -25.818 -9.870 -11.974 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -24.532 -11.992 -11.698 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -25.467 -12.366 -10.264 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -26.343 -13.497 -12.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -27.483 -12.383 -11.617 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -26.576 -12.020 -13.006 1.00 0.00 H new ATOM 1294 N GLU A 83 -24.704 -8.789 -5.979 1.00 0.00 N ATOM 1295 CA GLU A 83 -25.110 -8.638 -4.587 1.00 0.00 C ATOM 1296 C GLU A 83 -24.355 -7.490 -3.922 1.00 0.00 C ATOM 1297 O GLU A 83 -24.953 -6.640 -3.263 1.00 0.00 O ATOM 1298 CB GLU A 83 -24.864 -9.938 -3.818 1.00 0.00 C ATOM 1299 CG GLU A 83 -25.387 -9.909 -2.391 1.00 0.00 C ATOM 1300 CD GLU A 83 -26.605 -9.019 -2.234 1.00 0.00 C ATOM 1301 OE1 GLU A 83 -27.685 -9.400 -2.732 1.00 0.00 O ATOM 1302 OE2 GLU A 83 -26.478 -7.943 -1.614 1.00 0.00 O ATOM 0 H GLU A 83 -24.367 -9.721 -6.222 1.00 0.00 H new ATOM 0 HA GLU A 83 -26.175 -8.409 -4.568 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -25.337 -10.762 -4.353 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -23.794 -10.143 -3.800 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -25.640 -10.923 -2.080 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -24.598 -9.559 -1.726 1.00 0.00 H new ATOM 1309 N ALA A 84 -23.038 -7.475 -4.098 1.00 0.00 N ATOM 1310 CA ALA A 84 -22.202 -6.432 -3.517 1.00 0.00 C ATOM 1311 C ALA A 84 -22.745 -5.046 -3.847 1.00 0.00 C ATOM 1312 O ALA A 84 -22.715 -4.143 -3.011 1.00 0.00 O ATOM 1313 CB ALA A 84 -20.769 -6.570 -4.009 1.00 0.00 C ATOM 0 H ALA A 84 -22.527 -8.173 -4.638 1.00 0.00 H new ATOM 0 HA ALA A 84 -22.216 -6.551 -2.434 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -20.155 -5.785 -3.567 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -20.377 -7.544 -3.718 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -20.747 -6.480 -5.095 1.00 0.00 H new ATOM 1319 N MET A 85 -23.240 -4.884 -5.069 1.00 0.00 N ATOM 1320 CA MET A 85 -23.790 -3.607 -5.508 1.00 0.00 C ATOM 1321 C MET A 85 -25.069 -3.275 -4.747 1.00 0.00 C ATOM 1322 O MET A 85 -25.363 -2.109 -4.486 1.00 0.00 O ATOM 1323 CB MET A 85 -24.071 -3.638 -7.012 1.00 0.00 C ATOM 1324 CG MET A 85 -23.395 -2.513 -7.779 1.00 0.00 C ATOM 1325 SD MET A 85 -24.196 -2.171 -9.358 1.00 0.00 S ATOM 1326 CE MET A 85 -24.771 -0.496 -9.091 1.00 0.00 C ATOM 0 H MET A 85 -23.272 -5.621 -5.773 1.00 0.00 H new ATOM 0 HA MET A 85 -23.053 -2.832 -5.299 1.00 0.00 H new ATOM 0 HB2 MET A 85 -23.738 -4.594 -7.416 1.00 0.00 H new ATOM 0 HB3 MET A 85 -25.147 -3.582 -7.174 1.00 0.00 H new ATOM 0 HG2 MET A 85 -23.400 -1.609 -7.170 1.00 0.00 H new ATOM 0 HG3 MET A 85 -22.351 -2.774 -7.954 1.00 0.00 H new ATOM 0 HE1 MET A 85 -25.289 -0.143 -9.983 1.00 0.00 H new ATOM 0 HE2 MET A 85 -25.455 -0.477 -8.242 1.00 0.00 H new ATOM 0 HE3 MET A 85 -23.919 0.153 -8.885 1.00 0.00 H new ATOM 1336 N ALA A 86 -25.827 -4.309 -4.393 1.00 0.00 N ATOM 1337 CA ALA A 86 -27.073 -4.127 -3.660 1.00 0.00 C ATOM 1338 C ALA A 86 -26.806 -3.736 -2.210 1.00 0.00 C ATOM 1339 O ALA A 86 -27.631 -3.083 -1.572 1.00 0.00 O ATOM 1340 CB ALA A 86 -27.911 -5.395 -3.721 1.00 0.00 C ATOM 0 H ALA A 86 -25.599 -5.281 -4.602 1.00 0.00 H new ATOM 0 HA ALA A 86 -27.627 -3.315 -4.131 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -28.839 -5.245 -3.169 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -28.141 -5.630 -4.760 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -27.355 -6.221 -3.277 1.00 0.00 H new ATOM 1346 N GLN A 87 -25.649 -4.142 -1.697 1.00 0.00 N ATOM 1347 CA GLN A 87 -25.275 -3.835 -0.322 1.00 0.00 C ATOM 1348 C GLN A 87 -24.579 -2.481 -0.236 1.00 0.00 C ATOM 1349 O GLN A 87 -24.038 -2.114 0.808 1.00 0.00 O ATOM 1350 CB GLN A 87 -24.361 -4.927 0.236 1.00 0.00 C ATOM 1351 CG GLN A 87 -25.003 -6.305 0.260 1.00 0.00 C ATOM 1352 CD GLN A 87 -24.583 -7.124 1.464 1.00 0.00 C ATOM 1353 OE1 GLN A 87 -24.404 -6.592 2.560 1.00 0.00 O ATOM 1354 NE2 GLN A 87 -24.422 -8.428 1.266 1.00 0.00 N ATOM 0 H GLN A 87 -24.955 -4.684 -2.212 1.00 0.00 H new ATOM 0 HA GLN A 87 -26.186 -3.793 0.275 1.00 0.00 H new ATOM 0 HB2 GLN A 87 -23.452 -4.969 -0.364 1.00 0.00 H new ATOM 0 HB3 GLN A 87 -24.063 -4.657 1.249 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -26.088 -6.196 0.260 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -24.736 -6.842 -0.650 1.00 0.00 H new ATOM 0 HE21 GLN A 87 -24.581 -8.827 0.341 1.00 0.00 H new ATOM 0 HE22 GLN A 87 -24.139 -9.030 2.039 1.00 0.00 H new ATOM 1363 N ASP A 88 -24.595 -1.742 -1.340 1.00 0.00 N ATOM 1364 CA ASP A 88 -23.966 -0.427 -1.390 1.00 0.00 C ATOM 1365 C ASP A 88 -22.464 -0.534 -1.150 1.00 0.00 C ATOM 1366 O ASP A 88 -21.796 0.462 -0.870 1.00 0.00 O ATOM 1367 CB ASP A 88 -24.596 0.503 -0.352 1.00 0.00 C ATOM 1368 CG ASP A 88 -24.392 1.967 -0.686 1.00 0.00 C ATOM 1369 OD1 ASP A 88 -24.934 2.422 -1.715 1.00 0.00 O ATOM 1370 OD2 ASP A 88 -23.690 2.658 0.081 1.00 0.00 O ATOM 0 H ASP A 88 -25.037 -2.031 -2.213 1.00 0.00 H new ATOM 0 HA ASP A 88 -24.128 -0.011 -2.385 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -25.664 0.295 -0.283 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -24.166 0.294 0.627 1.00 0.00 H new ATOM 1375 N LYS A 89 -21.937 -1.749 -1.261 1.00 0.00 N ATOM 1376 CA LYS A 89 -20.513 -1.988 -1.057 1.00 0.00 C ATOM 1377 C LYS A 89 -19.732 -1.753 -2.345 1.00 0.00 C ATOM 1378 O LYS A 89 -18.509 -1.889 -2.374 1.00 0.00 O ATOM 1379 CB LYS A 89 -20.281 -3.416 -0.559 1.00 0.00 C ATOM 1380 CG LYS A 89 -20.829 -3.672 0.834 1.00 0.00 C ATOM 1381 CD LYS A 89 -19.866 -4.500 1.669 1.00 0.00 C ATOM 1382 CE LYS A 89 -20.571 -5.156 2.846 1.00 0.00 C ATOM 1383 NZ LYS A 89 -19.976 -6.479 3.182 1.00 0.00 N ATOM 0 H LYS A 89 -22.475 -2.584 -1.491 1.00 0.00 H new ATOM 0 HA LYS A 89 -20.156 -1.285 -0.304 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -20.744 -4.114 -1.256 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -19.211 -3.624 -0.563 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -21.019 -2.721 1.332 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -21.786 -4.189 0.760 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -19.408 -5.267 1.044 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -19.060 -3.864 2.035 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -20.513 -4.501 3.715 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -21.628 -5.282 2.612 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -20.484 -6.893 3.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -20.054 -7.113 2.361 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -18.974 -6.356 3.431 1.00 0.00 H new ATOM 1397 N MET A 90 -20.446 -1.399 -3.409 1.00 0.00 N ATOM 1398 CA MET A 90 -19.818 -1.143 -4.700 1.00 0.00 C ATOM 1399 C MET A 90 -20.799 -0.480 -5.660 1.00 0.00 C ATOM 1400 O MET A 90 -22.002 -0.733 -5.604 1.00 0.00 O ATOM 1401 CB MET A 90 -19.297 -2.448 -5.305 1.00 0.00 C ATOM 1402 CG MET A 90 -20.398 -3.363 -5.816 1.00 0.00 C ATOM 1403 SD MET A 90 -19.756 -4.791 -6.711 1.00 0.00 S ATOM 1404 CE MET A 90 -19.251 -4.027 -8.250 1.00 0.00 C ATOM 0 H MET A 90 -21.459 -1.283 -3.402 1.00 0.00 H new ATOM 0 HA MET A 90 -18.980 -0.465 -4.540 1.00 0.00 H new ATOM 0 HB2 MET A 90 -18.620 -2.213 -6.127 1.00 0.00 H new ATOM 0 HB3 MET A 90 -18.713 -2.980 -4.554 1.00 0.00 H new ATOM 0 HG2 MET A 90 -20.999 -3.707 -4.974 1.00 0.00 H new ATOM 0 HG3 MET A 90 -21.061 -2.797 -6.471 1.00 0.00 H new ATOM 0 HE1 MET A 90 -18.505 -4.653 -8.739 1.00 0.00 H new ATOM 0 HE2 MET A 90 -20.117 -3.917 -8.903 1.00 0.00 H new ATOM 0 HE3 MET A 90 -18.823 -3.045 -8.046 1.00 0.00 H new ATOM 1414 N GLU A 91 -20.278 0.370 -6.540 1.00 0.00 N ATOM 1415 CA GLU A 91 -21.110 1.070 -7.511 1.00 0.00 C ATOM 1416 C GLU A 91 -20.553 0.908 -8.922 1.00 0.00 C ATOM 1417 O GLU A 91 -19.422 0.459 -9.107 1.00 0.00 O ATOM 1418 CB GLU A 91 -21.207 2.555 -7.156 1.00 0.00 C ATOM 1419 CG GLU A 91 -22.254 2.861 -6.098 1.00 0.00 C ATOM 1420 CD GLU A 91 -23.657 2.931 -6.669 1.00 0.00 C ATOM 1421 OE1 GLU A 91 -24.049 4.017 -7.147 1.00 0.00 O ATOM 1422 OE2 GLU A 91 -24.363 1.902 -6.638 1.00 0.00 O ATOM 0 H GLU A 91 -19.284 0.590 -6.600 1.00 0.00 H new ATOM 0 HA GLU A 91 -22.107 0.631 -7.480 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -20.235 2.900 -6.803 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -21.438 3.121 -8.058 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -22.218 2.094 -5.324 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -22.013 3.809 -5.618 1.00 0.00 H new ATOM 1429 N VAL A 92 -21.356 1.277 -9.915 1.00 0.00 N ATOM 1430 CA VAL A 92 -20.944 1.173 -11.310 1.00 0.00 C ATOM 1431 C VAL A 92 -21.617 2.243 -12.162 1.00 0.00 C ATOM 1432 O VAL A 92 -22.778 2.589 -11.940 1.00 0.00 O ATOM 1433 CB VAL A 92 -21.275 -0.214 -11.892 1.00 0.00 C ATOM 1434 CG1 VAL A 92 -20.817 -0.309 -13.339 1.00 0.00 C ATOM 1435 CG2 VAL A 92 -20.638 -1.310 -11.050 1.00 0.00 C ATOM 0 H VAL A 92 -22.295 1.651 -9.779 1.00 0.00 H new ATOM 0 HA VAL A 92 -19.864 1.319 -11.333 1.00 0.00 H new ATOM 0 HB VAL A 92 -22.356 -0.350 -11.868 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -21.059 -1.296 -13.733 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -21.323 0.453 -13.932 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -19.740 -0.152 -13.391 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -20.882 -2.284 -11.475 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -19.556 -1.179 -11.040 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -21.019 -1.254 -10.030 1.00 0.00 H new ATOM 1445 N ASP A 93 -20.882 2.763 -13.139 1.00 0.00 N ATOM 1446 CA ASP A 93 -21.408 3.793 -14.027 1.00 0.00 C ATOM 1447 C ASP A 93 -21.288 3.365 -15.487 1.00 0.00 C ATOM 1448 O ASP A 93 -20.692 2.334 -15.795 1.00 0.00 O ATOM 1449 CB ASP A 93 -20.668 5.113 -13.807 1.00 0.00 C ATOM 1450 CG ASP A 93 -21.515 6.318 -14.166 1.00 0.00 C ATOM 1451 OD1 ASP A 93 -22.635 6.437 -13.628 1.00 0.00 O ATOM 1452 OD2 ASP A 93 -21.058 7.142 -14.986 1.00 0.00 O ATOM 0 H ASP A 93 -19.920 2.488 -13.336 1.00 0.00 H new ATOM 0 HA ASP A 93 -22.463 3.934 -13.794 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -20.362 5.185 -12.763 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -19.758 5.120 -14.407 1.00 0.00 H new ATOM 1457 N GLY A 94 -21.859 4.165 -16.382 1.00 0.00 N ATOM 1458 CA GLY A 94 -21.805 3.852 -17.798 1.00 0.00 C ATOM 1459 C GLY A 94 -23.005 3.050 -18.260 1.00 0.00 C ATOM 1460 O GLY A 94 -24.148 3.451 -18.045 1.00 0.00 O ATOM 0 H GLY A 94 -22.358 5.024 -16.152 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -21.749 4.778 -18.370 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -20.894 3.292 -18.009 1.00 0.00 H new ATOM 1464 N GLN A 95 -22.745 1.913 -18.898 1.00 0.00 N ATOM 1465 CA GLN A 95 -23.813 1.054 -19.394 1.00 0.00 C ATOM 1466 C GLN A 95 -24.056 -0.115 -18.446 1.00 0.00 C ATOM 1467 O GLN A 95 -23.304 -1.089 -18.438 1.00 0.00 O ATOM 1468 CB GLN A 95 -23.469 0.531 -20.790 1.00 0.00 C ATOM 1469 CG GLN A 95 -24.186 1.267 -21.910 1.00 0.00 C ATOM 1470 CD GLN A 95 -25.687 1.324 -21.704 1.00 0.00 C ATOM 1471 OE1 GLN A 95 -26.259 2.397 -21.507 1.00 0.00 O ATOM 1472 NE2 GLN A 95 -26.335 0.165 -21.748 1.00 0.00 N ATOM 0 H GLN A 95 -21.804 1.566 -19.083 1.00 0.00 H new ATOM 0 HA GLN A 95 -24.725 1.648 -19.451 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -22.393 0.612 -20.944 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -23.720 -0.528 -20.844 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -23.794 2.282 -21.982 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -23.972 0.775 -22.859 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -25.821 -0.700 -21.914 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -27.346 0.141 -21.616 1.00 0.00 H new ATOM 1481 N VAL A 96 -25.113 -0.011 -17.645 1.00 0.00 N ATOM 1482 CA VAL A 96 -25.456 -1.060 -16.693 1.00 0.00 C ATOM 1483 C VAL A 96 -25.376 -2.438 -17.340 1.00 0.00 C ATOM 1484 O VAL A 96 -24.979 -3.412 -16.702 1.00 0.00 O ATOM 1485 CB VAL A 96 -26.870 -0.856 -16.118 1.00 0.00 C ATOM 1486 CG1 VAL A 96 -27.183 -1.921 -15.077 1.00 0.00 C ATOM 1487 CG2 VAL A 96 -27.008 0.538 -15.525 1.00 0.00 C ATOM 0 H VAL A 96 -25.746 0.789 -17.637 1.00 0.00 H new ATOM 0 HA VAL A 96 -24.730 -1.000 -15.882 1.00 0.00 H new ATOM 0 HB VAL A 96 -27.591 -0.953 -16.930 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -28.186 -1.760 -14.682 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -27.128 -2.907 -15.538 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -26.459 -1.859 -14.264 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -28.013 0.665 -15.123 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -26.279 0.667 -14.725 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -26.831 1.283 -16.301 1.00 0.00 H new ATOM 1497 N GLU A 97 -25.757 -2.512 -18.612 1.00 0.00 N ATOM 1498 CA GLU A 97 -25.729 -3.771 -19.345 1.00 0.00 C ATOM 1499 C GLU A 97 -24.293 -4.227 -19.590 1.00 0.00 C ATOM 1500 O GLU A 97 -23.944 -5.380 -19.336 1.00 0.00 O ATOM 1501 CB GLU A 97 -26.464 -3.627 -20.680 1.00 0.00 C ATOM 1502 CG GLU A 97 -27.938 -3.289 -20.529 1.00 0.00 C ATOM 1503 CD GLU A 97 -28.761 -3.724 -21.726 1.00 0.00 C ATOM 1504 OE1 GLU A 97 -28.181 -3.874 -22.822 1.00 0.00 O ATOM 1505 OE2 GLU A 97 -29.985 -3.914 -21.567 1.00 0.00 O ATOM 0 H GLU A 97 -26.088 -1.715 -19.155 1.00 0.00 H new ATOM 0 HA GLU A 97 -26.233 -4.524 -18.740 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -25.980 -2.849 -21.270 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -26.369 -4.557 -21.240 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -28.327 -3.769 -19.631 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -28.048 -2.214 -20.388 1.00 0.00 H new ATOM 1512 N LEU A 98 -23.465 -3.313 -20.084 1.00 0.00 N ATOM 1513 CA LEU A 98 -22.067 -3.619 -20.364 1.00 0.00 C ATOM 1514 C LEU A 98 -21.394 -4.250 -19.150 1.00 0.00 C ATOM 1515 O LEU A 98 -20.891 -5.372 -19.219 1.00 0.00 O ATOM 1516 CB LEU A 98 -21.318 -2.349 -20.774 1.00 0.00 C ATOM 1517 CG LEU A 98 -21.054 -2.180 -22.271 1.00 0.00 C ATOM 1518 CD1 LEU A 98 -20.039 -3.204 -22.753 1.00 0.00 C ATOM 1519 CD2 LEU A 98 -22.351 -2.300 -23.059 1.00 0.00 C ATOM 0 H LEU A 98 -23.738 -2.354 -20.299 1.00 0.00 H new ATOM 0 HA LEU A 98 -22.035 -4.334 -21.186 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -21.887 -1.487 -20.426 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -20.361 -2.331 -20.252 1.00 0.00 H new ATOM 0 HG LEU A 98 -20.642 -1.185 -22.437 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -19.864 -3.068 -23.820 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -19.102 -3.070 -22.212 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -20.422 -4.209 -22.573 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -22.144 -2.177 -24.122 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -22.792 -3.282 -22.886 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -23.047 -1.527 -22.733 1.00 0.00 H new ATOM 1531 N ILE A 99 -21.390 -3.523 -18.038 1.00 0.00 N ATOM 1532 CA ILE A 99 -20.782 -4.013 -16.807 1.00 0.00 C ATOM 1533 C ILE A 99 -21.467 -5.287 -16.325 1.00 0.00 C ATOM 1534 O ILE A 99 -20.835 -6.153 -15.719 1.00 0.00 O ATOM 1535 CB ILE A 99 -20.844 -2.956 -15.689 1.00 0.00 C ATOM 1536 CG1 ILE A 99 -22.294 -2.542 -15.427 1.00 0.00 C ATOM 1537 CG2 ILE A 99 -20.000 -1.744 -16.057 1.00 0.00 C ATOM 1538 CD1 ILE A 99 -22.970 -3.360 -14.349 1.00 0.00 C ATOM 0 H ILE A 99 -21.801 -2.592 -17.964 1.00 0.00 H new ATOM 0 HA ILE A 99 -19.738 -4.228 -17.035 1.00 0.00 H new ATOM 0 HB ILE A 99 -20.440 -3.392 -14.776 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -22.317 -1.490 -15.142 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -22.863 -2.634 -16.352 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -20.054 -1.006 -15.257 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -18.964 -2.051 -16.197 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -20.377 -1.305 -16.981 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -23.994 -3.012 -14.217 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -22.979 -4.410 -14.641 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -22.425 -3.248 -13.412 1.00 0.00 H new ATOM 1550 N PHE A 100 -22.762 -5.396 -16.600 1.00 0.00 N ATOM 1551 CA PHE A 100 -23.534 -6.566 -16.195 1.00 0.00 C ATOM 1552 C PHE A 100 -23.138 -7.789 -17.017 1.00 0.00 C ATOM 1553 O PHE A 100 -23.141 -8.915 -16.517 1.00 0.00 O ATOM 1554 CB PHE A 100 -25.031 -6.295 -16.352 1.00 0.00 C ATOM 1555 CG PHE A 100 -25.891 -7.491 -16.059 1.00 0.00 C ATOM 1556 CD1 PHE A 100 -26.320 -7.753 -14.768 1.00 0.00 C ATOM 1557 CD2 PHE A 100 -26.270 -8.354 -17.075 1.00 0.00 C ATOM 1558 CE1 PHE A 100 -27.111 -8.853 -14.495 1.00 0.00 C ATOM 1559 CE2 PHE A 100 -27.062 -9.455 -16.808 1.00 0.00 C ATOM 1560 CZ PHE A 100 -27.482 -9.705 -15.516 1.00 0.00 C ATOM 0 H PHE A 100 -23.300 -4.689 -17.101 1.00 0.00 H new ATOM 0 HA PHE A 100 -23.317 -6.769 -15.146 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -25.316 -5.481 -15.686 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -25.226 -5.958 -17.370 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -26.033 -7.090 -13.965 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -25.943 -8.164 -18.087 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -27.439 -9.046 -13.484 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -27.352 -10.119 -17.609 1.00 0.00 H new ATOM 0 HZ PHE A 100 -28.100 -10.566 -15.305 1.00 0.00 H new ATOM 1570 N LEU A 101 -22.798 -7.561 -18.280 1.00 0.00 N ATOM 1571 CA LEU A 101 -22.400 -8.643 -19.173 1.00 0.00 C ATOM 1572 C LEU A 101 -21.061 -9.237 -18.747 1.00 0.00 C ATOM 1573 O LEU A 101 -20.641 -10.278 -19.254 1.00 0.00 O ATOM 1574 CB LEU A 101 -22.309 -8.136 -20.614 1.00 0.00 C ATOM 1575 CG LEU A 101 -23.495 -8.472 -21.519 1.00 0.00 C ATOM 1576 CD1 LEU A 101 -23.479 -9.946 -21.894 1.00 0.00 C ATOM 1577 CD2 LEU A 101 -24.806 -8.107 -20.839 1.00 0.00 C ATOM 0 H LEU A 101 -22.790 -6.636 -18.709 1.00 0.00 H new ATOM 0 HA LEU A 101 -23.158 -9.424 -19.116 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -22.191 -7.053 -20.590 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -21.405 -8.545 -21.066 1.00 0.00 H new ATOM 0 HG LEU A 101 -23.408 -7.884 -22.433 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -24.330 -10.167 -22.538 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -22.554 -10.177 -22.423 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -23.541 -10.552 -20.990 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -25.639 -8.353 -21.498 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -24.902 -8.667 -19.909 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -24.818 -7.039 -20.622 1.00 0.00 H new ATOM 1589 N LEU A 102 -20.396 -8.570 -17.810 1.00 0.00 N ATOM 1590 CA LEU A 102 -19.105 -9.033 -17.312 1.00 0.00 C ATOM 1591 C LEU A 102 -19.287 -10.068 -16.206 1.00 0.00 C ATOM 1592 O LEU A 102 -18.524 -11.029 -16.112 1.00 0.00 O ATOM 1593 CB LEU A 102 -18.284 -7.852 -16.791 1.00 0.00 C ATOM 1594 CG LEU A 102 -17.750 -6.887 -17.849 1.00 0.00 C ATOM 1595 CD1 LEU A 102 -16.901 -5.803 -17.203 1.00 0.00 C ATOM 1596 CD2 LEU A 102 -16.948 -7.639 -18.901 1.00 0.00 C ATOM 0 H LEU A 102 -20.729 -7.707 -17.380 1.00 0.00 H new ATOM 0 HA LEU A 102 -18.571 -9.502 -18.139 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -18.900 -7.288 -16.091 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -17.438 -8.244 -16.226 1.00 0.00 H new ATOM 0 HG LEU A 102 -18.599 -6.411 -18.340 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -16.529 -5.125 -17.972 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -17.506 -5.245 -16.489 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -16.058 -6.261 -16.685 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -16.576 -6.936 -19.646 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -16.107 -8.143 -18.426 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -17.586 -8.377 -19.386 1.00 0.00 H new ATOM 1608 N GLU A 103 -20.303 -9.865 -15.374 1.00 0.00 N ATOM 1609 CA GLU A 103 -20.585 -10.782 -14.276 1.00 0.00 C ATOM 1610 C GLU A 103 -20.529 -12.232 -14.750 1.00 0.00 C ATOM 1611 O GLU A 103 -19.761 -13.048 -14.241 1.00 0.00 O ATOM 1612 CB GLU A 103 -21.960 -10.484 -13.674 1.00 0.00 C ATOM 1613 CG GLU A 103 -21.912 -9.538 -12.486 1.00 0.00 C ATOM 1614 CD GLU A 103 -22.326 -8.125 -12.849 1.00 0.00 C ATOM 1615 OE1 GLU A 103 -23.533 -7.900 -13.078 1.00 0.00 O ATOM 1616 OE2 GLU A 103 -21.443 -7.244 -12.904 1.00 0.00 O ATOM 0 H GLU A 103 -20.944 -9.074 -15.439 1.00 0.00 H new ATOM 0 HA GLU A 103 -19.822 -10.638 -13.511 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -22.599 -10.054 -14.445 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -22.422 -11.421 -13.363 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -22.567 -9.914 -11.700 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -20.901 -9.523 -12.079 1.00 0.00 H new ATOM 1623 N PRO A 104 -21.362 -12.561 -15.748 1.00 0.00 N ATOM 1624 CA PRO A 104 -21.427 -13.912 -16.313 1.00 0.00 C ATOM 1625 C PRO A 104 -20.176 -14.268 -17.109 1.00 0.00 C ATOM 1626 O PRO A 104 -20.008 -15.407 -17.544 1.00 0.00 O ATOM 1627 CB PRO A 104 -22.648 -13.853 -17.234 1.00 0.00 C ATOM 1628 CG PRO A 104 -22.777 -12.415 -17.601 1.00 0.00 C ATOM 1629 CD PRO A 104 -22.305 -11.638 -16.403 1.00 0.00 C ATOM 0 HA PRO A 104 -21.497 -14.675 -15.538 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -22.508 -14.476 -18.117 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -23.543 -14.214 -16.728 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -22.176 -12.181 -18.480 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -23.810 -12.166 -17.846 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -21.819 -10.707 -16.694 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -23.132 -11.374 -15.744 1.00 0.00 H new ATOM 1637 N PHE A 105 -19.300 -13.286 -17.296 1.00 0.00 N ATOM 1638 CA PHE A 105 -18.064 -13.496 -18.040 1.00 0.00 C ATOM 1639 C PHE A 105 -16.985 -14.098 -17.144 1.00 0.00 C ATOM 1640 O PHE A 105 -16.036 -14.717 -17.627 1.00 0.00 O ATOM 1641 CB PHE A 105 -17.570 -12.175 -18.634 1.00 0.00 C ATOM 1642 CG PHE A 105 -16.924 -12.328 -19.981 1.00 0.00 C ATOM 1643 CD1 PHE A 105 -17.655 -12.779 -21.069 1.00 0.00 C ATOM 1644 CD2 PHE A 105 -15.585 -12.021 -20.161 1.00 0.00 C ATOM 1645 CE1 PHE A 105 -17.062 -12.921 -22.309 1.00 0.00 C ATOM 1646 CE2 PHE A 105 -14.986 -12.162 -21.399 1.00 0.00 C ATOM 1647 CZ PHE A 105 -15.727 -12.611 -22.474 1.00 0.00 C ATOM 0 H PHE A 105 -19.423 -12.337 -16.942 1.00 0.00 H new ATOM 0 HA PHE A 105 -18.272 -14.196 -18.850 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -18.411 -11.487 -18.719 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -16.856 -11.721 -17.947 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -18.700 -13.022 -20.946 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -15.002 -11.667 -19.324 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -17.643 -13.274 -23.148 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -13.941 -11.921 -21.525 1.00 0.00 H new ATOM 0 HZ PHE A 105 -15.263 -12.720 -23.443 1.00 0.00 H new ATOM 1657 N ILE A 106 -17.137 -13.911 -15.838 1.00 0.00 N ATOM 1658 CA ILE A 106 -16.177 -14.435 -14.874 1.00 0.00 C ATOM 1659 C ILE A 106 -16.082 -15.954 -14.964 1.00 0.00 C ATOM 1660 O ILE A 106 -15.043 -16.540 -14.661 1.00 0.00 O ATOM 1661 CB ILE A 106 -16.552 -14.040 -13.434 1.00 0.00 C ATOM 1662 CG1 ILE A 106 -16.584 -12.517 -13.292 1.00 0.00 C ATOM 1663 CG2 ILE A 106 -15.569 -14.649 -12.445 1.00 0.00 C ATOM 1664 CD1 ILE A 106 -17.260 -12.042 -12.024 1.00 0.00 C ATOM 0 H ILE A 106 -17.916 -13.400 -15.422 1.00 0.00 H new ATOM 0 HA ILE A 106 -15.210 -13.997 -15.122 1.00 0.00 H new ATOM 0 HB ILE A 106 -17.547 -14.428 -13.214 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -15.563 -12.137 -13.314 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -17.101 -12.091 -14.152 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -15.847 -14.361 -11.431 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -15.591 -15.735 -12.532 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -14.564 -14.288 -12.662 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -17.246 -10.953 -11.990 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -18.292 -12.392 -12.009 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -16.730 -12.439 -11.158 1.00 0.00 H new ATOM 1676 N ALA A 107 -17.173 -16.586 -15.385 1.00 0.00 N ATOM 1677 CA ALA A 107 -17.211 -18.037 -15.519 1.00 0.00 C ATOM 1678 C ALA A 107 -16.101 -18.533 -16.439 1.00 0.00 C ATOM 1679 O ALA A 107 -15.528 -19.599 -16.217 1.00 0.00 O ATOM 1680 CB ALA A 107 -18.570 -18.483 -16.039 1.00 0.00 C ATOM 0 H ALA A 107 -18.042 -16.116 -15.639 1.00 0.00 H new ATOM 0 HA ALA A 107 -17.051 -18.473 -14.533 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -18.585 -19.569 -16.134 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -19.347 -18.169 -15.342 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -18.753 -18.031 -17.014 1.00 0.00 H new ATOM 1686 N SER A 108 -15.805 -17.753 -17.474 1.00 0.00 N ATOM 1687 CA SER A 108 -14.766 -18.116 -18.432 1.00 0.00 C ATOM 1688 C SER A 108 -13.379 -17.942 -17.821 1.00 0.00 C ATOM 1689 O SER A 108 -12.529 -18.828 -17.920 1.00 0.00 O ATOM 1690 CB SER A 108 -14.889 -17.264 -19.697 1.00 0.00 C ATOM 1691 OG SER A 108 -15.365 -18.035 -20.786 1.00 0.00 O ATOM 0 H SER A 108 -16.269 -16.866 -17.671 1.00 0.00 H new ATOM 0 HA SER A 108 -14.899 -19.165 -18.695 1.00 0.00 H new ATOM 0 HB2 SER A 108 -15.567 -16.431 -19.513 1.00 0.00 H new ATOM 0 HB3 SER A 108 -13.918 -16.836 -19.947 1.00 0.00 H new ATOM 0 HG SER A 108 -15.437 -17.468 -21.582 1.00 0.00 H new