USER MOD reduce.3.24.130724 H: found=0, std=0, add=846, rem=0, adj=18 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 -178:sc= -1.42 (180deg=-1.54) USER MOD Set 1.2: A 71 MET CE :methyl -144:sc= -0.856 (180deg=-1.65) USER MOD Single : A 2 SER OG : rot 33:sc= 0.455 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot -76:sc= 0.0283 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 -40:sc= 0.00765 USER MOD Single : A 23 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 28 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 30 TYR OH : rot 70:sc= -2.23 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 THR OG1 : rot 180:sc= -0.787 USER MOD Single : A 36 GLN :FLIP amide:sc= -0.168 F(o=-0.75,f=-0.17) 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 X(o=0,f=0.5) USER MOD Single : A 46 MET CE :methyl -123:sc= -0.715 (180deg=-4.42!) 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=-0.017) USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot 180:sc= -0.0507 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot -150:sc= -1.38 USER MOD Single : A 76 THR OG1 : rot -40:sc= 0.673 USER MOD Single : A 82 LYS NZ :NH3+ -143:sc= 0.0334 (180deg=0) USER MOD Single : A 85 MET CE :methyl -151:sc= -1.2 (180deg=-1.38) USER MOD Single : A 87 GLN : amide:sc= 0 X(o=0,f=-0.022) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 MET CE :methyl 160:sc= -0.188 (180deg=-0.315) USER MOD Single : A 95 GLN :FLIP amide:sc= -0.492 F(o=-1.3,f=-0.49) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 18 N SER A 2 0.837 -1.671 -1.487 1.00 0.00 N ATOM 19 CA SER A 2 0.473 -2.975 -2.028 1.00 0.00 C ATOM 20 C SER A 2 -1.003 -3.273 -1.780 1.00 0.00 C ATOM 21 O SER A 2 -1.458 -3.307 -0.635 1.00 0.00 O ATOM 22 CB SER A 2 1.338 -4.071 -1.402 1.00 0.00 C ATOM 23 OG SER A 2 1.121 -4.155 -0.004 1.00 0.00 O ATOM 0 HA SER A 2 0.647 -2.955 -3.104 1.00 0.00 H new ATOM 0 HB2 SER A 2 1.109 -5.030 -1.867 1.00 0.00 H new ATOM 0 HB3 SER A 2 2.390 -3.865 -1.598 1.00 0.00 H new ATOM 0 HG SER A 2 0.189 -3.927 0.197 1.00 0.00 H new ATOM 29 N LEU A 3 -1.746 -3.487 -2.859 1.00 0.00 N ATOM 30 CA LEU A 3 -3.172 -3.783 -2.761 1.00 0.00 C ATOM 31 C LEU A 3 -3.448 -5.247 -3.088 1.00 0.00 C ATOM 32 O LEU A 3 -2.885 -5.801 -4.032 1.00 0.00 O ATOM 33 CB LEU A 3 -3.966 -2.878 -3.705 1.00 0.00 C ATOM 34 CG LEU A 3 -4.115 -1.420 -3.270 1.00 0.00 C ATOM 35 CD1 LEU A 3 -3.913 -0.487 -4.454 1.00 0.00 C ATOM 36 CD2 LEU A 3 -5.479 -1.190 -2.634 1.00 0.00 C ATOM 0 H LEU A 3 -1.386 -3.461 -3.813 1.00 0.00 H new ATOM 0 HA LEU A 3 -3.488 -3.594 -1.735 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -3.486 -2.897 -4.683 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -4.962 -3.302 -3.830 1.00 0.00 H new ATOM 0 HG LEU A 3 -3.348 -1.202 -2.527 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -4.023 0.547 -4.126 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -2.914 -0.633 -4.866 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -4.657 -0.705 -5.220 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -5.568 -0.147 -2.330 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -6.261 -1.426 -3.356 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -5.586 -1.833 -1.760 1.00 0.00 H new ATOM 48 N LYS A 4 -4.321 -5.868 -2.302 1.00 0.00 N ATOM 49 CA LYS A 4 -4.677 -7.267 -2.509 1.00 0.00 C ATOM 50 C LYS A 4 -5.315 -7.469 -3.880 1.00 0.00 C ATOM 51 O LYS A 4 -5.139 -8.513 -4.509 1.00 0.00 O ATOM 52 CB LYS A 4 -5.637 -7.738 -1.414 1.00 0.00 C ATOM 53 CG LYS A 4 -5.163 -8.982 -0.684 1.00 0.00 C ATOM 54 CD LYS A 4 -4.232 -8.634 0.466 1.00 0.00 C ATOM 55 CE LYS A 4 -3.633 -9.882 1.096 1.00 0.00 C ATOM 56 NZ LYS A 4 -3.126 -9.620 2.471 1.00 0.00 N ATOM 0 H LYS A 4 -4.795 -5.424 -1.515 1.00 0.00 H new ATOM 0 HA LYS A 4 -3.763 -7.859 -2.462 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -5.774 -6.933 -0.692 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -6.612 -7.937 -1.858 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -6.024 -9.531 -0.303 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -4.648 -9.641 -1.383 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -3.432 -7.988 0.105 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -4.780 -8.071 1.222 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -4.387 -10.669 1.131 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -2.818 -10.248 0.472 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -2.726 -10.495 2.866 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -2.389 -8.887 2.435 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -3.909 -9.295 3.074 1.00 0.00 H new ATOM 70 N SER A 5 -6.054 -6.464 -4.338 1.00 0.00 N ATOM 71 CA SER A 5 -6.719 -6.533 -5.634 1.00 0.00 C ATOM 72 C SER A 5 -5.704 -6.729 -6.756 1.00 0.00 C ATOM 73 O SER A 5 -6.055 -7.147 -7.860 1.00 0.00 O ATOM 74 CB SER A 5 -7.531 -5.260 -5.882 1.00 0.00 C ATOM 75 OG SER A 5 -7.201 -4.253 -4.942 1.00 0.00 O ATOM 0 H SER A 5 -6.207 -5.592 -3.831 1.00 0.00 H new ATOM 0 HA SER A 5 -7.393 -7.390 -5.624 1.00 0.00 H new ATOM 0 HB2 SER A 5 -7.342 -4.895 -6.892 1.00 0.00 H new ATOM 0 HB3 SER A 5 -8.595 -5.486 -5.819 1.00 0.00 H new ATOM 0 HG SER A 5 -7.619 -4.461 -4.080 1.00 0.00 H new ATOM 81 N ASP A 6 -4.444 -6.425 -6.465 1.00 0.00 N ATOM 82 CA ASP A 6 -3.377 -6.568 -7.448 1.00 0.00 C ATOM 83 C ASP A 6 -3.354 -7.981 -8.024 1.00 0.00 C ATOM 84 O ASP A 6 -3.083 -8.174 -9.208 1.00 0.00 O ATOM 85 CB ASP A 6 -2.024 -6.240 -6.815 1.00 0.00 C ATOM 86 CG ASP A 6 -1.837 -4.753 -6.585 1.00 0.00 C ATOM 87 OD1 ASP A 6 -2.844 -4.016 -6.625 1.00 0.00 O ATOM 88 OD2 ASP A 6 -0.684 -4.327 -6.367 1.00 0.00 O ATOM 0 H ASP A 6 -4.137 -6.078 -5.556 1.00 0.00 H new ATOM 0 HA ASP A 6 -3.569 -5.867 -8.260 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -1.934 -6.766 -5.864 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -1.226 -6.608 -7.460 1.00 0.00 H new ATOM 93 N GLU A 7 -3.639 -8.964 -7.176 1.00 0.00 N ATOM 94 CA GLU A 7 -3.650 -10.359 -7.601 1.00 0.00 C ATOM 95 C GLU A 7 -4.766 -10.612 -8.610 1.00 0.00 C ATOM 96 O GLU A 7 -4.538 -11.190 -9.673 1.00 0.00 O ATOM 97 CB GLU A 7 -3.820 -11.282 -6.393 1.00 0.00 C ATOM 98 CG GLU A 7 -2.678 -12.268 -6.214 1.00 0.00 C ATOM 99 CD GLU A 7 -3.056 -13.445 -5.335 1.00 0.00 C ATOM 100 OE1 GLU A 7 -3.543 -14.458 -5.879 1.00 0.00 O ATOM 101 OE2 GLU A 7 -2.864 -13.353 -4.105 1.00 0.00 O ATOM 0 H GLU A 7 -3.865 -8.821 -6.192 1.00 0.00 H new ATOM 0 HA GLU A 7 -2.695 -10.573 -8.081 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -3.909 -10.675 -5.492 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -4.753 -11.835 -6.498 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -2.363 -12.635 -7.191 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -1.823 -11.752 -5.777 1.00 0.00 H new ATOM 108 N VAL A 8 -5.974 -10.175 -8.269 1.00 0.00 N ATOM 109 CA VAL A 8 -7.127 -10.354 -9.145 1.00 0.00 C ATOM 110 C VAL A 8 -6.804 -9.926 -10.572 1.00 0.00 C ATOM 111 O VAL A 8 -7.001 -10.688 -11.519 1.00 0.00 O ATOM 112 CB VAL A 8 -8.342 -9.551 -8.643 1.00 0.00 C ATOM 113 CG1 VAL A 8 -9.427 -9.504 -9.707 1.00 0.00 C ATOM 114 CG2 VAL A 8 -8.877 -10.149 -7.350 1.00 0.00 C ATOM 0 H VAL A 8 -6.180 -9.695 -7.393 1.00 0.00 H new ATOM 0 HA VAL A 8 -7.372 -11.416 -9.134 1.00 0.00 H new ATOM 0 HB VAL A 8 -8.022 -8.529 -8.439 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -10.277 -8.933 -9.335 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -9.035 -9.027 -10.605 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -9.748 -10.518 -9.945 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -9.735 -9.570 -7.009 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -9.182 -11.181 -7.525 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -8.098 -10.125 -6.588 1.00 0.00 H new ATOM 124 N PHE A 9 -6.306 -8.703 -10.719 1.00 0.00 N ATOM 125 CA PHE A 9 -5.956 -8.173 -12.032 1.00 0.00 C ATOM 126 C PHE A 9 -4.917 -9.057 -12.716 1.00 0.00 C ATOM 127 O PHE A 9 -4.896 -9.175 -13.941 1.00 0.00 O ATOM 128 CB PHE A 9 -5.421 -6.745 -11.903 1.00 0.00 C ATOM 129 CG PHE A 9 -6.477 -5.741 -11.539 1.00 0.00 C ATOM 130 CD1 PHE A 9 -7.717 -5.765 -12.155 1.00 0.00 C ATOM 131 CD2 PHE A 9 -6.228 -4.772 -10.579 1.00 0.00 C ATOM 132 CE1 PHE A 9 -8.690 -4.841 -11.822 1.00 0.00 C ATOM 133 CE2 PHE A 9 -7.197 -3.846 -10.242 1.00 0.00 C ATOM 134 CZ PHE A 9 -8.430 -3.881 -10.864 1.00 0.00 C ATOM 0 H PHE A 9 -6.136 -8.060 -9.946 1.00 0.00 H new ATOM 0 HA PHE A 9 -6.858 -8.162 -12.644 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -4.637 -6.726 -11.146 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -4.961 -6.451 -12.846 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -7.926 -6.514 -12.904 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -5.266 -4.741 -10.089 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -9.653 -4.870 -12.311 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -6.990 -3.096 -9.493 1.00 0.00 H new ATOM 0 HZ PHE A 9 -9.189 -3.159 -10.602 1.00 0.00 H new ATOM 144 N ALA A 10 -4.056 -9.676 -11.915 1.00 0.00 N ATOM 145 CA ALA A 10 -3.016 -10.551 -12.442 1.00 0.00 C ATOM 146 C ALA A 10 -3.612 -11.838 -13.002 1.00 0.00 C ATOM 147 O ALA A 10 -3.224 -12.298 -14.076 1.00 0.00 O ATOM 148 CB ALA A 10 -1.995 -10.868 -11.359 1.00 0.00 C ATOM 0 H ALA A 10 -4.058 -9.588 -10.899 1.00 0.00 H new ATOM 0 HA ALA A 10 -2.515 -10.029 -13.257 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -1.224 -11.522 -11.766 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -1.538 -9.943 -11.008 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -2.491 -11.366 -10.526 1.00 0.00 H new ATOM 154 N LYS A 11 -4.557 -12.415 -12.268 1.00 0.00 N ATOM 155 CA LYS A 11 -5.208 -13.650 -12.691 1.00 0.00 C ATOM 156 C LYS A 11 -6.147 -13.394 -13.865 1.00 0.00 C ATOM 157 O LYS A 11 -6.101 -14.100 -14.873 1.00 0.00 O ATOM 158 CB LYS A 11 -5.986 -14.265 -11.526 1.00 0.00 C ATOM 159 CG LYS A 11 -5.206 -14.297 -10.223 1.00 0.00 C ATOM 160 CD LYS A 11 -3.815 -14.875 -10.419 1.00 0.00 C ATOM 161 CE LYS A 11 -3.347 -15.632 -9.185 1.00 0.00 C ATOM 162 NZ LYS A 11 -1.907 -16.002 -9.274 1.00 0.00 N ATOM 0 H LYS A 11 -4.890 -12.047 -11.377 1.00 0.00 H new ATOM 0 HA LYS A 11 -4.435 -14.348 -13.012 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -6.906 -13.699 -11.375 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -6.277 -15.282 -11.791 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -5.128 -13.287 -9.820 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -5.748 -14.892 -9.488 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -3.816 -15.544 -11.279 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -3.114 -14.071 -10.642 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -3.510 -15.018 -8.299 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -3.947 -16.534 -9.063 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -1.627 -16.516 -8.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -1.755 -16.608 -10.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -1.332 -15.140 -9.365 1.00 0.00 H new ATOM 176 N ILE A 12 -6.996 -12.381 -13.728 1.00 0.00 N ATOM 177 CA ILE A 12 -7.944 -12.032 -14.779 1.00 0.00 C ATOM 178 C ILE A 12 -7.222 -11.682 -16.076 1.00 0.00 C ATOM 179 O ILE A 12 -7.707 -11.979 -17.167 1.00 0.00 O ATOM 180 CB ILE A 12 -8.834 -10.846 -14.363 1.00 0.00 C ATOM 181 CG1 ILE A 12 -9.726 -11.238 -13.184 1.00 0.00 C ATOM 182 CG2 ILE A 12 -9.676 -10.378 -15.540 1.00 0.00 C ATOM 183 CD1 ILE A 12 -10.530 -10.085 -12.625 1.00 0.00 C ATOM 0 H ILE A 12 -7.047 -11.788 -12.900 1.00 0.00 H new ATOM 0 HA ILE A 12 -8.573 -12.908 -14.941 1.00 0.00 H new ATOM 0 HB ILE A 12 -8.193 -10.022 -14.050 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -10.409 -12.026 -13.502 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -9.105 -11.655 -12.392 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -10.300 -9.539 -15.231 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -9.022 -10.063 -16.353 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -10.311 -11.196 -15.881 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -11.139 -10.436 -11.792 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -9.853 -9.305 -12.276 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -11.178 -9.682 -13.403 1.00 0.00 H new ATOM 195 N ALA A 13 -6.060 -11.052 -15.948 1.00 0.00 N ATOM 196 CA ALA A 13 -5.269 -10.664 -17.110 1.00 0.00 C ATOM 197 C ALA A 13 -4.714 -11.889 -17.829 1.00 0.00 C ATOM 198 O ALA A 13 -4.634 -11.918 -19.057 1.00 0.00 O ATOM 199 CB ALA A 13 -4.137 -9.737 -16.692 1.00 0.00 C ATOM 0 H ALA A 13 -5.645 -10.799 -15.051 1.00 0.00 H new ATOM 0 HA ALA A 13 -5.922 -10.133 -17.803 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -3.555 -9.455 -17.569 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -4.552 -8.842 -16.229 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -3.492 -10.249 -15.978 1.00 0.00 H new ATOM 205 N LYS A 14 -4.331 -12.900 -17.056 1.00 0.00 N ATOM 206 CA LYS A 14 -3.784 -14.129 -17.619 1.00 0.00 C ATOM 207 C LYS A 14 -4.859 -14.912 -18.365 1.00 0.00 C ATOM 208 O LYS A 14 -4.577 -15.577 -19.362 1.00 0.00 O ATOM 209 CB LYS A 14 -3.182 -14.997 -16.512 1.00 0.00 C ATOM 210 CG LYS A 14 -2.325 -16.139 -17.032 1.00 0.00 C ATOM 211 CD LYS A 14 -1.507 -16.774 -15.920 1.00 0.00 C ATOM 212 CE LYS A 14 -0.059 -16.976 -16.339 1.00 0.00 C ATOM 213 NZ LYS A 14 0.698 -15.694 -16.356 1.00 0.00 N ATOM 0 H LYS A 14 -4.389 -12.892 -16.038 1.00 0.00 H new ATOM 0 HA LYS A 14 -3.001 -13.857 -18.327 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -2.577 -14.369 -15.858 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -3.989 -15.407 -15.904 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -2.963 -16.894 -17.492 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -1.657 -15.769 -17.810 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -1.545 -16.142 -15.033 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -1.945 -17.734 -15.647 1.00 0.00 H new ATOM 0 HE2 LYS A 14 0.423 -17.673 -15.654 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -0.028 -17.429 -17.330 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 1.680 -15.875 -16.647 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 0.253 -15.037 -17.028 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 0.690 -15.274 -15.405 1.00 0.00 H new ATOM 227 N ARG A 15 -6.092 -14.827 -17.877 1.00 0.00 N ATOM 228 CA ARG A 15 -7.210 -15.528 -18.498 1.00 0.00 C ATOM 229 C ARG A 15 -7.627 -14.842 -19.796 1.00 0.00 C ATOM 230 O ARG A 15 -8.045 -15.499 -20.751 1.00 0.00 O ATOM 231 CB ARG A 15 -8.398 -15.590 -17.537 1.00 0.00 C ATOM 232 CG ARG A 15 -9.140 -16.917 -17.570 1.00 0.00 C ATOM 233 CD ARG A 15 -9.120 -17.600 -16.212 1.00 0.00 C ATOM 234 NE ARG A 15 -9.349 -19.039 -16.320 1.00 0.00 N ATOM 235 CZ ARG A 15 -8.425 -19.901 -16.728 1.00 0.00 C ATOM 236 NH1 ARG A 15 -7.216 -19.472 -17.066 1.00 0.00 N ATOM 237 NH2 ARG A 15 -8.709 -21.195 -16.800 1.00 0.00 N ATOM 0 H ARG A 15 -6.342 -14.280 -17.053 1.00 0.00 H new ATOM 0 HA ARG A 15 -6.887 -16.543 -18.730 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -8.044 -15.407 -16.523 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -9.094 -14.788 -17.781 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -10.172 -16.751 -17.880 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -8.685 -17.571 -18.314 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -8.159 -17.421 -15.730 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -9.884 -17.158 -15.573 1.00 0.00 H new ATOM 0 HE ARG A 15 -10.269 -19.401 -16.068 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -6.994 -18.478 -17.013 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -6.508 -20.136 -17.379 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -9.638 -21.528 -16.542 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -7.999 -21.856 -17.114 1.00 0.00 H new ATOM 251 N LEU A 16 -7.512 -13.519 -19.823 1.00 0.00 N ATOM 252 CA LEU A 16 -7.878 -12.744 -21.004 1.00 0.00 C ATOM 253 C LEU A 16 -6.977 -13.091 -22.184 1.00 0.00 C ATOM 254 O LEU A 16 -7.298 -12.786 -23.332 1.00 0.00 O ATOM 255 CB LEU A 16 -7.789 -11.247 -20.703 1.00 0.00 C ATOM 256 CG LEU A 16 -8.793 -10.706 -19.683 1.00 0.00 C ATOM 257 CD1 LEU A 16 -8.195 -9.540 -18.912 1.00 0.00 C ATOM 258 CD2 LEU A 16 -10.081 -10.285 -20.375 1.00 0.00 C ATOM 0 H LEU A 16 -7.169 -12.961 -19.042 1.00 0.00 H new ATOM 0 HA LEU A 16 -8.905 -12.995 -21.269 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -6.783 -11.028 -20.344 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -7.920 -10.701 -21.637 1.00 0.00 H new ATOM 0 HG LEU A 16 -9.027 -11.501 -18.975 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -8.924 -9.168 -18.191 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -7.301 -9.873 -18.385 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -7.932 -8.742 -19.606 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -10.784 -9.903 -19.635 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -9.864 -9.506 -21.105 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -10.520 -11.145 -20.882 1.00 0.00 H new ATOM 270 N GLU A 17 -5.850 -13.733 -21.893 1.00 0.00 N ATOM 271 CA GLU A 17 -4.903 -14.122 -22.932 1.00 0.00 C ATOM 272 C GLU A 17 -5.357 -15.402 -23.628 1.00 0.00 C ATOM 273 O GLU A 17 -4.857 -15.749 -24.698 1.00 0.00 O ATOM 274 CB GLU A 17 -3.509 -14.321 -22.333 1.00 0.00 C ATOM 275 CG GLU A 17 -2.834 -13.024 -21.920 1.00 0.00 C ATOM 276 CD GLU A 17 -1.361 -13.207 -21.608 1.00 0.00 C ATOM 277 OE1 GLU A 17 -0.795 -14.247 -22.007 1.00 0.00 O ATOM 278 OE2 GLU A 17 -0.774 -12.311 -20.966 1.00 0.00 O ATOM 0 H GLU A 17 -5.570 -13.995 -20.948 1.00 0.00 H new ATOM 0 HA GLU A 17 -4.862 -13.321 -23.671 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -3.586 -14.974 -21.463 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -2.879 -14.833 -23.061 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -2.944 -12.291 -22.719 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -3.340 -12.619 -21.044 1.00 0.00 H new ATOM 285 N SER A 18 -6.306 -16.099 -23.013 1.00 0.00 N ATOM 286 CA SER A 18 -6.825 -17.343 -23.570 1.00 0.00 C ATOM 287 C SER A 18 -8.040 -17.077 -24.453 1.00 0.00 C ATOM 288 O SER A 18 -8.487 -17.954 -25.193 1.00 0.00 O ATOM 289 CB SER A 18 -7.198 -18.314 -22.448 1.00 0.00 C ATOM 290 OG SER A 18 -7.241 -19.649 -22.922 1.00 0.00 O ATOM 0 H SER A 18 -6.732 -15.824 -22.128 1.00 0.00 H new ATOM 0 HA SER A 18 -6.043 -17.792 -24.183 1.00 0.00 H new ATOM 0 HB2 SER A 18 -6.472 -18.235 -21.639 1.00 0.00 H new ATOM 0 HB3 SER A 18 -8.168 -18.040 -22.034 1.00 0.00 H new ATOM 0 HG SER A 18 -7.645 -19.666 -23.815 1.00 0.00 H new ATOM 296 N ILE A 19 -8.570 -15.862 -24.370 1.00 0.00 N ATOM 297 CA ILE A 19 -9.733 -15.479 -25.161 1.00 0.00 C ATOM 298 C ILE A 19 -9.477 -15.688 -26.650 1.00 0.00 C ATOM 299 O ILE A 19 -8.368 -15.469 -27.136 1.00 0.00 O ATOM 300 CB ILE A 19 -10.119 -14.008 -24.919 1.00 0.00 C ATOM 301 CG1 ILE A 19 -10.355 -13.758 -23.429 1.00 0.00 C ATOM 302 CG2 ILE A 19 -11.358 -13.647 -25.725 1.00 0.00 C ATOM 303 CD1 ILE A 19 -10.613 -12.306 -23.093 1.00 0.00 C ATOM 0 H ILE A 19 -8.212 -15.125 -23.762 1.00 0.00 H new ATOM 0 HA ILE A 19 -10.556 -16.119 -24.843 1.00 0.00 H new ATOM 0 HB ILE A 19 -9.297 -13.373 -25.248 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -11.205 -14.355 -23.099 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -9.486 -14.103 -22.869 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -11.619 -12.604 -25.544 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -11.156 -13.791 -26.786 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -12.188 -14.286 -25.423 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -10.772 -12.204 -22.019 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -9.754 -11.705 -23.392 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -11.500 -11.961 -23.625 1.00 0.00 H new ATOM 315 N ASP A 20 -10.511 -16.111 -27.368 1.00 0.00 N ATOM 316 CA ASP A 20 -10.400 -16.347 -28.803 1.00 0.00 C ATOM 317 C ASP A 20 -11.232 -15.336 -29.586 1.00 0.00 C ATOM 318 O ASP A 20 -12.213 -14.784 -29.088 1.00 0.00 O ATOM 319 CB ASP A 20 -10.850 -17.769 -29.144 1.00 0.00 C ATOM 320 CG ASP A 20 -9.732 -18.604 -29.736 1.00 0.00 C ATOM 321 OD1 ASP A 20 -8.581 -18.471 -29.268 1.00 0.00 O ATOM 322 OD2 ASP A 20 -10.007 -19.390 -30.666 1.00 0.00 O ATOM 0 H ASP A 20 -11.436 -16.298 -26.980 1.00 0.00 H new ATOM 0 HA ASP A 20 -9.354 -16.227 -29.086 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -11.224 -18.255 -28.243 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -11.679 -17.725 -29.850 1.00 0.00 H new ATOM 327 N PRO A 21 -10.831 -15.085 -30.841 1.00 0.00 N ATOM 328 CA PRO A 21 -11.524 -14.138 -31.719 1.00 0.00 C ATOM 329 C PRO A 21 -12.894 -14.648 -32.154 1.00 0.00 C ATOM 330 O PRO A 21 -13.851 -13.880 -32.248 1.00 0.00 O ATOM 331 CB PRO A 21 -10.589 -14.022 -32.925 1.00 0.00 C ATOM 332 CG PRO A 21 -9.828 -15.303 -32.939 1.00 0.00 C ATOM 333 CD PRO A 21 -9.669 -15.706 -31.499 1.00 0.00 C ATOM 0 HA PRO A 21 -11.719 -13.188 -31.221 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -11.150 -13.885 -33.849 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -9.921 -13.166 -32.827 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -10.363 -16.068 -33.502 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -8.857 -15.175 -33.418 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -9.673 -16.790 -31.382 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -8.730 -15.344 -31.082 1.00 0.00 H new ATOM 341 N ALA A 22 -12.979 -15.947 -32.420 1.00 0.00 N ATOM 342 CA ALA A 22 -14.233 -16.560 -32.843 1.00 0.00 C ATOM 343 C ALA A 22 -15.324 -16.356 -31.797 1.00 0.00 C ATOM 344 O ALA A 22 -16.397 -15.837 -32.099 1.00 0.00 O ATOM 345 CB ALA A 22 -14.030 -18.043 -33.115 1.00 0.00 C ATOM 0 H ALA A 22 -12.195 -16.596 -32.350 1.00 0.00 H new ATOM 0 HA ALA A 22 -14.554 -16.074 -33.764 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -14.974 -18.488 -33.430 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -13.288 -18.170 -33.903 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -13.682 -18.535 -32.207 1.00 0.00 H new ATOM 351 N ASN A 23 -15.041 -16.770 -30.566 1.00 0.00 N ATOM 352 CA ASN A 23 -16.000 -16.634 -29.475 1.00 0.00 C ATOM 353 C ASN A 23 -15.808 -15.309 -28.744 1.00 0.00 C ATOM 354 O ASN A 23 -14.773 -15.077 -28.118 1.00 0.00 O ATOM 355 CB ASN A 23 -15.853 -17.797 -28.492 1.00 0.00 C ATOM 356 CG ASN A 23 -17.129 -18.607 -28.360 1.00 0.00 C ATOM 357 OD1 ASN A 23 -17.708 -18.702 -27.278 1.00 0.00 O ATOM 358 ND2 ASN A 23 -17.573 -19.195 -29.465 1.00 0.00 N ATOM 0 H ASN A 23 -14.156 -17.202 -30.299 1.00 0.00 H new ATOM 0 HA ASN A 23 -17.003 -16.651 -29.902 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -15.045 -18.449 -28.823 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -15.569 -17.409 -27.514 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -18.427 -19.753 -29.438 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -17.060 -19.089 -30.340 1.00 0.00 H new ATOM 365 N ARG A 24 -16.812 -14.442 -28.828 1.00 0.00 N ATOM 366 CA ARG A 24 -16.754 -13.140 -28.175 1.00 0.00 C ATOM 367 C ARG A 24 -18.026 -12.340 -28.443 1.00 0.00 C ATOM 368 O ARG A 24 -18.105 -11.590 -29.416 1.00 0.00 O ATOM 369 CB ARG A 24 -15.534 -12.356 -28.662 1.00 0.00 C ATOM 370 CG ARG A 24 -14.481 -12.138 -27.587 1.00 0.00 C ATOM 371 CD ARG A 24 -13.178 -11.624 -28.180 1.00 0.00 C ATOM 372 NE ARG A 24 -12.341 -10.971 -27.177 1.00 0.00 N ATOM 373 CZ ARG A 24 -11.040 -10.755 -27.334 1.00 0.00 C ATOM 374 NH1 ARG A 24 -10.431 -11.137 -28.447 1.00 0.00 N ATOM 375 NH2 ARG A 24 -10.346 -10.154 -26.376 1.00 0.00 N ATOM 0 H ARG A 24 -17.675 -14.618 -29.342 1.00 0.00 H new ATOM 0 HA ARG A 24 -16.668 -13.304 -27.101 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -15.082 -12.888 -29.499 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -15.862 -11.387 -29.039 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -14.853 -11.426 -26.851 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -14.298 -13.074 -27.060 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -12.630 -12.454 -28.625 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -13.398 -10.920 -28.983 1.00 0.00 H new ATOM 0 HE ARG A 24 -12.779 -10.664 -26.309 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -10.961 -11.598 -29.186 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -9.432 -10.970 -28.565 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -10.812 -9.858 -25.518 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -9.347 -9.988 -26.497 1.00 0.00 H new ATOM 389 N GLN A 25 -19.017 -12.507 -27.574 1.00 0.00 N ATOM 390 CA GLN A 25 -20.286 -11.802 -27.718 1.00 0.00 C ATOM 391 C GLN A 25 -20.078 -10.292 -27.662 1.00 0.00 C ATOM 392 O GLN A 25 -20.632 -9.548 -28.471 1.00 0.00 O ATOM 393 CB GLN A 25 -21.262 -12.236 -26.623 1.00 0.00 C ATOM 394 CG GLN A 25 -22.386 -13.126 -27.129 1.00 0.00 C ATOM 395 CD GLN A 25 -22.240 -14.565 -26.676 1.00 0.00 C ATOM 396 OE1 GLN A 25 -22.992 -15.039 -25.823 1.00 0.00 O ATOM 397 NE2 GLN A 25 -21.269 -15.269 -27.245 1.00 0.00 N ATOM 0 H GLN A 25 -18.966 -13.124 -26.763 1.00 0.00 H new ATOM 0 HA GLN A 25 -20.707 -12.057 -28.691 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -20.711 -12.766 -25.846 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -21.693 -11.349 -26.159 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -23.341 -12.734 -26.778 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -22.408 -13.093 -28.218 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -20.669 -14.836 -27.947 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -21.123 -16.243 -26.980 1.00 0.00 H new ATOM 406 N VAL A 26 -19.277 -9.845 -26.699 1.00 0.00 N ATOM 407 CA VAL A 26 -18.996 -8.424 -26.537 1.00 0.00 C ATOM 408 C VAL A 26 -17.844 -8.199 -25.564 1.00 0.00 C ATOM 409 O VAL A 26 -17.695 -8.929 -24.585 1.00 0.00 O ATOM 410 CB VAL A 26 -20.235 -7.660 -26.034 1.00 0.00 C ATOM 411 CG1 VAL A 26 -20.438 -7.894 -24.545 1.00 0.00 C ATOM 412 CG2 VAL A 26 -20.105 -6.175 -26.336 1.00 0.00 C ATOM 0 H VAL A 26 -18.812 -10.447 -26.020 1.00 0.00 H new ATOM 0 HA VAL A 26 -18.718 -8.043 -27.520 1.00 0.00 H new ATOM 0 HB VAL A 26 -21.112 -8.038 -26.560 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -21.318 -7.346 -24.207 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -20.580 -8.959 -24.360 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -19.562 -7.545 -23.999 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -20.989 -5.651 -25.974 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -19.219 -5.779 -25.839 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -20.013 -6.029 -27.412 1.00 0.00 H new ATOM 422 N GLU A 27 -17.032 -7.183 -25.841 1.00 0.00 N ATOM 423 CA GLU A 27 -15.893 -6.863 -24.990 1.00 0.00 C ATOM 424 C GLU A 27 -15.421 -5.431 -25.228 1.00 0.00 C ATOM 425 O GLU A 27 -15.049 -5.066 -26.344 1.00 0.00 O ATOM 426 CB GLU A 27 -14.744 -7.840 -25.248 1.00 0.00 C ATOM 427 CG GLU A 27 -14.776 -8.465 -26.633 1.00 0.00 C ATOM 428 CD GLU A 27 -14.699 -7.432 -27.741 1.00 0.00 C ATOM 429 OE1 GLU A 27 -13.576 -6.989 -28.061 1.00 0.00 O ATOM 430 OE2 GLU A 27 -15.761 -7.069 -28.287 1.00 0.00 O ATOM 0 H GLU A 27 -17.142 -6.568 -26.648 1.00 0.00 H new ATOM 0 HA GLU A 27 -16.211 -6.954 -23.952 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -13.797 -7.317 -25.116 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -14.777 -8.632 -24.500 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -13.944 -9.162 -26.732 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -15.692 -9.045 -26.745 1.00 0.00 H new ATOM 437 N HIS A 28 -15.441 -4.624 -24.172 1.00 0.00 N ATOM 438 CA HIS A 28 -15.015 -3.232 -24.266 1.00 0.00 C ATOM 439 C HIS A 28 -14.117 -2.858 -23.090 1.00 0.00 C ATOM 440 O HIS A 28 -13.963 -3.630 -22.143 1.00 0.00 O ATOM 441 CB HIS A 28 -16.231 -2.307 -24.308 1.00 0.00 C ATOM 442 CG HIS A 28 -16.704 -2.001 -25.696 1.00 0.00 C ATOM 443 ND1 HIS A 28 -16.442 -0.806 -26.333 1.00 0.00 N ATOM 444 CD2 HIS A 28 -17.423 -2.743 -26.570 1.00 0.00 C ATOM 445 CE1 HIS A 28 -16.982 -0.826 -27.539 1.00 0.00 C ATOM 446 NE2 HIS A 28 -17.583 -1.990 -27.708 1.00 0.00 N ATOM 0 H HIS A 28 -15.747 -4.910 -23.242 1.00 0.00 H new ATOM 0 HA HIS A 28 -14.445 -3.113 -25.188 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -17.046 -2.766 -23.748 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -15.984 -1.373 -23.803 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -17.801 -3.741 -26.404 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -16.939 -0.026 -28.264 1.00 0.00 H new ATOM 0 HE2 HIS A 28 -18.084 -2.282 -28.547 1.00 0.00 H new ATOM 454 N VAL A 29 -13.525 -1.670 -23.158 1.00 0.00 N ATOM 455 CA VAL A 29 -12.643 -1.194 -22.100 1.00 0.00 C ATOM 456 C VAL A 29 -13.423 -0.901 -20.824 1.00 0.00 C ATOM 457 O VAL A 29 -14.486 -0.280 -20.862 1.00 0.00 O ATOM 458 CB VAL A 29 -11.887 0.078 -22.529 1.00 0.00 C ATOM 459 CG1 VAL A 29 -10.828 0.443 -21.500 1.00 0.00 C ATOM 460 CG2 VAL A 29 -11.264 -0.111 -23.904 1.00 0.00 C ATOM 0 H VAL A 29 -13.640 -1.020 -23.935 1.00 0.00 H new ATOM 0 HA VAL A 29 -11.923 -1.989 -21.908 1.00 0.00 H new ATOM 0 HB VAL A 29 -12.600 0.901 -22.588 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -10.305 1.344 -21.820 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -11.304 0.623 -20.536 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -10.115 -0.376 -21.405 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -10.734 0.797 -24.191 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -10.564 -0.946 -23.875 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -12.047 -0.320 -24.633 1.00 0.00 H new ATOM 470 N TYR A 30 -12.890 -1.353 -19.694 1.00 0.00 N ATOM 471 CA TYR A 30 -13.537 -1.141 -18.405 1.00 0.00 C ATOM 472 C TYR A 30 -12.619 -0.382 -17.452 1.00 0.00 C ATOM 473 O TYR A 30 -11.409 -0.301 -17.668 1.00 0.00 O ATOM 474 CB TYR A 30 -13.937 -2.482 -17.786 1.00 0.00 C ATOM 475 CG TYR A 30 -15.367 -2.880 -18.076 1.00 0.00 C ATOM 476 CD1 TYR A 30 -15.757 -3.259 -19.355 1.00 0.00 C ATOM 477 CD2 TYR A 30 -16.327 -2.877 -17.072 1.00 0.00 C ATOM 478 CE1 TYR A 30 -17.062 -3.623 -19.625 1.00 0.00 C ATOM 479 CE2 TYR A 30 -17.634 -3.242 -17.333 1.00 0.00 C ATOM 480 CZ TYR A 30 -17.996 -3.613 -18.611 1.00 0.00 C ATOM 481 OH TYR A 30 -19.297 -3.975 -18.875 1.00 0.00 O ATOM 0 H TYR A 30 -12.011 -1.869 -19.645 1.00 0.00 H new ATOM 0 HA TYR A 30 -14.433 -0.542 -18.571 1.00 0.00 H new ATOM 0 HB2 TYR A 30 -13.270 -3.259 -18.160 1.00 0.00 H new ATOM 0 HB3 TYR A 30 -13.794 -2.431 -16.707 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -15.027 -3.269 -20.151 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -16.047 -2.585 -16.071 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -17.349 -3.914 -20.625 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -18.368 -3.237 -16.541 1.00 0.00 H new ATOM 0 HH TYR A 30 -19.338 -4.937 -19.056 1.00 0.00 H new ATOM 491 N LYS A 31 -13.203 0.173 -16.395 1.00 0.00 N ATOM 492 CA LYS A 31 -12.439 0.925 -15.406 1.00 0.00 C ATOM 493 C LYS A 31 -12.625 0.335 -14.012 1.00 0.00 C ATOM 494 O LYS A 31 -13.752 0.135 -13.557 1.00 0.00 O ATOM 495 CB LYS A 31 -12.867 2.394 -15.411 1.00 0.00 C ATOM 496 CG LYS A 31 -11.928 3.299 -16.189 1.00 0.00 C ATOM 497 CD LYS A 31 -11.669 4.601 -15.450 1.00 0.00 C ATOM 498 CE LYS A 31 -12.611 5.702 -15.914 1.00 0.00 C ATOM 499 NZ LYS A 31 -11.949 7.036 -15.914 1.00 0.00 N ATOM 0 H LYS A 31 -14.203 0.116 -16.201 1.00 0.00 H new ATOM 0 HA LYS A 31 -11.384 0.859 -15.671 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -13.867 2.471 -15.837 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -12.930 2.749 -14.382 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -10.983 2.783 -16.361 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -12.357 3.514 -17.168 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -11.792 4.443 -14.379 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -10.637 4.912 -15.610 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -12.969 5.474 -16.918 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -13.485 5.730 -15.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -12.624 7.759 -16.236 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -11.630 7.265 -14.951 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -11.130 7.017 -16.555 1.00 0.00 H new ATOM 513 N PHE A 32 -11.514 0.058 -13.338 1.00 0.00 N ATOM 514 CA PHE A 32 -11.555 -0.509 -11.996 1.00 0.00 C ATOM 515 C PHE A 32 -10.759 0.351 -11.018 1.00 0.00 C ATOM 516 O PHE A 32 -9.528 0.361 -11.043 1.00 0.00 O ATOM 517 CB PHE A 32 -11.002 -1.936 -12.004 1.00 0.00 C ATOM 518 CG PHE A 32 -11.761 -2.867 -12.905 1.00 0.00 C ATOM 519 CD1 PHE A 32 -11.546 -2.856 -14.274 1.00 0.00 C ATOM 520 CD2 PHE A 32 -12.690 -3.753 -12.384 1.00 0.00 C ATOM 521 CE1 PHE A 32 -12.243 -3.712 -15.106 1.00 0.00 C ATOM 522 CE2 PHE A 32 -13.390 -4.611 -13.211 1.00 0.00 C ATOM 523 CZ PHE A 32 -13.167 -4.590 -14.574 1.00 0.00 C ATOM 0 H PHE A 32 -10.574 0.217 -13.700 1.00 0.00 H new ATOM 0 HA PHE A 32 -12.595 -0.532 -11.670 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -9.958 -1.911 -12.317 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -11.021 -2.330 -10.988 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -10.826 -2.171 -14.696 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -12.869 -3.773 -11.319 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -12.065 -3.694 -16.171 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -14.111 -5.297 -12.792 1.00 0.00 H new ATOM 0 HZ PHE A 32 -13.714 -5.259 -15.222 1.00 0.00 H new ATOM 533 N ARG A 33 -11.471 1.071 -10.158 1.00 0.00 N ATOM 534 CA ARG A 33 -10.832 1.936 -9.173 1.00 0.00 C ATOM 535 C ARG A 33 -10.901 1.317 -7.780 1.00 0.00 C ATOM 536 O ARG A 33 -11.975 0.937 -7.311 1.00 0.00 O ATOM 537 CB ARG A 33 -11.498 3.313 -9.164 1.00 0.00 C ATOM 538 CG ARG A 33 -13.003 3.261 -8.961 1.00 0.00 C ATOM 539 CD ARG A 33 -13.669 4.559 -9.390 1.00 0.00 C ATOM 540 NE ARG A 33 -13.251 4.972 -10.727 1.00 0.00 N ATOM 541 CZ ARG A 33 -13.404 6.205 -11.197 1.00 0.00 C ATOM 542 NH1 ARG A 33 -13.963 7.141 -10.443 1.00 0.00 N ATOM 543 NH2 ARG A 33 -12.998 6.504 -12.425 1.00 0.00 N ATOM 0 H ARG A 33 -12.490 1.073 -10.123 1.00 0.00 H new ATOM 0 HA ARG A 33 -9.784 2.048 -9.451 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -11.054 3.917 -8.372 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -11.284 3.817 -10.107 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -13.420 2.431 -9.532 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -13.223 3.068 -7.911 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -14.752 4.435 -9.371 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -13.426 5.345 -8.675 1.00 0.00 H new ATOM 0 HE ARG A 33 -12.818 4.275 -11.333 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -14.277 6.915 -9.499 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -14.079 8.087 -10.807 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -12.568 5.787 -13.009 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -13.116 7.451 -12.785 1.00 0.00 H new ATOM 557 N ILE A 34 -9.750 1.217 -7.124 1.00 0.00 N ATOM 558 CA ILE A 34 -9.680 0.645 -5.786 1.00 0.00 C ATOM 559 C ILE A 34 -9.484 1.731 -4.733 1.00 0.00 C ATOM 560 O ILE A 34 -8.557 2.537 -4.821 1.00 0.00 O ATOM 561 CB ILE A 34 -8.536 -0.379 -5.670 1.00 0.00 C ATOM 562 CG1 ILE A 34 -8.885 -1.655 -6.439 1.00 0.00 C ATOM 563 CG2 ILE A 34 -8.253 -0.695 -4.209 1.00 0.00 C ATOM 564 CD1 ILE A 34 -7.700 -2.280 -7.141 1.00 0.00 C ATOM 0 H ILE A 34 -8.853 1.525 -7.498 1.00 0.00 H new ATOM 0 HA ILE A 34 -10.629 0.138 -5.610 1.00 0.00 H new ATOM 0 HB ILE A 34 -7.636 0.053 -6.108 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -9.312 -2.381 -5.747 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -9.655 -1.426 -7.176 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -7.442 -1.420 -4.144 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -7.966 0.218 -3.688 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -9.149 -1.110 -3.746 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -8.021 -3.180 -7.665 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -7.286 -1.571 -7.858 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -6.938 -2.540 -6.407 1.00 0.00 H new ATOM 576 N THR A 35 -10.362 1.746 -3.735 1.00 0.00 N ATOM 577 CA THR A 35 -10.286 2.732 -2.665 1.00 0.00 C ATOM 578 C THR A 35 -9.673 2.129 -1.405 1.00 0.00 C ATOM 579 O THR A 35 -9.913 0.966 -1.084 1.00 0.00 O ATOM 580 CB THR A 35 -11.677 3.300 -2.324 1.00 0.00 C ATOM 581 OG1 THR A 35 -12.529 2.254 -1.844 1.00 0.00 O ATOM 582 CG2 THR A 35 -12.307 3.955 -3.543 1.00 0.00 C ATOM 0 H THR A 35 -11.134 1.086 -3.646 1.00 0.00 H new ATOM 0 HA THR A 35 -9.650 3.541 -3.025 1.00 0.00 H new ATOM 0 HB THR A 35 -11.557 4.055 -1.547 1.00 0.00 H new ATOM 0 HG1 THR A 35 -13.411 2.623 -1.628 1.00 0.00 H new ATOM 0 HG21 THR A 35 -13.288 4.349 -3.278 1.00 0.00 H new ATOM 0 HG22 THR A 35 -11.670 4.770 -3.888 1.00 0.00 H new ATOM 0 HG23 THR A 35 -12.415 3.217 -4.338 1.00 0.00 H new ATOM 590 N GLN A 36 -8.883 2.929 -0.697 1.00 0.00 N ATOM 591 CA GLN A 36 -8.236 2.474 0.528 1.00 0.00 C ATOM 592 C GLN A 36 -9.035 2.897 1.756 1.00 0.00 C ATOM 593 O GLN A 36 -9.091 4.077 2.096 1.00 0.00 O ATOM 594 CB GLN A 36 -6.813 3.029 0.615 1.00 0.00 C ATOM 595 CG GLN A 36 -5.821 2.065 1.247 1.00 0.00 C ATOM 596 CD GLN A 36 -4.386 2.535 1.117 1.00 0.00 C ATOM 597 OE1 GLN A 36 -3.739 2.164 0.018 1.00 0.00 O flip ATOM 598 NE2 GLN A 36 -3.865 3.225 1.994 1.00 0.00 N flip ATOM 0 H GLN A 36 -8.675 3.895 -0.950 1.00 0.00 H new ATOM 0 HA GLN A 36 -8.193 1.385 0.503 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -6.470 3.285 -0.387 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -6.827 3.953 1.193 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -6.064 1.940 2.302 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -5.922 1.086 0.778 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -4.400 3.487 2.822 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -2.899 3.535 1.892 1.00 0.00 H new ATOM 607 N GLY A 37 -9.654 1.923 2.417 1.00 0.00 N ATOM 608 CA GLY A 37 -10.443 2.215 3.600 1.00 0.00 C ATOM 609 C GLY A 37 -11.806 2.786 3.261 1.00 0.00 C ATOM 610 O GLY A 37 -12.821 2.353 3.805 1.00 0.00 O ATOM 0 H GLY A 37 -9.623 0.938 2.155 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -10.569 1.303 4.183 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -9.902 2.923 4.228 1.00 0.00 H new ATOM 614 N GLY A 38 -11.829 3.764 2.360 1.00 0.00 N ATOM 615 CA GLY A 38 -13.083 4.380 1.967 1.00 0.00 C ATOM 616 C GLY A 38 -12.888 5.505 0.970 1.00 0.00 C ATOM 617 O GLY A 38 -13.839 6.202 0.615 1.00 0.00 O ATOM 0 H GLY A 38 -11.002 4.140 1.896 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -13.736 3.623 1.533 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -13.588 4.767 2.852 1.00 0.00 H new ATOM 621 N LYS A 39 -11.652 5.684 0.516 1.00 0.00 N ATOM 622 CA LYS A 39 -11.334 6.732 -0.446 1.00 0.00 C ATOM 623 C LYS A 39 -10.449 6.193 -1.565 1.00 0.00 C ATOM 624 O LYS A 39 -9.537 5.403 -1.323 1.00 0.00 O ATOM 625 CB LYS A 39 -10.634 7.900 0.254 1.00 0.00 C ATOM 626 CG LYS A 39 -10.725 9.209 -0.510 1.00 0.00 C ATOM 627 CD LYS A 39 -10.573 10.406 0.414 1.00 0.00 C ATOM 628 CE LYS A 39 -9.757 11.513 -0.237 1.00 0.00 C ATOM 629 NZ LYS A 39 -9.906 12.808 0.483 1.00 0.00 N ATOM 0 H LYS A 39 -10.854 5.116 0.799 1.00 0.00 H new ATOM 0 HA LYS A 39 -12.268 7.085 -0.883 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -11.072 8.035 1.243 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -9.584 7.647 0.402 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -9.950 9.239 -1.276 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -11.684 9.265 -1.025 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -11.558 10.788 0.681 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -10.090 10.093 1.340 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -8.706 11.226 -0.255 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -10.072 11.635 -1.273 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -9.335 13.537 0.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -10.906 13.095 0.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -9.581 12.699 1.465 1.00 0.00 H new ATOM 643 N VAL A 40 -10.725 6.626 -2.792 1.00 0.00 N ATOM 644 CA VAL A 40 -9.953 6.189 -3.948 1.00 0.00 C ATOM 645 C VAL A 40 -8.457 6.369 -3.711 1.00 0.00 C ATOM 646 O VAL A 40 -8.012 7.424 -3.259 1.00 0.00 O ATOM 647 CB VAL A 40 -10.356 6.962 -5.218 1.00 0.00 C ATOM 648 CG1 VAL A 40 -9.311 6.781 -6.308 1.00 0.00 C ATOM 649 CG2 VAL A 40 -11.727 6.513 -5.702 1.00 0.00 C ATOM 0 H VAL A 40 -11.478 7.279 -3.010 1.00 0.00 H new ATOM 0 HA VAL A 40 -10.171 5.131 -4.091 1.00 0.00 H new ATOM 0 HB VAL A 40 -10.411 8.023 -4.974 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -9.613 7.334 -7.197 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -8.350 7.156 -5.956 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -9.220 5.723 -6.553 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -11.996 7.069 -6.600 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -11.702 5.447 -5.929 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -12.467 6.700 -4.924 1.00 0.00 H new ATOM 659 N VAL A 41 -7.686 5.331 -4.019 1.00 0.00 N ATOM 660 CA VAL A 41 -6.239 5.375 -3.841 1.00 0.00 C ATOM 661 C VAL A 41 -5.515 5.122 -5.159 1.00 0.00 C ATOM 662 O VAL A 41 -4.335 5.440 -5.303 1.00 0.00 O ATOM 663 CB VAL A 41 -5.770 4.338 -2.803 1.00 0.00 C ATOM 664 CG1 VAL A 41 -6.170 2.935 -3.232 1.00 0.00 C ATOM 665 CG2 VAL A 41 -4.266 4.433 -2.598 1.00 0.00 C ATOM 0 H VAL A 41 -8.039 4.450 -4.393 1.00 0.00 H new ATOM 0 HA VAL A 41 -5.994 6.375 -3.482 1.00 0.00 H new ATOM 0 HB VAL A 41 -6.258 4.554 -1.853 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -5.830 2.216 -2.487 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -7.255 2.878 -3.323 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -5.712 2.704 -4.194 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -3.952 3.693 -1.862 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -3.757 4.243 -3.543 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -4.010 5.431 -2.242 1.00 0.00 H new ATOM 675 N LYS A 42 -6.231 4.549 -6.120 1.00 0.00 N ATOM 676 CA LYS A 42 -5.659 4.254 -7.429 1.00 0.00 C ATOM 677 C LYS A 42 -6.732 3.758 -8.393 1.00 0.00 C ATOM 678 O LYS A 42 -7.751 3.210 -7.973 1.00 0.00 O ATOM 679 CB LYS A 42 -4.551 3.206 -7.299 1.00 0.00 C ATOM 680 CG LYS A 42 -3.682 3.084 -8.539 1.00 0.00 C ATOM 681 CD LYS A 42 -2.372 2.377 -8.234 1.00 0.00 C ATOM 682 CE LYS A 42 -1.418 3.277 -7.464 1.00 0.00 C ATOM 683 NZ LYS A 42 -0.031 3.204 -8.002 1.00 0.00 N ATOM 0 H LYS A 42 -7.209 4.279 -6.017 1.00 0.00 H new ATOM 0 HA LYS A 42 -5.235 5.175 -7.829 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -3.920 3.460 -6.447 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -5.002 2.237 -7.085 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -4.222 2.535 -9.310 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -3.476 4.077 -8.939 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -2.570 1.475 -7.655 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -1.903 2.060 -9.166 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -1.772 4.307 -7.511 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -1.415 2.989 -6.413 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 0.589 3.831 -7.451 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 0.317 2.226 -7.934 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -0.029 3.503 -8.998 1.00 0.00 H new ATOM 697 N ASN A 43 -6.496 3.954 -9.686 1.00 0.00 N ATOM 698 CA ASN A 43 -7.443 3.526 -10.709 1.00 0.00 C ATOM 699 C ASN A 43 -6.741 2.715 -11.794 1.00 0.00 C ATOM 700 O ASN A 43 -5.725 3.141 -12.342 1.00 0.00 O ATOM 701 CB ASN A 43 -8.136 4.740 -11.332 1.00 0.00 C ATOM 702 CG ASN A 43 -7.180 5.893 -11.569 1.00 0.00 C ATOM 703 OD1 ASN A 43 -6.374 5.865 -12.499 1.00 0.00 O ATOM 704 ND2 ASN A 43 -7.265 6.915 -10.725 1.00 0.00 N ATOM 0 H ASN A 43 -5.657 4.406 -10.050 1.00 0.00 H new ATOM 0 HA ASN A 43 -8.192 2.893 -10.234 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -8.591 4.449 -12.279 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -8.943 5.069 -10.678 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -6.647 7.719 -10.834 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -7.948 6.896 -9.968 1.00 0.00 H new ATOM 711 N TRP A 44 -7.291 1.545 -12.098 1.00 0.00 N ATOM 712 CA TRP A 44 -6.718 0.674 -13.118 1.00 0.00 C ATOM 713 C TRP A 44 -7.575 0.676 -14.380 1.00 0.00 C ATOM 714 O TRP A 44 -8.790 0.861 -14.316 1.00 0.00 O ATOM 715 CB TRP A 44 -6.582 -0.752 -12.582 1.00 0.00 C ATOM 716 CG TRP A 44 -5.451 -0.916 -11.612 1.00 0.00 C ATOM 717 CD1 TRP A 44 -5.477 -0.654 -10.271 1.00 0.00 C ATOM 718 CD2 TRP A 44 -4.129 -1.378 -11.907 1.00 0.00 C ATOM 719 NE1 TRP A 44 -4.250 -0.925 -9.716 1.00 0.00 N ATOM 720 CE2 TRP A 44 -3.406 -1.371 -10.698 1.00 0.00 C ATOM 721 CE3 TRP A 44 -3.485 -1.798 -13.074 1.00 0.00 C ATOM 722 CZ2 TRP A 44 -2.073 -1.767 -10.625 1.00 0.00 C ATOM 723 CZ3 TRP A 44 -2.162 -2.190 -13.000 1.00 0.00 C ATOM 724 CH2 TRP A 44 -1.467 -2.173 -11.783 1.00 0.00 C ATOM 0 H TRP A 44 -8.132 1.178 -11.653 1.00 0.00 H new ATOM 0 HA TRP A 44 -5.729 1.055 -13.372 1.00 0.00 H new ATOM 0 HB2 TRP A 44 -7.514 -1.040 -12.095 1.00 0.00 H new ATOM 0 HB3 TRP A 44 -6.435 -1.435 -13.419 1.00 0.00 H new ATOM 0 HD1 TRP A 44 -6.336 -0.288 -9.728 1.00 0.00 H new ATOM 0 HE1 TRP A 44 -4.007 -0.812 -8.732 1.00 0.00 H new ATOM 0 HE3 TRP A 44 -4.012 -1.816 -14.017 1.00 0.00 H new ATOM 0 HZ2 TRP A 44 -1.536 -1.754 -9.688 1.00 0.00 H new ATOM 0 HZ3 TRP A 44 -1.654 -2.515 -13.896 1.00 0.00 H new ATOM 0 HH2 TRP A 44 -0.434 -2.486 -11.759 1.00 0.00 H new ATOM 735 N VAL A 45 -6.934 0.469 -15.526 1.00 0.00 N ATOM 736 CA VAL A 45 -7.638 0.446 -16.802 1.00 0.00 C ATOM 737 C VAL A 45 -7.488 -0.907 -17.488 1.00 0.00 C ATOM 738 O VAL A 45 -6.422 -1.521 -17.446 1.00 0.00 O ATOM 739 CB VAL A 45 -7.122 1.548 -17.747 1.00 0.00 C ATOM 740 CG1 VAL A 45 -5.831 1.112 -18.422 1.00 0.00 C ATOM 741 CG2 VAL A 45 -8.181 1.900 -18.781 1.00 0.00 C ATOM 0 H VAL A 45 -5.928 0.315 -15.596 1.00 0.00 H new ATOM 0 HA VAL A 45 -8.691 0.626 -16.586 1.00 0.00 H new ATOM 0 HB VAL A 45 -6.911 2.440 -17.157 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -5.482 1.903 -19.085 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -5.073 0.913 -17.664 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -6.011 0.206 -19.001 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -7.800 2.680 -19.441 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -8.424 1.015 -19.369 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -9.078 2.258 -18.276 1.00 0.00 H new ATOM 751 N MET A 46 -8.564 -1.367 -18.119 1.00 0.00 N ATOM 752 CA MET A 46 -8.552 -2.647 -18.816 1.00 0.00 C ATOM 753 C MET A 46 -8.420 -2.445 -20.322 1.00 0.00 C ATOM 754 O MET A 46 -9.335 -1.939 -20.972 1.00 0.00 O ATOM 755 CB MET A 46 -9.826 -3.434 -18.504 1.00 0.00 C ATOM 756 CG MET A 46 -10.038 -4.634 -19.414 1.00 0.00 C ATOM 757 SD MET A 46 -10.937 -5.970 -18.603 1.00 0.00 S ATOM 758 CE MET A 46 -12.612 -5.620 -19.130 1.00 0.00 C ATOM 0 H MET A 46 -9.455 -0.872 -18.162 1.00 0.00 H new ATOM 0 HA MET A 46 -7.689 -3.214 -18.467 1.00 0.00 H new ATOM 0 HB2 MET A 46 -9.788 -3.775 -17.469 1.00 0.00 H new ATOM 0 HB3 MET A 46 -10.685 -2.768 -18.589 1.00 0.00 H new ATOM 0 HG2 MET A 46 -10.586 -4.319 -20.302 1.00 0.00 H new ATOM 0 HG3 MET A 46 -9.070 -5.005 -19.751 1.00 0.00 H new ATOM 0 HE1 MET A 46 -13.250 -5.494 -18.255 1.00 0.00 H new ATOM 0 HE2 MET A 46 -12.623 -4.705 -19.722 1.00 0.00 H new ATOM 0 HE3 MET A 46 -12.984 -6.448 -19.734 1.00 0.00 H new ATOM 768 N ASP A 47 -7.278 -2.844 -20.870 1.00 0.00 N ATOM 769 CA ASP A 47 -7.027 -2.707 -22.301 1.00 0.00 C ATOM 770 C ASP A 47 -7.612 -3.887 -23.070 1.00 0.00 C ATOM 771 O ASP A 47 -7.217 -5.035 -22.861 1.00 0.00 O ATOM 772 CB ASP A 47 -5.526 -2.601 -22.569 1.00 0.00 C ATOM 773 CG ASP A 47 -5.203 -1.611 -23.671 1.00 0.00 C ATOM 774 OD1 ASP A 47 -6.029 -1.463 -24.596 1.00 0.00 O ATOM 775 OD2 ASP A 47 -4.124 -0.985 -23.610 1.00 0.00 O ATOM 0 H ASP A 47 -6.511 -3.265 -20.346 1.00 0.00 H new ATOM 0 HA ASP A 47 -7.514 -1.795 -22.645 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -5.017 -2.300 -21.653 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -5.138 -3.583 -22.841 1.00 0.00 H new ATOM 780 N LEU A 48 -8.556 -3.598 -23.959 1.00 0.00 N ATOM 781 CA LEU A 48 -9.197 -4.636 -24.759 1.00 0.00 C ATOM 782 C LEU A 48 -8.516 -4.776 -26.116 1.00 0.00 C ATOM 783 O LEU A 48 -8.713 -5.764 -26.824 1.00 0.00 O ATOM 784 CB LEU A 48 -10.681 -4.316 -24.951 1.00 0.00 C ATOM 785 CG LEU A 48 -11.646 -5.492 -24.799 1.00 0.00 C ATOM 786 CD1 LEU A 48 -11.189 -6.671 -25.645 1.00 0.00 C ATOM 787 CD2 LEU A 48 -11.767 -5.897 -23.337 1.00 0.00 C ATOM 0 H LEU A 48 -8.894 -2.654 -24.144 1.00 0.00 H new ATOM 0 HA LEU A 48 -9.101 -5.582 -24.226 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -10.962 -3.546 -24.232 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -10.814 -3.889 -25.945 1.00 0.00 H new ATOM 0 HG LEU A 48 -12.629 -5.178 -25.151 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -11.888 -7.498 -25.524 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -11.155 -6.375 -26.694 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -10.196 -6.985 -25.325 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -12.458 -6.735 -23.248 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -10.788 -6.192 -22.959 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -12.142 -5.054 -22.756 1.00 0.00 H new ATOM 799 N LYS A 49 -7.710 -3.781 -26.473 1.00 0.00 N ATOM 800 CA LYS A 49 -6.995 -3.793 -27.744 1.00 0.00 C ATOM 801 C LYS A 49 -5.772 -4.702 -27.671 1.00 0.00 C ATOM 802 O LYS A 49 -5.490 -5.454 -28.603 1.00 0.00 O ATOM 803 CB LYS A 49 -6.568 -2.374 -28.126 1.00 0.00 C ATOM 804 CG LYS A 49 -7.068 -1.935 -29.491 1.00 0.00 C ATOM 805 CD LYS A 49 -6.661 -0.505 -29.801 1.00 0.00 C ATOM 806 CE LYS A 49 -7.252 -0.029 -31.119 1.00 0.00 C ATOM 807 NZ LYS A 49 -8.062 1.208 -30.949 1.00 0.00 N ATOM 0 H LYS A 49 -7.536 -2.956 -25.899 1.00 0.00 H new ATOM 0 HA LYS A 49 -7.669 -4.181 -28.508 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -6.936 -1.678 -27.372 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -5.480 -2.315 -28.111 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -6.670 -2.601 -30.257 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -8.154 -2.021 -29.526 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -6.991 0.151 -28.995 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -5.574 -0.436 -29.843 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -6.448 0.158 -31.831 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -7.876 -0.816 -31.543 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -8.447 1.500 -31.870 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -8.844 1.023 -30.289 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -7.461 1.967 -30.569 1.00 0.00 H new ATOM 821 N ASN A 50 -5.051 -4.627 -26.558 1.00 0.00 N ATOM 822 CA ASN A 50 -3.858 -5.444 -26.364 1.00 0.00 C ATOM 823 C ASN A 50 -4.144 -6.608 -25.420 1.00 0.00 C ATOM 824 O ASN A 50 -3.346 -7.539 -25.306 1.00 0.00 O ATOM 825 CB ASN A 50 -2.715 -4.591 -25.808 1.00 0.00 C ATOM 826 CG ASN A 50 -2.191 -3.595 -26.824 1.00 0.00 C ATOM 827 OD1 ASN A 50 -1.796 -3.968 -27.929 1.00 0.00 O ATOM 828 ND2 ASN A 50 -2.185 -2.320 -26.454 1.00 0.00 N ATOM 0 H ASN A 50 -5.271 -4.009 -25.777 1.00 0.00 H new ATOM 0 HA ASN A 50 -3.563 -5.848 -27.332 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -3.061 -4.056 -24.924 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -1.901 -5.242 -25.488 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -1.844 -1.604 -27.096 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -2.522 -2.056 -25.528 1.00 0.00 H new ATOM 835 N VAL A 51 -5.288 -6.549 -24.745 1.00 0.00 N ATOM 836 CA VAL A 51 -5.680 -7.599 -23.813 1.00 0.00 C ATOM 837 C VAL A 51 -4.744 -7.645 -22.611 1.00 0.00 C ATOM 838 O VAL A 51 -4.303 -8.716 -22.193 1.00 0.00 O ATOM 839 CB VAL A 51 -5.690 -8.980 -24.495 1.00 0.00 C ATOM 840 CG1 VAL A 51 -6.435 -9.993 -23.638 1.00 0.00 C ATOM 841 CG2 VAL A 51 -6.309 -8.885 -25.881 1.00 0.00 C ATOM 0 H VAL A 51 -5.959 -5.785 -24.826 1.00 0.00 H new ATOM 0 HA VAL A 51 -6.689 -7.361 -23.475 1.00 0.00 H new ATOM 0 HB VAL A 51 -4.660 -9.319 -24.605 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -6.432 -10.963 -24.136 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -5.944 -10.081 -22.669 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -7.464 -9.662 -23.495 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -6.308 -9.870 -26.348 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -7.334 -8.524 -25.798 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -5.729 -8.193 -26.492 1.00 0.00 H new ATOM 851 N LYS A 52 -4.443 -6.475 -22.058 1.00 0.00 N ATOM 852 CA LYS A 52 -3.560 -6.379 -20.901 1.00 0.00 C ATOM 853 C LYS A 52 -3.989 -5.241 -19.981 1.00 0.00 C ATOM 854 O LYS A 52 -4.366 -4.163 -20.444 1.00 0.00 O ATOM 855 CB LYS A 52 -2.114 -6.165 -21.354 1.00 0.00 C ATOM 856 CG LYS A 52 -1.933 -4.960 -22.261 1.00 0.00 C ATOM 857 CD LYS A 52 -0.702 -4.155 -21.878 1.00 0.00 C ATOM 858 CE LYS A 52 -0.621 -2.854 -22.662 1.00 0.00 C ATOM 859 NZ LYS A 52 0.767 -2.567 -23.118 1.00 0.00 N ATOM 0 H LYS A 52 -4.798 -5.579 -22.393 1.00 0.00 H new ATOM 0 HA LYS A 52 -3.626 -7.315 -20.346 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -1.481 -6.046 -20.475 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -1.770 -7.058 -21.877 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -1.845 -5.292 -23.295 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -2.817 -4.325 -22.204 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -0.726 -3.937 -20.810 1.00 0.00 H new ATOM 0 HD3 LYS A 52 0.194 -4.748 -22.062 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -1.283 -2.909 -23.526 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -0.976 -2.032 -22.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 0.780 -1.672 -23.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 1.395 -2.489 -22.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 1.097 -3.338 -23.732 1.00 0.00 H new ATOM 873 N LEU A 53 -3.929 -5.485 -18.677 1.00 0.00 N ATOM 874 CA LEU A 53 -4.310 -4.479 -17.692 1.00 0.00 C ATOM 875 C LEU A 53 -3.084 -3.738 -17.168 1.00 0.00 C ATOM 876 O LEU A 53 -2.045 -4.343 -16.904 1.00 0.00 O ATOM 877 CB LEU A 53 -5.059 -5.134 -16.529 1.00 0.00 C ATOM 878 CG LEU A 53 -6.582 -5.006 -16.555 1.00 0.00 C ATOM 879 CD1 LEU A 53 -7.152 -5.660 -17.804 1.00 0.00 C ATOM 880 CD2 LEU A 53 -7.190 -5.621 -15.303 1.00 0.00 C ATOM 0 H LEU A 53 -3.620 -6.371 -18.277 1.00 0.00 H new ATOM 0 HA LEU A 53 -4.966 -3.759 -18.180 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -4.804 -6.194 -16.509 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -4.694 -4.701 -15.598 1.00 0.00 H new ATOM 0 HG LEU A 53 -6.838 -3.947 -16.576 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -8.237 -5.559 -17.805 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -6.742 -5.174 -18.689 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -6.886 -6.717 -17.815 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -8.275 -5.521 -15.338 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -6.925 -6.677 -15.251 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -6.807 -5.106 -14.422 1.00 0.00 H new ATOM 892 N VAL A 54 -3.213 -2.423 -17.019 1.00 0.00 N ATOM 893 CA VAL A 54 -2.117 -1.599 -16.524 1.00 0.00 C ATOM 894 C VAL A 54 -2.640 -0.428 -15.699 1.00 0.00 C ATOM 895 O VAL A 54 -3.828 -0.112 -15.736 1.00 0.00 O ATOM 896 CB VAL A 54 -1.258 -1.055 -17.680 1.00 0.00 C ATOM 897 CG1 VAL A 54 -0.841 -2.182 -18.612 1.00 0.00 C ATOM 898 CG2 VAL A 54 -2.011 0.026 -18.441 1.00 0.00 C ATOM 0 H VAL A 54 -4.066 -1.906 -17.234 1.00 0.00 H new ATOM 0 HA VAL A 54 -1.500 -2.238 -15.892 1.00 0.00 H new ATOM 0 HB VAL A 54 -0.356 -0.610 -17.260 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -0.235 -1.778 -19.423 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -0.260 -2.918 -18.056 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -1.729 -2.659 -19.026 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -1.389 0.399 -19.254 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -2.931 -0.391 -18.850 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -2.253 0.846 -17.764 1.00 0.00 H new ATOM 908 N GLU A 55 -1.743 0.212 -14.955 1.00 0.00 N ATOM 909 CA GLU A 55 -2.114 1.349 -14.121 1.00 0.00 C ATOM 910 C GLU A 55 -2.248 2.618 -14.958 1.00 0.00 C ATOM 911 O GLU A 55 -1.251 3.222 -15.353 1.00 0.00 O ATOM 912 CB GLU A 55 -1.076 1.561 -13.017 1.00 0.00 C ATOM 913 CG GLU A 55 0.357 1.571 -13.523 1.00 0.00 C ATOM 914 CD GLU A 55 1.143 2.768 -13.024 1.00 0.00 C ATOM 915 OE1 GLU A 55 0.790 3.906 -13.397 1.00 0.00 O ATOM 916 OE2 GLU A 55 2.111 2.566 -12.262 1.00 0.00 O ATOM 0 H GLU A 55 -0.755 -0.038 -14.913 1.00 0.00 H new ATOM 0 HA GLU A 55 -3.080 1.131 -13.665 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -1.281 2.506 -12.513 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -1.184 0.773 -12.272 1.00 0.00 H new ATOM 0 HG2 GLU A 55 0.857 0.655 -13.207 1.00 0.00 H new ATOM 0 HG3 GLU A 55 0.354 1.572 -14.613 1.00 0.00 H new ATOM 923 N SER A 56 -3.489 3.015 -15.225 1.00 0.00 N ATOM 924 CA SER A 56 -3.755 4.209 -16.019 1.00 0.00 C ATOM 925 C SER A 56 -5.082 4.845 -15.616 1.00 0.00 C ATOM 926 O SER A 56 -5.870 4.249 -14.881 1.00 0.00 O ATOM 927 CB SER A 56 -3.774 3.862 -17.509 1.00 0.00 C ATOM 928 OG SER A 56 -3.775 5.035 -18.305 1.00 0.00 O ATOM 0 H SER A 56 -4.325 2.527 -14.903 1.00 0.00 H new ATOM 0 HA SER A 56 -2.956 4.926 -15.830 1.00 0.00 H new ATOM 0 HB2 SER A 56 -2.905 3.252 -17.755 1.00 0.00 H new ATOM 0 HB3 SER A 56 -4.657 3.264 -17.735 1.00 0.00 H new ATOM 0 HG SER A 56 -3.786 4.787 -19.253 1.00 0.00 H new ATOM 934 N ASP A 57 -5.321 6.057 -16.102 1.00 0.00 N ATOM 935 CA ASP A 57 -6.552 6.775 -15.795 1.00 0.00 C ATOM 936 C ASP A 57 -7.443 6.880 -17.029 1.00 0.00 C ATOM 937 O ASP A 57 -8.414 7.637 -17.043 1.00 0.00 O ATOM 938 CB ASP A 57 -6.234 8.172 -15.261 1.00 0.00 C ATOM 939 CG ASP A 57 -7.158 8.586 -14.132 1.00 0.00 C ATOM 940 OD1 ASP A 57 -8.196 7.919 -13.942 1.00 0.00 O ATOM 941 OD2 ASP A 57 -6.844 9.577 -13.440 1.00 0.00 O ATOM 0 H ASP A 57 -4.678 6.564 -16.711 1.00 0.00 H new ATOM 0 HA ASP A 57 -7.088 6.215 -15.029 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -5.202 8.197 -14.910 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -6.312 8.894 -16.073 1.00 0.00 H new ATOM 946 N ASP A 58 -7.106 6.115 -18.062 1.00 0.00 N ATOM 947 CA ASP A 58 -7.875 6.122 -19.301 1.00 0.00 C ATOM 948 C ASP A 58 -9.362 5.928 -19.018 1.00 0.00 C ATOM 949 O ASP A 58 -9.739 5.275 -18.046 1.00 0.00 O ATOM 950 CB ASP A 58 -7.375 5.026 -20.242 1.00 0.00 C ATOM 951 CG ASP A 58 -8.366 4.714 -21.346 1.00 0.00 C ATOM 952 OD1 ASP A 58 -8.490 5.533 -22.281 1.00 0.00 O ATOM 953 OD2 ASP A 58 -9.019 3.651 -21.276 1.00 0.00 O ATOM 0 H ASP A 58 -6.306 5.483 -18.066 1.00 0.00 H new ATOM 0 HA ASP A 58 -7.738 7.091 -19.780 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -6.428 5.335 -20.685 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -7.178 4.121 -19.668 1.00 0.00 H new ATOM 958 N ALA A 59 -10.201 6.500 -19.876 1.00 0.00 N ATOM 959 CA ALA A 59 -11.646 6.389 -19.719 1.00 0.00 C ATOM 960 C ALA A 59 -12.188 5.175 -20.466 1.00 0.00 C ATOM 961 O ALA A 59 -11.742 4.864 -21.570 1.00 0.00 O ATOM 962 CB ALA A 59 -12.329 7.658 -20.206 1.00 0.00 C ATOM 0 H ALA A 59 -9.905 7.044 -20.686 1.00 0.00 H new ATOM 0 HA ALA A 59 -11.862 6.257 -18.659 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -13.408 7.561 -20.083 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -11.973 8.509 -19.625 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -12.097 7.815 -21.259 1.00 0.00 H new ATOM 968 N ALA A 60 -13.151 4.492 -19.857 1.00 0.00 N ATOM 969 CA ALA A 60 -13.754 3.313 -20.466 1.00 0.00 C ATOM 970 C ALA A 60 -15.254 3.504 -20.664 1.00 0.00 C ATOM 971 O ALA A 60 -15.825 4.501 -20.226 1.00 0.00 O ATOM 972 CB ALA A 60 -13.485 2.082 -19.613 1.00 0.00 C ATOM 0 H ALA A 60 -13.531 4.735 -18.942 1.00 0.00 H new ATOM 0 HA ALA A 60 -13.300 3.168 -21.446 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -13.941 1.209 -20.080 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -12.410 1.927 -19.527 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -13.911 2.227 -18.620 1.00 0.00 H new ATOM 978 N GLU A 61 -15.886 2.541 -21.329 1.00 0.00 N ATOM 979 CA GLU A 61 -17.320 2.605 -21.586 1.00 0.00 C ATOM 980 C GLU A 61 -18.107 2.620 -20.279 1.00 0.00 C ATOM 981 O GLU A 61 -19.278 2.996 -20.252 1.00 0.00 O ATOM 982 CB GLU A 61 -17.760 1.418 -22.446 1.00 0.00 C ATOM 983 CG GLU A 61 -17.649 0.079 -21.737 1.00 0.00 C ATOM 984 CD GLU A 61 -18.344 -1.039 -22.490 1.00 0.00 C ATOM 985 OE1 GLU A 61 -18.798 -0.794 -23.628 1.00 0.00 O ATOM 986 OE2 GLU A 61 -18.434 -2.157 -21.943 1.00 0.00 O ATOM 0 H GLU A 61 -15.428 1.708 -21.699 1.00 0.00 H new ATOM 0 HA GLU A 61 -17.526 3.530 -22.124 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -18.793 1.570 -22.758 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -17.154 1.392 -23.351 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -16.597 -0.174 -21.609 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -18.080 0.163 -20.740 1.00 0.00 H new ATOM 993 N ALA A 62 -17.454 2.207 -19.197 1.00 0.00 N ATOM 994 CA ALA A 62 -18.091 2.175 -17.887 1.00 0.00 C ATOM 995 C ALA A 62 -17.054 2.239 -16.770 1.00 0.00 C ATOM 996 O ALA A 62 -15.875 1.957 -16.986 1.00 0.00 O ATOM 997 CB ALA A 62 -18.944 0.922 -17.746 1.00 0.00 C ATOM 0 H ALA A 62 -16.484 1.890 -19.203 1.00 0.00 H new ATOM 0 HA ALA A 62 -18.734 3.051 -17.801 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -19.414 0.911 -16.763 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -19.715 0.918 -18.517 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -18.315 0.039 -17.857 1.00 0.00 H new ATOM 1003 N THR A 63 -17.501 2.613 -15.575 1.00 0.00 N ATOM 1004 CA THR A 63 -16.611 2.716 -14.425 1.00 0.00 C ATOM 1005 C THR A 63 -17.111 1.863 -13.265 1.00 0.00 C ATOM 1006 O THR A 63 -18.256 1.996 -12.831 1.00 0.00 O ATOM 1007 CB THR A 63 -16.473 4.175 -13.952 1.00 0.00 C ATOM 1008 OG1 THR A 63 -16.240 5.034 -15.073 1.00 0.00 O ATOM 1009 CG2 THR A 63 -15.333 4.315 -12.954 1.00 0.00 C ATOM 0 H THR A 63 -18.474 2.849 -15.378 1.00 0.00 H new ATOM 0 HA THR A 63 -15.635 2.351 -14.746 1.00 0.00 H new ATOM 0 HB THR A 63 -17.402 4.464 -13.461 1.00 0.00 H new ATOM 0 HG1 THR A 63 -16.155 5.960 -14.764 1.00 0.00 H new ATOM 0 HG21 THR A 63 -15.255 5.354 -12.634 1.00 0.00 H new ATOM 0 HG22 THR A 63 -15.528 3.682 -12.088 1.00 0.00 H new ATOM 0 HG23 THR A 63 -14.398 4.009 -13.424 1.00 0.00 H new ATOM 1017 N LEU A 64 -16.246 0.986 -12.767 1.00 0.00 N ATOM 1018 CA LEU A 64 -16.600 0.110 -11.655 1.00 0.00 C ATOM 1019 C LEU A 64 -15.791 0.458 -10.409 1.00 0.00 C ATOM 1020 O LEU A 64 -14.590 0.198 -10.342 1.00 0.00 O ATOM 1021 CB LEU A 64 -16.365 -1.352 -12.037 1.00 0.00 C ATOM 1022 CG LEU A 64 -16.348 -2.354 -10.882 1.00 0.00 C ATOM 1023 CD1 LEU A 64 -17.733 -2.483 -10.267 1.00 0.00 C ATOM 1024 CD2 LEU A 64 -15.846 -3.709 -11.358 1.00 0.00 C ATOM 0 H LEU A 64 -15.295 0.863 -13.115 1.00 0.00 H new ATOM 0 HA LEU A 64 -17.657 0.256 -11.432 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -17.142 -1.652 -12.740 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -15.414 -1.420 -12.565 1.00 0.00 H new ATOM 0 HG LEU A 64 -15.666 -1.985 -10.116 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -17.702 -3.200 -9.447 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -18.055 -1.513 -9.889 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -18.437 -2.829 -11.024 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -15.841 -4.409 -10.523 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -16.503 -4.085 -12.143 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -14.834 -3.605 -11.750 1.00 0.00 H new ATOM 1036 N THR A 65 -16.459 1.047 -9.422 1.00 0.00 N ATOM 1037 CA THR A 65 -15.804 1.430 -8.177 1.00 0.00 C ATOM 1038 C THR A 65 -15.964 0.347 -7.116 1.00 0.00 C ATOM 1039 O THR A 65 -17.082 -0.010 -6.745 1.00 0.00 O ATOM 1040 CB THR A 65 -16.366 2.756 -7.631 1.00 0.00 C ATOM 1041 OG1 THR A 65 -16.663 3.645 -8.714 1.00 0.00 O ATOM 1042 CG2 THR A 65 -15.374 3.415 -6.685 1.00 0.00 C ATOM 0 H THR A 65 -17.454 1.269 -9.461 1.00 0.00 H new ATOM 0 HA THR A 65 -14.746 1.559 -8.403 1.00 0.00 H new ATOM 0 HB THR A 65 -17.280 2.538 -7.079 1.00 0.00 H new ATOM 0 HG1 THR A 65 -16.555 4.572 -8.415 1.00 0.00 H new ATOM 0 HG21 THR A 65 -15.793 4.350 -6.312 1.00 0.00 H new ATOM 0 HG22 THR A 65 -15.172 2.748 -5.847 1.00 0.00 H new ATOM 0 HG23 THR A 65 -14.445 3.620 -7.217 1.00 0.00 H new ATOM 1050 N MET A 66 -14.841 -0.170 -6.630 1.00 0.00 N ATOM 1051 CA MET A 66 -14.858 -1.211 -5.609 1.00 0.00 C ATOM 1052 C MET A 66 -13.602 -1.145 -4.745 1.00 0.00 C ATOM 1053 O MET A 66 -12.499 -0.949 -5.252 1.00 0.00 O ATOM 1054 CB MET A 66 -14.971 -2.591 -6.259 1.00 0.00 C ATOM 1055 CG MET A 66 -16.146 -3.409 -5.748 1.00 0.00 C ATOM 1056 SD MET A 66 -16.916 -4.402 -7.041 1.00 0.00 S ATOM 1057 CE MET A 66 -15.709 -5.713 -7.225 1.00 0.00 C ATOM 0 H MET A 66 -13.908 0.115 -6.927 1.00 0.00 H new ATOM 0 HA MET A 66 -15.726 -1.045 -4.971 1.00 0.00 H new ATOM 0 HB2 MET A 66 -15.066 -2.469 -7.338 1.00 0.00 H new ATOM 0 HB3 MET A 66 -14.049 -3.144 -6.081 1.00 0.00 H new ATOM 0 HG2 MET A 66 -15.806 -4.064 -4.946 1.00 0.00 H new ATOM 0 HG3 MET A 66 -16.890 -2.739 -5.318 1.00 0.00 H new ATOM 0 HE1 MET A 66 -16.026 -6.391 -8.017 1.00 0.00 H new ATOM 0 HE2 MET A 66 -14.741 -5.283 -7.482 1.00 0.00 H new ATOM 0 HE3 MET A 66 -15.624 -6.264 -6.288 1.00 0.00 H new ATOM 1067 N GLU A 67 -13.780 -1.310 -3.438 1.00 0.00 N ATOM 1068 CA GLU A 67 -12.661 -1.268 -2.504 1.00 0.00 C ATOM 1069 C GLU A 67 -11.673 -2.396 -2.787 1.00 0.00 C ATOM 1070 O GLU A 67 -11.962 -3.309 -3.561 1.00 0.00 O ATOM 1071 CB GLU A 67 -13.166 -1.367 -1.063 1.00 0.00 C ATOM 1072 CG GLU A 67 -13.830 -0.095 -0.562 1.00 0.00 C ATOM 1073 CD GLU A 67 -15.136 -0.364 0.159 1.00 0.00 C ATOM 1074 OE1 GLU A 67 -15.092 -0.882 1.294 1.00 0.00 O ATOM 1075 OE2 GLU A 67 -16.203 -0.057 -0.413 1.00 0.00 O ATOM 0 H GLU A 67 -14.688 -1.474 -3.002 1.00 0.00 H new ATOM 0 HA GLU A 67 -12.147 -0.316 -2.636 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -13.877 -2.190 -0.992 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -12.329 -1.611 -0.409 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -13.148 0.425 0.111 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -14.015 0.570 -1.405 1.00 0.00 H new ATOM 1082 N ASP A 68 -10.507 -2.326 -2.155 1.00 0.00 N ATOM 1083 CA ASP A 68 -9.476 -3.341 -2.337 1.00 0.00 C ATOM 1084 C ASP A 68 -9.962 -4.703 -1.849 1.00 0.00 C ATOM 1085 O ASP A 68 -9.937 -5.685 -2.591 1.00 0.00 O ATOM 1086 CB ASP A 68 -8.201 -2.944 -1.592 1.00 0.00 C ATOM 1087 CG ASP A 68 -7.073 -3.934 -1.806 1.00 0.00 C ATOM 1088 OD1 ASP A 68 -7.307 -4.967 -2.468 1.00 0.00 O ATOM 1089 OD2 ASP A 68 -5.956 -3.675 -1.312 1.00 0.00 O ATOM 0 H ASP A 68 -10.252 -1.577 -1.512 1.00 0.00 H new ATOM 0 HA ASP A 68 -9.257 -3.413 -3.402 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -7.882 -1.956 -1.925 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -8.416 -2.867 -0.526 1.00 0.00 H new ATOM 1094 N ASP A 69 -10.402 -4.754 -0.596 1.00 0.00 N ATOM 1095 CA ASP A 69 -10.893 -5.995 -0.008 1.00 0.00 C ATOM 1096 C ASP A 69 -12.113 -6.509 -0.766 1.00 0.00 C ATOM 1097 O ASP A 69 -12.330 -7.717 -0.865 1.00 0.00 O ATOM 1098 CB ASP A 69 -11.244 -5.782 1.465 1.00 0.00 C ATOM 1099 CG ASP A 69 -12.653 -5.254 1.654 1.00 0.00 C ATOM 1100 OD1 ASP A 69 -13.597 -6.072 1.669 1.00 0.00 O ATOM 1101 OD2 ASP A 69 -12.811 -4.022 1.787 1.00 0.00 O ATOM 0 H ASP A 69 -10.429 -3.950 0.032 1.00 0.00 H new ATOM 0 HA ASP A 69 -10.102 -6.741 -0.080 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -11.138 -6.725 2.001 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -10.535 -5.082 1.907 1.00 0.00 H new ATOM 1106 N ILE A 70 -12.906 -5.585 -1.298 1.00 0.00 N ATOM 1107 CA ILE A 70 -14.104 -5.946 -2.046 1.00 0.00 C ATOM 1108 C ILE A 70 -13.748 -6.476 -3.431 1.00 0.00 C ATOM 1109 O ILE A 70 -14.198 -7.549 -3.830 1.00 0.00 O ATOM 1110 CB ILE A 70 -15.056 -4.745 -2.197 1.00 0.00 C ATOM 1111 CG1 ILE A 70 -15.229 -4.031 -0.855 1.00 0.00 C ATOM 1112 CG2 ILE A 70 -16.403 -5.202 -2.737 1.00 0.00 C ATOM 1113 CD1 ILE A 70 -16.160 -4.749 0.096 1.00 0.00 C ATOM 0 H ILE A 70 -12.741 -4.581 -1.225 1.00 0.00 H new ATOM 0 HA ILE A 70 -14.607 -6.729 -1.478 1.00 0.00 H new ATOM 0 HB ILE A 70 -14.621 -4.042 -2.907 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -14.253 -3.922 -0.382 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -15.610 -3.026 -1.034 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -17.065 -4.342 -2.838 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -16.264 -5.670 -3.712 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -16.846 -5.922 -2.049 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -16.235 -4.186 1.026 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -17.148 -4.835 -0.357 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -15.769 -5.745 0.305 1.00 0.00 H new ATOM 1125 N MET A 71 -12.936 -5.716 -4.158 1.00 0.00 N ATOM 1126 CA MET A 71 -12.517 -6.111 -5.498 1.00 0.00 C ATOM 1127 C MET A 71 -11.956 -7.530 -5.496 1.00 0.00 C ATOM 1128 O MET A 71 -12.082 -8.259 -6.480 1.00 0.00 O ATOM 1129 CB MET A 71 -11.467 -5.136 -6.036 1.00 0.00 C ATOM 1130 CG MET A 71 -11.124 -5.359 -7.500 1.00 0.00 C ATOM 1131 SD MET A 71 -10.726 -3.826 -8.361 1.00 0.00 S ATOM 1132 CE MET A 71 -12.362 -3.134 -8.594 1.00 0.00 C ATOM 0 H MET A 71 -12.555 -4.824 -3.842 1.00 0.00 H new ATOM 0 HA MET A 71 -13.392 -6.086 -6.147 1.00 0.00 H new ATOM 0 HB2 MET A 71 -11.830 -4.116 -5.908 1.00 0.00 H new ATOM 0 HB3 MET A 71 -10.559 -5.228 -5.440 1.00 0.00 H new ATOM 0 HG2 MET A 71 -10.277 -6.041 -7.571 1.00 0.00 H new ATOM 0 HG3 MET A 71 -11.965 -5.842 -7.997 1.00 0.00 H new ATOM 0 HE1 MET A 71 -12.407 -2.621 -9.555 1.00 0.00 H new ATOM 0 HE2 MET A 71 -13.102 -3.934 -8.575 1.00 0.00 H new ATOM 0 HE3 MET A 71 -12.574 -2.425 -7.794 1.00 0.00 H new ATOM 1142 N PHE A 72 -11.337 -7.915 -4.385 1.00 0.00 N ATOM 1143 CA PHE A 72 -10.756 -9.246 -4.257 1.00 0.00 C ATOM 1144 C PHE A 72 -11.847 -10.308 -4.148 1.00 0.00 C ATOM 1145 O PHE A 72 -11.742 -11.383 -4.737 1.00 0.00 O ATOM 1146 CB PHE A 72 -9.843 -9.311 -3.031 1.00 0.00 C ATOM 1147 CG PHE A 72 -8.729 -10.309 -3.166 1.00 0.00 C ATOM 1148 CD1 PHE A 72 -7.627 -10.036 -3.961 1.00 0.00 C ATOM 1149 CD2 PHE A 72 -8.783 -11.522 -2.497 1.00 0.00 C ATOM 1150 CE1 PHE A 72 -6.601 -10.953 -4.087 1.00 0.00 C ATOM 1151 CE2 PHE A 72 -7.760 -12.443 -2.619 1.00 0.00 C ATOM 1152 CZ PHE A 72 -6.667 -12.158 -3.414 1.00 0.00 C ATOM 0 H PHE A 72 -11.225 -7.324 -3.561 1.00 0.00 H new ATOM 0 HA PHE A 72 -10.167 -9.445 -5.152 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -9.416 -8.324 -2.853 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -10.441 -9.562 -2.155 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -7.569 -9.095 -4.488 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -9.635 -11.750 -1.873 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -5.749 -10.728 -4.711 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -7.815 -13.385 -2.093 1.00 0.00 H new ATOM 0 HZ PHE A 72 -5.866 -12.876 -3.509 1.00 0.00 H new ATOM 1162 N ALA A 73 -12.894 -9.997 -3.391 1.00 0.00 N ATOM 1163 CA ALA A 73 -14.005 -10.922 -3.205 1.00 0.00 C ATOM 1164 C ALA A 73 -14.663 -11.264 -4.538 1.00 0.00 C ATOM 1165 O ALA A 73 -14.825 -12.436 -4.878 1.00 0.00 O ATOM 1166 CB ALA A 73 -15.028 -10.332 -2.245 1.00 0.00 C ATOM 0 H ALA A 73 -12.996 -9.111 -2.896 1.00 0.00 H new ATOM 0 HA ALA A 73 -13.611 -11.844 -2.777 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -15.852 -11.033 -2.115 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -14.556 -10.144 -1.281 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -15.409 -9.395 -2.651 1.00 0.00 H new ATOM 1172 N ILE A 74 -15.039 -10.234 -5.288 1.00 0.00 N ATOM 1173 CA ILE A 74 -15.679 -10.426 -6.583 1.00 0.00 C ATOM 1174 C ILE A 74 -14.648 -10.718 -7.668 1.00 0.00 C ATOM 1175 O ILE A 74 -14.978 -11.250 -8.727 1.00 0.00 O ATOM 1176 CB ILE A 74 -16.504 -9.192 -6.993 1.00 0.00 C ATOM 1177 CG1 ILE A 74 -17.143 -8.547 -5.762 1.00 0.00 C ATOM 1178 CG2 ILE A 74 -17.568 -9.579 -8.009 1.00 0.00 C ATOM 1179 CD1 ILE A 74 -17.988 -9.503 -4.949 1.00 0.00 C ATOM 0 H ILE A 74 -14.911 -9.258 -5.021 1.00 0.00 H new ATOM 0 HA ILE A 74 -16.347 -11.281 -6.480 1.00 0.00 H new ATOM 0 HB ILE A 74 -15.837 -8.465 -7.456 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -16.357 -8.139 -5.126 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -17.762 -7.709 -6.081 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -18.142 -8.696 -8.289 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -17.090 -9.997 -8.895 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -18.235 -10.322 -7.572 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -18.409 -8.978 -4.092 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -18.796 -9.892 -5.569 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -17.369 -10.329 -4.599 1.00 0.00 H new ATOM 1191 N GLY A 75 -13.395 -10.367 -7.395 1.00 0.00 N ATOM 1192 CA GLY A 75 -12.333 -10.600 -8.357 1.00 0.00 C ATOM 1193 C GLY A 75 -11.935 -12.060 -8.438 1.00 0.00 C ATOM 1194 O GLY A 75 -11.590 -12.559 -9.510 1.00 0.00 O ATOM 0 H GLY A 75 -13.096 -9.926 -6.525 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -12.657 -10.260 -9.341 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -11.462 -10.004 -8.084 1.00 0.00 H new ATOM 1198 N THR A 76 -11.982 -12.750 -7.302 1.00 0.00 N ATOM 1199 CA THR A 76 -11.622 -14.161 -7.249 1.00 0.00 C ATOM 1200 C THR A 76 -12.862 -15.046 -7.272 1.00 0.00 C ATOM 1201 O THR A 76 -12.775 -16.258 -7.078 1.00 0.00 O ATOM 1202 CB THR A 76 -10.799 -14.483 -5.987 1.00 0.00 C ATOM 1203 OG1 THR A 76 -10.266 -15.809 -6.075 1.00 0.00 O ATOM 1204 CG2 THR A 76 -11.654 -14.356 -4.736 1.00 0.00 C ATOM 0 H THR A 76 -12.266 -12.354 -6.406 1.00 0.00 H new ATOM 0 HA THR A 76 -11.016 -14.366 -8.132 1.00 0.00 H new ATOM 0 HB THR A 76 -9.980 -13.767 -5.922 1.00 0.00 H new ATOM 0 HG1 THR A 76 -10.939 -16.407 -6.461 1.00 0.00 H new ATOM 0 HG21 THR A 76 -11.051 -14.588 -3.858 1.00 0.00 H new ATOM 0 HG22 THR A 76 -12.033 -13.337 -4.657 1.00 0.00 H new ATOM 0 HG23 THR A 76 -12.491 -15.051 -4.795 1.00 0.00 H new ATOM 1212 N GLY A 77 -14.017 -14.433 -7.512 1.00 0.00 N ATOM 1213 CA GLY A 77 -15.260 -15.182 -7.557 1.00 0.00 C ATOM 1214 C GLY A 77 -15.807 -15.482 -6.175 1.00 0.00 C ATOM 1215 O GLY A 77 -16.878 -16.071 -6.039 1.00 0.00 O ATOM 0 H GLY A 77 -14.114 -13.431 -7.676 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -16.001 -14.617 -8.123 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -15.097 -16.118 -8.091 1.00 0.00 H new ATOM 1219 N ALA A 78 -15.068 -15.076 -5.147 1.00 0.00 N ATOM 1220 CA ALA A 78 -15.485 -15.304 -3.770 1.00 0.00 C ATOM 1221 C ALA A 78 -16.925 -14.851 -3.550 1.00 0.00 C ATOM 1222 O ALA A 78 -17.785 -15.646 -3.168 1.00 0.00 O ATOM 1223 CB ALA A 78 -14.551 -14.583 -2.809 1.00 0.00 C ATOM 0 H ALA A 78 -14.178 -14.588 -5.243 1.00 0.00 H new ATOM 0 HA ALA A 78 -15.434 -16.375 -3.574 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -14.875 -14.762 -1.784 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -13.535 -14.957 -2.939 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -14.573 -13.513 -3.015 1.00 0.00 H new ATOM 1229 N LEU A 79 -17.181 -13.571 -3.793 1.00 0.00 N ATOM 1230 CA LEU A 79 -18.517 -13.012 -3.621 1.00 0.00 C ATOM 1231 C LEU A 79 -19.121 -12.621 -4.966 1.00 0.00 C ATOM 1232 O LEU A 79 -18.430 -12.158 -5.874 1.00 0.00 O ATOM 1233 CB LEU A 79 -18.467 -11.793 -2.698 1.00 0.00 C ATOM 1234 CG LEU A 79 -18.668 -12.070 -1.208 1.00 0.00 C ATOM 1235 CD1 LEU A 79 -18.287 -10.851 -0.382 1.00 0.00 C ATOM 1236 CD2 LEU A 79 -20.109 -12.475 -0.931 1.00 0.00 C ATOM 0 H LEU A 79 -16.481 -12.900 -4.110 1.00 0.00 H new ATOM 0 HA LEU A 79 -19.148 -13.777 -3.168 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -17.502 -11.303 -2.829 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -19.231 -11.086 -3.022 1.00 0.00 H new ATOM 0 HG LEU A 79 -18.017 -12.896 -0.920 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -18.437 -11.067 0.676 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -17.240 -10.605 -0.558 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -18.911 -10.006 -0.672 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -20.234 -12.668 0.134 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -20.778 -11.670 -1.235 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -20.348 -13.377 -1.494 1.00 0.00 H new ATOM 1248 N PRO A 80 -20.442 -12.809 -5.099 1.00 0.00 N ATOM 1249 CA PRO A 80 -21.169 -12.480 -6.328 1.00 0.00 C ATOM 1250 C PRO A 80 -21.261 -10.976 -6.563 1.00 0.00 C ATOM 1251 O PRO A 80 -21.614 -10.218 -5.661 1.00 0.00 O ATOM 1252 CB PRO A 80 -22.561 -13.069 -6.086 1.00 0.00 C ATOM 1253 CG PRO A 80 -22.706 -13.100 -4.604 1.00 0.00 C ATOM 1254 CD PRO A 80 -21.329 -13.357 -4.058 1.00 0.00 C ATOM 0 HA PRO A 80 -20.671 -12.876 -7.213 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -23.336 -12.456 -6.547 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -22.648 -14.068 -6.513 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -23.104 -12.156 -4.231 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -23.400 -13.882 -4.296 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -21.178 -12.861 -3.099 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -21.152 -14.421 -3.898 1.00 0.00 H new ATOM 1262 N ALA A 81 -20.941 -10.552 -7.781 1.00 0.00 N ATOM 1263 CA ALA A 81 -20.989 -9.138 -8.135 1.00 0.00 C ATOM 1264 C ALA A 81 -22.414 -8.602 -8.057 1.00 0.00 C ATOM 1265 O ALA A 81 -22.629 -7.408 -7.845 1.00 0.00 O ATOM 1266 CB ALA A 81 -20.417 -8.923 -9.528 1.00 0.00 C ATOM 0 H ALA A 81 -20.646 -11.167 -8.539 1.00 0.00 H new ATOM 0 HA ALA A 81 -20.382 -8.587 -7.417 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -20.459 -7.863 -9.779 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -19.381 -9.261 -9.552 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -21.001 -9.491 -10.253 1.00 0.00 H new ATOM 1272 N LYS A 82 -23.387 -9.490 -8.231 1.00 0.00 N ATOM 1273 CA LYS A 82 -24.792 -9.107 -8.180 1.00 0.00 C ATOM 1274 C LYS A 82 -25.188 -8.677 -6.772 1.00 0.00 C ATOM 1275 O LYS A 82 -25.780 -7.615 -6.581 1.00 0.00 O ATOM 1276 CB LYS A 82 -25.676 -10.270 -8.637 1.00 0.00 C ATOM 1277 CG LYS A 82 -25.346 -11.588 -7.958 1.00 0.00 C ATOM 1278 CD LYS A 82 -26.158 -12.734 -8.539 1.00 0.00 C ATOM 1279 CE LYS A 82 -25.359 -13.516 -9.571 1.00 0.00 C ATOM 1280 NZ LYS A 82 -26.209 -13.958 -10.711 1.00 0.00 N ATOM 0 H LYS A 82 -23.227 -10.482 -8.409 1.00 0.00 H new ATOM 0 HA LYS A 82 -24.937 -8.262 -8.853 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -26.719 -10.021 -8.441 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -25.574 -10.391 -9.715 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -24.283 -11.800 -8.071 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -25.543 -11.507 -6.889 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -26.471 -13.402 -7.737 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -27.065 -12.342 -9.000 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -24.544 -12.897 -9.945 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -24.906 -14.387 -9.096 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -25.907 -14.903 -11.023 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -27.203 -13.994 -10.409 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -26.111 -13.286 -11.498 1.00 0.00 H new ATOM 1294 N GLU A 83 -24.856 -9.507 -5.788 1.00 0.00 N ATOM 1295 CA GLU A 83 -25.177 -9.210 -4.397 1.00 0.00 C ATOM 1296 C GLU A 83 -24.450 -7.954 -3.927 1.00 0.00 C ATOM 1297 O GLU A 83 -25.062 -7.040 -3.375 1.00 0.00 O ATOM 1298 CB GLU A 83 -24.805 -10.393 -3.501 1.00 0.00 C ATOM 1299 CG GLU A 83 -25.520 -11.683 -3.868 1.00 0.00 C ATOM 1300 CD GLU A 83 -26.974 -11.687 -3.439 1.00 0.00 C ATOM 1301 OE1 GLU A 83 -27.406 -10.709 -2.795 1.00 0.00 O ATOM 1302 OE2 GLU A 83 -27.680 -12.670 -3.747 1.00 0.00 O ATOM 0 H GLU A 83 -24.365 -10.390 -5.928 1.00 0.00 H new ATOM 0 HA GLU A 83 -26.251 -9.035 -4.328 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -23.729 -10.556 -3.557 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -25.036 -10.141 -2.466 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -25.463 -11.831 -4.946 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -25.006 -12.524 -3.403 1.00 0.00 H new ATOM 1309 N ALA A 84 -23.140 -7.917 -4.150 1.00 0.00 N ATOM 1310 CA ALA A 84 -22.329 -6.773 -3.751 1.00 0.00 C ATOM 1311 C ALA A 84 -22.947 -5.466 -4.236 1.00 0.00 C ATOM 1312 O ALA A 84 -22.931 -4.461 -3.526 1.00 0.00 O ATOM 1313 CB ALA A 84 -20.912 -6.920 -4.285 1.00 0.00 C ATOM 0 H ALA A 84 -22.618 -8.666 -4.605 1.00 0.00 H new ATOM 0 HA ALA A 84 -22.294 -6.745 -2.662 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -20.317 -6.059 -3.980 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -20.465 -7.830 -3.885 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -20.937 -6.976 -5.373 1.00 0.00 H new ATOM 1319 N MET A 85 -23.491 -5.488 -5.448 1.00 0.00 N ATOM 1320 CA MET A 85 -24.114 -4.304 -6.027 1.00 0.00 C ATOM 1321 C MET A 85 -25.418 -3.971 -5.310 1.00 0.00 C ATOM 1322 O MET A 85 -25.752 -2.801 -5.119 1.00 0.00 O ATOM 1323 CB MET A 85 -24.380 -4.519 -7.518 1.00 0.00 C ATOM 1324 CG MET A 85 -23.639 -3.539 -8.414 1.00 0.00 C ATOM 1325 SD MET A 85 -24.749 -2.588 -9.471 1.00 0.00 S ATOM 1326 CE MET A 85 -24.372 -3.289 -11.075 1.00 0.00 C ATOM 0 H MET A 85 -23.513 -6.313 -6.048 1.00 0.00 H new ATOM 0 HA MET A 85 -23.428 -3.466 -5.905 1.00 0.00 H new ATOM 0 HB2 MET A 85 -24.092 -5.535 -7.788 1.00 0.00 H new ATOM 0 HB3 MET A 85 -25.450 -4.431 -7.704 1.00 0.00 H new ATOM 0 HG2 MET A 85 -23.058 -2.855 -7.795 1.00 0.00 H new ATOM 0 HG3 MET A 85 -22.931 -4.086 -9.036 1.00 0.00 H new ATOM 0 HE1 MET A 85 -24.539 -2.539 -11.848 1.00 0.00 H new ATOM 0 HE2 MET A 85 -23.330 -3.607 -11.097 1.00 0.00 H new ATOM 0 HE3 MET A 85 -25.018 -4.148 -11.257 1.00 0.00 H new ATOM 1336 N ALA A 86 -26.152 -5.006 -4.914 1.00 0.00 N ATOM 1337 CA ALA A 86 -27.419 -4.822 -4.216 1.00 0.00 C ATOM 1338 C ALA A 86 -27.191 -4.454 -2.754 1.00 0.00 C ATOM 1339 O ALA A 86 -28.053 -3.850 -2.116 1.00 0.00 O ATOM 1340 CB ALA A 86 -28.266 -6.081 -4.320 1.00 0.00 C ATOM 0 H ALA A 86 -25.891 -5.980 -5.065 1.00 0.00 H new ATOM 0 HA ALA A 86 -27.952 -3.999 -4.692 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -29.209 -5.930 -3.795 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -28.466 -6.299 -5.369 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -27.731 -6.918 -3.871 1.00 0.00 H new ATOM 1346 N GLN A 87 -26.027 -4.824 -2.230 1.00 0.00 N ATOM 1347 CA GLN A 87 -25.689 -4.533 -0.842 1.00 0.00 C ATOM 1348 C GLN A 87 -25.046 -3.156 -0.715 1.00 0.00 C ATOM 1349 O GLN A 87 -24.541 -2.791 0.347 1.00 0.00 O ATOM 1350 CB GLN A 87 -24.744 -5.603 -0.291 1.00 0.00 C ATOM 1351 CG GLN A 87 -25.317 -7.009 -0.349 1.00 0.00 C ATOM 1352 CD GLN A 87 -25.554 -7.601 1.026 1.00 0.00 C ATOM 1353 OE1 GLN A 87 -26.191 -6.982 1.880 1.00 0.00 O ATOM 1354 NE2 GLN A 87 -25.043 -8.806 1.250 1.00 0.00 N ATOM 0 H GLN A 87 -25.303 -5.325 -2.745 1.00 0.00 H new ATOM 0 HA GLN A 87 -26.611 -4.538 -0.261 1.00 0.00 H new ATOM 0 HB2 GLN A 87 -23.811 -5.576 -0.854 1.00 0.00 H new ATOM 0 HB3 GLN A 87 -24.499 -5.362 0.743 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -26.258 -6.991 -0.899 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -24.635 -7.652 -0.904 1.00 0.00 H new ATOM 0 HE21 GLN A 87 -24.522 -9.284 0.515 1.00 0.00 H new ATOM 0 HE22 GLN A 87 -25.172 -9.254 2.157 1.00 0.00 H new ATOM 1363 N ASP A 88 -25.067 -2.396 -1.804 1.00 0.00 N ATOM 1364 CA ASP A 88 -24.487 -1.058 -1.815 1.00 0.00 C ATOM 1365 C ASP A 88 -22.996 -1.110 -1.496 1.00 0.00 C ATOM 1366 O ASP A 88 -22.387 -0.096 -1.155 1.00 0.00 O ATOM 1367 CB ASP A 88 -25.205 -0.160 -0.807 1.00 0.00 C ATOM 1368 CG ASP A 88 -25.854 1.043 -1.464 1.00 0.00 C ATOM 1369 OD1 ASP A 88 -26.714 0.846 -2.347 1.00 0.00 O ATOM 1370 OD2 ASP A 88 -25.501 2.183 -1.094 1.00 0.00 O ATOM 0 H ASP A 88 -25.480 -2.684 -2.691 1.00 0.00 H new ATOM 0 HA ASP A 88 -24.613 -0.642 -2.815 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -25.966 -0.740 -0.285 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -24.493 0.180 -0.055 1.00 0.00 H new ATOM 1375 N LYS A 89 -22.413 -2.299 -1.609 1.00 0.00 N ATOM 1376 CA LYS A 89 -20.993 -2.485 -1.333 1.00 0.00 C ATOM 1377 C LYS A 89 -20.153 -2.159 -2.564 1.00 0.00 C ATOM 1378 O LYS A 89 -18.924 -2.222 -2.523 1.00 0.00 O ATOM 1379 CB LYS A 89 -20.724 -3.923 -0.885 1.00 0.00 C ATOM 1380 CG LYS A 89 -20.959 -4.152 0.598 1.00 0.00 C ATOM 1381 CD LYS A 89 -19.718 -3.835 1.416 1.00 0.00 C ATOM 1382 CE LYS A 89 -19.799 -4.441 2.808 1.00 0.00 C ATOM 1383 NZ LYS A 89 -18.528 -4.263 3.565 1.00 0.00 N ATOM 0 H LYS A 89 -22.902 -3.149 -1.890 1.00 0.00 H new ATOM 0 HA LYS A 89 -20.711 -1.803 -0.531 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -21.364 -4.598 -1.454 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -19.693 -4.183 -1.125 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -21.787 -3.529 0.936 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -21.251 -5.189 0.765 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -18.835 -4.216 0.903 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -19.599 -2.754 1.495 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -20.618 -3.978 3.359 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -20.029 -5.504 2.729 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -18.623 -4.689 4.509 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -17.751 -4.727 3.052 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -18.321 -3.248 3.663 1.00 0.00 H new ATOM 1397 N MET A 90 -20.823 -1.808 -3.657 1.00 0.00 N ATOM 1398 CA MET A 90 -20.137 -1.470 -4.898 1.00 0.00 C ATOM 1399 C MET A 90 -21.077 -0.752 -5.861 1.00 0.00 C ATOM 1400 O MET A 90 -22.292 -0.936 -5.808 1.00 0.00 O ATOM 1401 CB MET A 90 -19.579 -2.733 -5.558 1.00 0.00 C ATOM 1402 CG MET A 90 -20.565 -3.416 -6.492 1.00 0.00 C ATOM 1403 SD MET A 90 -20.326 -2.948 -8.217 1.00 0.00 S ATOM 1404 CE MET A 90 -20.119 -4.556 -8.978 1.00 0.00 C ATOM 0 H MET A 90 -21.840 -1.750 -3.708 1.00 0.00 H new ATOM 0 HA MET A 90 -19.312 -0.800 -4.657 1.00 0.00 H new ATOM 0 HB2 MET A 90 -18.680 -2.474 -6.118 1.00 0.00 H new ATOM 0 HB3 MET A 90 -19.279 -3.437 -4.782 1.00 0.00 H new ATOM 0 HG2 MET A 90 -20.462 -4.497 -6.395 1.00 0.00 H new ATOM 0 HG3 MET A 90 -21.581 -3.164 -6.189 1.00 0.00 H new ATOM 0 HE1 MET A 90 -20.315 -4.480 -10.048 1.00 0.00 H new ATOM 0 HE2 MET A 90 -19.098 -4.905 -8.820 1.00 0.00 H new ATOM 0 HE3 MET A 90 -20.818 -5.263 -8.530 1.00 0.00 H new ATOM 1414 N GLU A 91 -20.506 0.067 -6.739 1.00 0.00 N ATOM 1415 CA GLU A 91 -21.295 0.813 -7.712 1.00 0.00 C ATOM 1416 C GLU A 91 -20.673 0.720 -9.103 1.00 0.00 C ATOM 1417 O GLU A 91 -19.519 0.318 -9.253 1.00 0.00 O ATOM 1418 CB GLU A 91 -21.411 2.279 -7.291 1.00 0.00 C ATOM 1419 CG GLU A 91 -22.426 3.067 -8.102 1.00 0.00 C ATOM 1420 CD GLU A 91 -23.766 2.365 -8.200 1.00 0.00 C ATOM 1421 OE1 GLU A 91 -24.304 1.963 -7.147 1.00 0.00 O ATOM 1422 OE2 GLU A 91 -24.278 2.218 -9.330 1.00 0.00 O ATOM 0 H GLU A 91 -19.501 0.230 -6.796 1.00 0.00 H new ATOM 0 HA GLU A 91 -22.291 0.373 -7.748 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -21.686 2.325 -6.237 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -20.435 2.754 -7.387 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -22.566 4.048 -7.647 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -22.033 3.234 -9.105 1.00 0.00 H new ATOM 1429 N VAL A 92 -21.446 1.094 -10.117 1.00 0.00 N ATOM 1430 CA VAL A 92 -20.973 1.054 -11.495 1.00 0.00 C ATOM 1431 C VAL A 92 -21.625 2.148 -12.332 1.00 0.00 C ATOM 1432 O VAL A 92 -22.805 2.457 -12.159 1.00 0.00 O ATOM 1433 CB VAL A 92 -21.255 -0.313 -12.146 1.00 0.00 C ATOM 1434 CG1 VAL A 92 -22.713 -0.412 -12.570 1.00 0.00 C ATOM 1435 CG2 VAL A 92 -20.330 -0.539 -13.332 1.00 0.00 C ATOM 0 H VAL A 92 -22.404 1.428 -10.010 1.00 0.00 H new ATOM 0 HA VAL A 92 -19.896 1.218 -11.465 1.00 0.00 H new ATOM 0 HB VAL A 92 -21.062 -1.093 -11.410 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -22.894 -1.385 -13.028 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -23.355 -0.298 -11.696 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -22.937 0.375 -13.290 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -20.543 -1.510 -13.780 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -20.489 0.245 -14.072 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -19.294 -0.515 -12.995 1.00 0.00 H new ATOM 1445 N ASP A 93 -20.851 2.731 -13.241 1.00 0.00 N ATOM 1446 CA ASP A 93 -21.354 3.790 -14.108 1.00 0.00 C ATOM 1447 C ASP A 93 -21.208 3.406 -15.577 1.00 0.00 C ATOM 1448 O ASP A 93 -20.710 2.328 -15.901 1.00 0.00 O ATOM 1449 CB ASP A 93 -20.612 5.099 -13.834 1.00 0.00 C ATOM 1450 CG ASP A 93 -21.496 6.316 -14.020 1.00 0.00 C ATOM 1451 OD1 ASP A 93 -22.551 6.189 -14.676 1.00 0.00 O ATOM 1452 OD2 ASP A 93 -21.133 7.396 -13.509 1.00 0.00 O ATOM 0 H ASP A 93 -19.873 2.488 -13.396 1.00 0.00 H new ATOM 0 HA ASP A 93 -22.413 3.930 -13.891 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -20.225 5.087 -12.815 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -19.753 5.172 -14.501 1.00 0.00 H new ATOM 1457 N GLY A 94 -21.646 4.295 -16.463 1.00 0.00 N ATOM 1458 CA GLY A 94 -21.555 4.031 -17.887 1.00 0.00 C ATOM 1459 C GLY A 94 -22.736 3.234 -18.405 1.00 0.00 C ATOM 1460 O GLY A 94 -23.886 3.641 -18.242 1.00 0.00 O ATOM 0 H GLY A 94 -22.062 5.194 -16.220 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -21.494 4.977 -18.426 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -20.634 3.486 -18.094 1.00 0.00 H new ATOM 1464 N GLN A 95 -22.452 2.097 -19.032 1.00 0.00 N ATOM 1465 CA GLN A 95 -23.501 1.243 -19.578 1.00 0.00 C ATOM 1466 C GLN A 95 -23.853 0.124 -18.604 1.00 0.00 C ATOM 1467 O GLN A 95 -23.153 -0.886 -18.523 1.00 0.00 O ATOM 1468 CB GLN A 95 -23.060 0.651 -20.917 1.00 0.00 C ATOM 1469 CG GLN A 95 -23.688 1.334 -22.121 1.00 0.00 C ATOM 1470 CD GLN A 95 -25.203 1.277 -22.100 1.00 0.00 C ATOM 1471 OE1 GLN A 95 -25.754 0.092 -22.332 1.00 0.00 O flip ATOM 1472 NE2 GLN A 95 -25.870 2.288 -21.878 1.00 0.00 N flip ATOM 0 H GLN A 95 -21.505 1.746 -19.175 1.00 0.00 H new ATOM 0 HA GLN A 95 -24.389 1.855 -19.735 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -21.975 0.720 -20.996 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -23.314 -0.409 -20.937 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -23.368 2.375 -22.151 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -23.323 0.862 -23.033 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -25.404 3.179 -21.705 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -26.889 2.235 -21.867 1.00 0.00 H new ATOM 1481 N VAL A 96 -24.942 0.310 -17.864 1.00 0.00 N ATOM 1482 CA VAL A 96 -25.387 -0.685 -16.896 1.00 0.00 C ATOM 1483 C VAL A 96 -25.673 -2.021 -17.572 1.00 0.00 C ATOM 1484 O VAL A 96 -25.549 -3.078 -16.955 1.00 0.00 O ATOM 1485 CB VAL A 96 -26.652 -0.217 -16.152 1.00 0.00 C ATOM 1486 CG1 VAL A 96 -27.081 -1.252 -15.124 1.00 0.00 C ATOM 1487 CG2 VAL A 96 -26.414 1.134 -15.493 1.00 0.00 C ATOM 0 H VAL A 96 -25.532 1.140 -17.917 1.00 0.00 H new ATOM 0 HA VAL A 96 -24.577 -0.812 -16.177 1.00 0.00 H new ATOM 0 HB VAL A 96 -27.458 -0.105 -16.877 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -27.976 -0.904 -14.609 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -27.295 -2.196 -15.625 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -26.280 -1.399 -14.400 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -27.318 1.449 -14.972 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -25.594 1.051 -14.779 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -26.159 1.871 -16.255 1.00 0.00 H new ATOM 1497 N GLU A 97 -26.057 -1.964 -18.844 1.00 0.00 N ATOM 1498 CA GLU A 97 -26.361 -3.171 -19.603 1.00 0.00 C ATOM 1499 C GLU A 97 -25.084 -3.925 -19.960 1.00 0.00 C ATOM 1500 O GLU A 97 -25.110 -5.133 -20.202 1.00 0.00 O ATOM 1501 CB GLU A 97 -27.131 -2.817 -20.878 1.00 0.00 C ATOM 1502 CG GLU A 97 -28.597 -2.500 -20.636 1.00 0.00 C ATOM 1503 CD GLU A 97 -29.521 -3.587 -21.149 1.00 0.00 C ATOM 1504 OE1 GLU A 97 -29.572 -4.667 -20.525 1.00 0.00 O ATOM 1505 OE2 GLU A 97 -30.194 -3.356 -22.176 1.00 0.00 O ATOM 0 H GLU A 97 -26.165 -1.096 -19.369 1.00 0.00 H new ATOM 0 HA GLU A 97 -26.980 -3.816 -18.980 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -26.656 -1.958 -21.353 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -27.059 -3.649 -21.579 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -28.763 -2.361 -19.568 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -28.846 -1.557 -21.123 1.00 0.00 H new ATOM 1512 N LEU A 98 -23.968 -3.206 -19.992 1.00 0.00 N ATOM 1513 CA LEU A 98 -22.679 -3.806 -20.319 1.00 0.00 C ATOM 1514 C LEU A 98 -22.121 -4.581 -19.130 1.00 0.00 C ATOM 1515 O LEU A 98 -21.869 -5.783 -19.223 1.00 0.00 O ATOM 1516 CB LEU A 98 -21.686 -2.726 -20.750 1.00 0.00 C ATOM 1517 CG LEU A 98 -21.489 -2.557 -22.257 1.00 0.00 C ATOM 1518 CD1 LEU A 98 -20.704 -3.728 -22.827 1.00 0.00 C ATOM 1519 CD2 LEU A 98 -22.833 -2.422 -22.959 1.00 0.00 C ATOM 0 H LEU A 98 -23.929 -2.206 -19.795 1.00 0.00 H new ATOM 0 HA LEU A 98 -22.830 -4.502 -21.144 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -22.016 -1.772 -20.338 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -20.719 -2.950 -20.300 1.00 0.00 H new ATOM 0 HG LEU A 98 -20.918 -1.645 -22.429 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -20.574 -3.591 -23.900 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -19.727 -3.780 -22.346 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -21.248 -4.655 -22.643 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -22.673 -2.303 -24.031 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -23.429 -3.316 -22.778 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -23.360 -1.550 -22.571 1.00 0.00 H new ATOM 1531 N ILE A 99 -21.933 -3.886 -18.013 1.00 0.00 N ATOM 1532 CA ILE A 99 -21.408 -4.510 -16.805 1.00 0.00 C ATOM 1533 C ILE A 99 -22.220 -5.743 -16.426 1.00 0.00 C ATOM 1534 O ILE A 99 -21.718 -6.651 -15.762 1.00 0.00 O ATOM 1535 CB ILE A 99 -21.406 -3.527 -15.619 1.00 0.00 C ATOM 1536 CG1 ILE A 99 -22.837 -3.254 -15.152 1.00 0.00 C ATOM 1537 CG2 ILE A 99 -20.714 -2.229 -16.009 1.00 0.00 C ATOM 1538 CD1 ILE A 99 -23.252 -4.087 -13.960 1.00 0.00 C ATOM 0 H ILE A 99 -22.136 -2.891 -17.920 1.00 0.00 H new ATOM 0 HA ILE A 99 -20.382 -4.806 -17.023 1.00 0.00 H new ATOM 0 HB ILE A 99 -20.854 -3.977 -14.794 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -22.933 -2.198 -14.898 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -23.523 -3.447 -15.977 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -20.720 -1.544 -15.161 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -19.684 -2.438 -16.299 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -21.241 -1.773 -16.847 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -24.277 -3.841 -13.684 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -23.189 -5.145 -14.216 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -22.589 -3.876 -13.121 1.00 0.00 H new ATOM 1550 N PHE A 100 -23.478 -5.771 -16.854 1.00 0.00 N ATOM 1551 CA PHE A 100 -24.361 -6.895 -16.561 1.00 0.00 C ATOM 1552 C PHE A 100 -23.940 -8.135 -17.343 1.00 0.00 C ATOM 1553 O PHE A 100 -24.008 -9.256 -16.836 1.00 0.00 O ATOM 1554 CB PHE A 100 -25.809 -6.533 -16.895 1.00 0.00 C ATOM 1555 CG PHE A 100 -26.748 -6.679 -15.731 1.00 0.00 C ATOM 1556 CD1 PHE A 100 -27.010 -7.926 -15.188 1.00 0.00 C ATOM 1557 CD2 PHE A 100 -27.367 -5.569 -15.180 1.00 0.00 C ATOM 1558 CE1 PHE A 100 -27.873 -8.063 -14.117 1.00 0.00 C ATOM 1559 CE2 PHE A 100 -28.231 -5.699 -14.110 1.00 0.00 C ATOM 1560 CZ PHE A 100 -28.484 -6.948 -13.577 1.00 0.00 C ATOM 0 H PHE A 100 -23.909 -5.029 -17.405 1.00 0.00 H new ATOM 0 HA PHE A 100 -24.286 -7.117 -15.496 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -25.844 -5.504 -17.253 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -26.154 -7.167 -17.712 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -26.535 -8.801 -15.606 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -27.172 -4.590 -15.592 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -28.069 -9.041 -13.703 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -28.708 -4.825 -13.691 1.00 0.00 H new ATOM 0 HZ PHE A 100 -29.158 -7.053 -12.740 1.00 0.00 H new ATOM 1570 N LEU A 101 -23.507 -7.927 -18.582 1.00 0.00 N ATOM 1571 CA LEU A 101 -23.076 -9.028 -19.436 1.00 0.00 C ATOM 1572 C LEU A 101 -21.789 -9.654 -18.910 1.00 0.00 C ATOM 1573 O LEU A 101 -21.382 -10.730 -19.353 1.00 0.00 O ATOM 1574 CB LEU A 101 -22.868 -8.536 -20.870 1.00 0.00 C ATOM 1575 CG LEU A 101 -24.127 -8.422 -21.729 1.00 0.00 C ATOM 1576 CD1 LEU A 101 -23.857 -7.572 -22.961 1.00 0.00 C ATOM 1577 CD2 LEU A 101 -24.626 -9.803 -22.130 1.00 0.00 C ATOM 0 H LEU A 101 -23.445 -7.007 -19.017 1.00 0.00 H new ATOM 0 HA LEU A 101 -23.857 -9.788 -19.428 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -22.389 -7.558 -20.831 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -22.173 -9.212 -21.368 1.00 0.00 H new ATOM 0 HG LEU A 101 -24.903 -7.934 -21.139 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -24.765 -7.502 -23.561 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -23.547 -6.573 -22.653 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -23.065 -8.031 -23.553 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -25.523 -9.702 -22.741 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -23.853 -10.317 -22.701 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -24.860 -10.380 -21.235 1.00 0.00 H new ATOM 1589 N LEU A 102 -21.152 -8.976 -17.961 1.00 0.00 N ATOM 1590 CA LEU A 102 -19.911 -9.467 -17.372 1.00 0.00 C ATOM 1591 C LEU A 102 -20.197 -10.463 -16.253 1.00 0.00 C ATOM 1592 O LEU A 102 -19.467 -11.439 -16.077 1.00 0.00 O ATOM 1593 CB LEU A 102 -19.083 -8.299 -16.832 1.00 0.00 C ATOM 1594 CG LEU A 102 -18.251 -7.534 -17.861 1.00 0.00 C ATOM 1595 CD1 LEU A 102 -17.461 -6.422 -17.188 1.00 0.00 C ATOM 1596 CD2 LEU A 102 -17.318 -8.480 -18.602 1.00 0.00 C ATOM 0 H LEU A 102 -21.474 -8.085 -17.583 1.00 0.00 H new ATOM 0 HA LEU A 102 -19.344 -9.977 -18.151 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -19.758 -7.596 -16.345 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -18.412 -8.681 -16.063 1.00 0.00 H new ATOM 0 HG LEU A 102 -18.929 -7.083 -18.586 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -16.875 -5.888 -17.936 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -18.149 -5.729 -16.704 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -16.793 -6.851 -16.441 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -16.734 -7.918 -19.331 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -16.646 -8.960 -17.890 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -17.905 -9.241 -19.117 1.00 0.00 H new ATOM 1608 N GLU A 103 -21.263 -10.211 -15.500 1.00 0.00 N ATOM 1609 CA GLU A 103 -21.645 -11.088 -14.400 1.00 0.00 C ATOM 1610 C GLU A 103 -21.589 -12.552 -14.825 1.00 0.00 C ATOM 1611 O GLU A 103 -20.863 -13.364 -14.252 1.00 0.00 O ATOM 1612 CB GLU A 103 -23.052 -10.742 -13.907 1.00 0.00 C ATOM 1613 CG GLU A 103 -23.071 -10.050 -12.554 1.00 0.00 C ATOM 1614 CD GLU A 103 -23.688 -10.909 -11.468 1.00 0.00 C ATOM 1615 OE1 GLU A 103 -24.829 -11.379 -11.660 1.00 0.00 O ATOM 1616 OE2 GLU A 103 -23.030 -11.112 -10.427 1.00 0.00 O ATOM 0 H GLU A 103 -21.877 -9.407 -15.632 1.00 0.00 H new ATOM 0 HA GLU A 103 -20.935 -10.937 -13.587 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -23.537 -10.099 -14.641 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -23.641 -11.657 -13.846 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -22.052 -9.788 -12.270 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -23.629 -9.117 -12.635 1.00 0.00 H new ATOM 1623 N PRO A 104 -22.375 -12.899 -15.856 1.00 0.00 N ATOM 1624 CA PRO A 104 -22.434 -14.266 -16.382 1.00 0.00 C ATOM 1625 C PRO A 104 -21.149 -14.666 -17.099 1.00 0.00 C ATOM 1626 O PRO A 104 -20.994 -15.812 -17.522 1.00 0.00 O ATOM 1627 CB PRO A 104 -23.604 -14.217 -17.367 1.00 0.00 C ATOM 1628 CG PRO A 104 -23.689 -12.789 -17.784 1.00 0.00 C ATOM 1629 CD PRO A 104 -23.266 -11.982 -16.587 1.00 0.00 C ATOM 0 HA PRO A 104 -22.558 -15.003 -15.589 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -23.429 -14.869 -18.222 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -24.530 -14.548 -16.898 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -23.039 -12.592 -18.637 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -24.703 -12.531 -18.090 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -22.749 -11.068 -16.880 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -24.121 -11.684 -15.981 1.00 0.00 H new ATOM 1637 N PHE A 105 -20.230 -13.716 -17.233 1.00 0.00 N ATOM 1638 CA PHE A 105 -18.959 -13.970 -17.900 1.00 0.00 C ATOM 1639 C PHE A 105 -17.854 -14.237 -16.882 1.00 0.00 C ATOM 1640 O PHE A 105 -16.780 -14.728 -17.230 1.00 0.00 O ATOM 1641 CB PHE A 105 -18.576 -12.781 -18.784 1.00 0.00 C ATOM 1642 CG PHE A 105 -17.782 -13.169 -19.999 1.00 0.00 C ATOM 1643 CD1 PHE A 105 -18.343 -13.963 -20.986 1.00 0.00 C ATOM 1644 CD2 PHE A 105 -16.474 -12.739 -20.154 1.00 0.00 C ATOM 1645 CE1 PHE A 105 -17.614 -14.322 -22.103 1.00 0.00 C ATOM 1646 CE2 PHE A 105 -15.740 -13.094 -21.270 1.00 0.00 C ATOM 1647 CZ PHE A 105 -16.311 -13.886 -22.246 1.00 0.00 C ATOM 0 H PHE A 105 -20.342 -12.763 -16.888 1.00 0.00 H new ATOM 0 HA PHE A 105 -19.076 -14.856 -18.524 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -19.483 -12.267 -19.102 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -17.998 -12.071 -18.193 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -19.362 -14.305 -20.881 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -16.023 -12.119 -19.394 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -18.062 -14.943 -22.864 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -14.721 -12.752 -21.378 1.00 0.00 H new ATOM 0 HZ PHE A 105 -15.740 -14.164 -23.120 1.00 0.00 H new ATOM 1657 N ILE A 106 -18.126 -13.909 -15.623 1.00 0.00 N ATOM 1658 CA ILE A 106 -17.156 -14.113 -14.554 1.00 0.00 C ATOM 1659 C ILE A 106 -16.628 -15.544 -14.557 1.00 0.00 C ATOM 1660 O ILE A 106 -15.457 -15.785 -14.266 1.00 0.00 O ATOM 1661 CB ILE A 106 -17.766 -13.806 -13.174 1.00 0.00 C ATOM 1662 CG1 ILE A 106 -18.281 -12.365 -13.129 1.00 0.00 C ATOM 1663 CG2 ILE A 106 -16.740 -14.042 -12.076 1.00 0.00 C ATOM 1664 CD1 ILE A 106 -19.093 -12.052 -11.892 1.00 0.00 C ATOM 0 H ILE A 106 -19.010 -13.501 -15.319 1.00 0.00 H new ATOM 0 HA ILE A 106 -16.332 -13.424 -14.739 1.00 0.00 H new ATOM 0 HB ILE A 106 -18.608 -14.478 -13.008 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -17.432 -11.683 -13.179 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -18.892 -12.178 -14.012 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -17.187 -13.821 -11.107 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -16.417 -15.083 -12.097 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -15.880 -13.392 -12.236 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -19.425 -11.014 -11.928 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -19.961 -12.710 -11.851 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -18.479 -12.206 -11.005 1.00 0.00 H new ATOM 1676 N ALA A 107 -17.501 -16.490 -14.890 1.00 0.00 N ATOM 1677 CA ALA A 107 -17.122 -17.896 -14.935 1.00 0.00 C ATOM 1678 C ALA A 107 -15.943 -18.118 -15.876 1.00 0.00 C ATOM 1679 O ALA A 107 -15.125 -19.013 -15.663 1.00 0.00 O ATOM 1680 CB ALA A 107 -18.307 -18.749 -15.362 1.00 0.00 C ATOM 0 H ALA A 107 -18.475 -16.307 -15.132 1.00 0.00 H new ATOM 0 HA ALA A 107 -16.815 -18.195 -13.933 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -18.009 -19.797 -15.391 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -19.122 -18.623 -14.649 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -18.640 -18.439 -16.352 1.00 0.00 H new ATOM 1686 N SER A 108 -15.861 -17.297 -16.918 1.00 0.00 N ATOM 1687 CA SER A 108 -14.784 -17.406 -17.895 1.00 0.00 C ATOM 1688 C SER A 108 -13.453 -16.975 -17.287 1.00 0.00 C ATOM 1689 O SER A 108 -12.454 -17.690 -17.378 1.00 0.00 O ATOM 1690 CB SER A 108 -15.095 -16.553 -19.127 1.00 0.00 C ATOM 1691 OG SER A 108 -14.651 -17.188 -20.313 1.00 0.00 O ATOM 0 H SER A 108 -16.528 -16.549 -17.107 1.00 0.00 H new ATOM 0 HA SER A 108 -14.705 -18.451 -18.196 1.00 0.00 H new ATOM 0 HB2 SER A 108 -16.168 -16.373 -19.187 1.00 0.00 H new ATOM 0 HB3 SER A 108 -14.614 -15.580 -19.030 1.00 0.00 H new ATOM 0 HG SER A 108 -14.863 -16.623 -21.085 1.00 0.00 H new