USER MOD reduce.3.24.130724 H: found=0, std=0, add=621, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 624 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 NoAdj : A 143 ASNHD21 : A 143 ASN OD1 : A 163 CACA :(metal ligand) USER MOD NoAdj : A 143 ASNHD22 : A 143 ASN OD1 : A 163 CACA :(metal ligand) USER MOD Single : A 81 MET CE :methyl -172:sc= 0 (180deg=-0.0698) USER MOD Single : A 84 CYS SG : rot 180:sc= -0.0244 USER MOD Single : A 85 MET CE :methyl -115:sc= 0 (180deg=-1.81!) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0.0149 USER MOD Single : A 98 SER OG : rot -88:sc= 0.914 USER MOD Single : A 103 MET CE :methyl -161:sc= -0.0269 (180deg=-0.346) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 ASN : amide:sc= -1.1 X(o=-1.1,f=-1.4!) USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 MET CE :methyl -109:sc= -1.39 (180deg=-6.91!) USER MOD Single : A 122 GLN : amide:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 124 THR OG1 : rot -61:sc= 1.23 USER MOD Single : A 127 THR OG1 : rot 50:sc= 0.414 USER MOD Single : A 129 THR OG1 : rot 180:sc= -0.259 USER MOD Single : A 137 MET CE :methyl 154:sc= -0.975 (180deg=-2.24) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 144 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 150 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 158 LYS NZ :NH3+ 167:sc= -0.0142 (180deg=-0.227) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 81 95.286 -11.745 -1.150 1.00 0.00 N ATOM 2 CA MET A 81 94.717 -10.871 -0.092 1.00 0.00 C ATOM 3 C MET A 81 94.556 -11.632 1.222 1.00 0.00 C ATOM 4 O MET A 81 93.462 -11.701 1.782 1.00 0.00 O ATOM 5 CB MET A 81 93.362 -10.347 -0.571 1.00 0.00 C ATOM 6 CG MET A 81 93.463 -9.092 -1.423 1.00 0.00 C ATOM 7 SD MET A 81 92.111 -7.939 -1.123 1.00 0.00 S ATOM 8 CE MET A 81 90.699 -8.944 -1.572 1.00 0.00 C ATOM 0 HA MET A 81 95.397 -10.039 0.092 1.00 0.00 H new ATOM 0 HB2 MET A 81 92.862 -11.127 -1.145 1.00 0.00 H new ATOM 0 HB3 MET A 81 92.735 -10.138 0.296 1.00 0.00 H new ATOM 0 HG2 MET A 81 94.411 -8.595 -1.220 1.00 0.00 H new ATOM 0 HG3 MET A 81 93.470 -9.372 -2.476 1.00 0.00 H new ATOM 0 HE1 MET A 81 89.800 -8.327 -1.576 1.00 0.00 H new ATOM 0 HE2 MET A 81 90.854 -9.366 -2.565 1.00 0.00 H new ATOM 0 HE3 MET A 81 90.582 -9.751 -0.849 1.00 0.00 H new ATOM 20 N VAL A 82 95.655 -12.203 1.706 1.00 0.00 N ATOM 21 CA VAL A 82 95.637 -12.960 2.952 1.00 0.00 C ATOM 22 C VAL A 82 96.907 -12.720 3.761 1.00 0.00 C ATOM 23 O VAL A 82 97.999 -13.116 3.351 1.00 0.00 O ATOM 24 CB VAL A 82 95.486 -14.470 2.691 1.00 0.00 C ATOM 25 CG1 VAL A 82 94.061 -14.801 2.279 1.00 0.00 C ATOM 26 CG2 VAL A 82 96.477 -14.928 1.632 1.00 0.00 C ATOM 0 H VAL A 82 96.568 -12.156 1.254 1.00 0.00 H new ATOM 0 HA VAL A 82 94.776 -12.610 3.521 1.00 0.00 H new ATOM 0 HB VAL A 82 95.704 -15.005 3.615 1.00 0.00 H new ATOM 0 HG11 VAL A 82 93.974 -15.872 2.099 1.00 0.00 H new ATOM 0 HG12 VAL A 82 93.375 -14.510 3.075 1.00 0.00 H new ATOM 0 HG13 VAL A 82 93.810 -14.258 1.367 1.00 0.00 H new ATOM 0 HG21 VAL A 82 96.357 -15.998 1.460 1.00 0.00 H new ATOM 0 HG22 VAL A 82 96.293 -14.388 0.703 1.00 0.00 H new ATOM 0 HG23 VAL A 82 97.493 -14.727 1.973 1.00 0.00 H new ATOM 36 N ARG A 83 96.758 -12.071 4.911 1.00 0.00 N ATOM 37 CA ARG A 83 97.895 -11.782 5.777 1.00 0.00 C ATOM 38 C ARG A 83 98.920 -10.910 5.058 1.00 0.00 C ATOM 39 O ARG A 83 99.783 -11.414 4.340 1.00 0.00 O ATOM 40 CB ARG A 83 98.552 -13.082 6.244 1.00 0.00 C ATOM 41 CG ARG A 83 97.874 -13.706 7.452 1.00 0.00 C ATOM 42 CD ARG A 83 98.707 -14.836 8.035 1.00 0.00 C ATOM 43 NE ARG A 83 97.961 -15.615 9.020 1.00 0.00 N ATOM 44 CZ ARG A 83 98.354 -16.800 9.481 1.00 0.00 C ATOM 45 NH1 ARG A 83 99.484 -17.346 9.050 1.00 0.00 N ATOM 46 NH2 ARG A 83 97.614 -17.441 10.375 1.00 0.00 N ATOM 0 H ARG A 83 95.862 -11.736 5.265 1.00 0.00 H new ATOM 0 HA ARG A 83 97.527 -11.237 6.646 1.00 0.00 H new ATOM 0 HB2 ARG A 83 98.544 -13.799 5.423 1.00 0.00 H new ATOM 0 HB3 ARG A 83 99.597 -12.885 6.485 1.00 0.00 H new ATOM 0 HG2 ARG A 83 97.710 -12.943 8.213 1.00 0.00 H new ATOM 0 HG3 ARG A 83 96.894 -14.086 7.165 1.00 0.00 H new ATOM 0 HD2 ARG A 83 99.040 -15.492 7.231 1.00 0.00 H new ATOM 0 HD3 ARG A 83 99.602 -14.423 8.501 1.00 0.00 H new ATOM 0 HE ARG A 83 97.087 -15.228 9.376 1.00 0.00 H new ATOM 0 HH11 ARG A 83 100.057 -16.857 8.362 1.00 0.00 H new ATOM 0 HH12 ARG A 83 99.780 -18.254 9.407 1.00 0.00 H new ATOM 0 HH21 ARG A 83 96.744 -17.026 10.709 1.00 0.00 H new ATOM 0 HH22 ARG A 83 97.914 -18.349 10.729 1.00 0.00 H new ATOM 60 N CYS A 84 98.818 -9.599 5.258 1.00 0.00 N ATOM 61 CA CYS A 84 99.738 -8.657 4.629 1.00 0.00 C ATOM 62 C CYS A 84 100.604 -7.963 5.676 1.00 0.00 C ATOM 63 O CYS A 84 100.147 -7.670 6.780 1.00 0.00 O ATOM 64 CB CYS A 84 98.960 -7.616 3.822 1.00 0.00 C ATOM 65 SG CYS A 84 100.008 -6.466 2.900 1.00 0.00 S ATOM 0 H CYS A 84 98.109 -9.166 5.849 1.00 0.00 H new ATOM 0 HA CYS A 84 100.389 -9.215 3.957 1.00 0.00 H new ATOM 0 HB2 CYS A 84 98.301 -8.131 3.123 1.00 0.00 H new ATOM 0 HB3 CYS A 84 98.323 -7.048 4.500 1.00 0.00 H new ATOM 0 HG CYS A 84 99.261 -5.626 2.248 1.00 0.00 H new ATOM 71 N MET A 85 101.858 -7.703 5.319 1.00 0.00 N ATOM 72 CA MET A 85 102.789 -7.042 6.226 1.00 0.00 C ATOM 73 C MET A 85 104.049 -6.605 5.488 1.00 0.00 C ATOM 74 O MET A 85 104.342 -5.413 5.392 1.00 0.00 O ATOM 75 CB MET A 85 103.160 -7.976 7.380 1.00 0.00 C ATOM 76 CG MET A 85 103.637 -7.246 8.625 1.00 0.00 C ATOM 77 SD MET A 85 103.666 -8.306 10.084 1.00 0.00 S ATOM 78 CE MET A 85 105.018 -9.406 9.677 1.00 0.00 C ATOM 0 H MET A 85 102.252 -7.940 4.409 1.00 0.00 H new ATOM 0 HA MET A 85 102.298 -6.156 6.628 1.00 0.00 H new ATOM 0 HB2 MET A 85 102.293 -8.585 7.636 1.00 0.00 H new ATOM 0 HB3 MET A 85 103.942 -8.658 7.047 1.00 0.00 H new ATOM 0 HG2 MET A 85 104.637 -6.850 8.448 1.00 0.00 H new ATOM 0 HG3 MET A 85 102.985 -6.393 8.813 1.00 0.00 H new ATOM 0 HE1 MET A 85 104.638 -10.421 9.559 1.00 0.00 H new ATOM 0 HE2 MET A 85 105.483 -9.082 8.746 1.00 0.00 H new ATOM 0 HE3 MET A 85 105.757 -9.386 10.478 1.00 0.00 H new ATOM 88 N LYS A 86 104.791 -7.577 4.966 1.00 0.00 N ATOM 89 CA LYS A 86 106.021 -7.296 4.233 1.00 0.00 C ATOM 90 C LYS A 86 107.071 -6.673 5.149 1.00 0.00 C ATOM 91 O LYS A 86 107.997 -7.349 5.597 1.00 0.00 O ATOM 92 CB LYS A 86 105.736 -6.367 3.048 1.00 0.00 C ATOM 93 CG LYS A 86 105.641 -7.092 1.717 1.00 0.00 C ATOM 94 CD LYS A 86 104.261 -7.696 1.505 1.00 0.00 C ATOM 95 CE LYS A 86 104.346 -9.160 1.103 1.00 0.00 C ATOM 96 NZ LYS A 86 104.420 -10.057 2.289 1.00 0.00 N ATOM 0 H LYS A 86 104.561 -8.568 5.037 1.00 0.00 H new ATOM 0 HA LYS A 86 106.413 -8.240 3.855 1.00 0.00 H new ATOM 0 HB2 LYS A 86 104.802 -5.835 3.230 1.00 0.00 H new ATOM 0 HB3 LYS A 86 106.524 -5.616 2.988 1.00 0.00 H new ATOM 0 HG2 LYS A 86 105.863 -6.397 0.907 1.00 0.00 H new ATOM 0 HG3 LYS A 86 106.394 -7.880 1.677 1.00 0.00 H new ATOM 0 HD2 LYS A 86 103.678 -7.603 2.421 1.00 0.00 H new ATOM 0 HD3 LYS A 86 103.733 -7.136 0.733 1.00 0.00 H new ATOM 0 HE2 LYS A 86 103.475 -9.423 0.503 1.00 0.00 H new ATOM 0 HE3 LYS A 86 105.224 -9.314 0.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 104.477 -11.046 1.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 105.265 -9.823 2.849 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 103.570 -9.929 2.875 1.00 0.00 H new ATOM 110 N ASP A 87 106.920 -5.381 5.424 1.00 0.00 N ATOM 111 CA ASP A 87 107.856 -4.670 6.288 1.00 0.00 C ATOM 112 C ASP A 87 107.360 -4.654 7.731 1.00 0.00 C ATOM 113 O ASP A 87 106.582 -3.782 8.121 1.00 0.00 O ATOM 114 CB ASP A 87 108.058 -3.238 5.787 1.00 0.00 C ATOM 115 CG ASP A 87 109.424 -3.033 5.158 1.00 0.00 C ATOM 116 OD1 ASP A 87 110.393 -2.796 5.911 1.00 0.00 O ATOM 117 OD2 ASP A 87 109.522 -3.109 3.916 1.00 0.00 O ATOM 0 H ASP A 87 106.160 -4.806 5.062 1.00 0.00 H new ATOM 0 HA ASP A 87 108.811 -5.195 6.258 1.00 0.00 H new ATOM 0 HB2 ASP A 87 107.285 -2.999 5.057 1.00 0.00 H new ATOM 0 HB3 ASP A 87 107.936 -2.544 6.619 1.00 0.00 H new ATOM 122 N ASP A 88 107.816 -5.623 8.519 1.00 0.00 N ATOM 123 CA ASP A 88 107.418 -5.719 9.919 1.00 0.00 C ATOM 124 C ASP A 88 107.967 -4.543 10.720 1.00 0.00 C ATOM 125 O ASP A 88 108.563 -3.622 10.160 1.00 0.00 O ATOM 126 CB ASP A 88 107.912 -7.037 10.519 1.00 0.00 C ATOM 127 CG ASP A 88 109.424 -7.160 10.483 1.00 0.00 C ATOM 128 OD1 ASP A 88 110.059 -6.432 9.693 1.00 0.00 O ATOM 129 OD2 ASP A 88 109.970 -7.986 11.243 1.00 0.00 O ATOM 0 H ASP A 88 108.460 -6.352 8.212 1.00 0.00 H new ATOM 0 HA ASP A 88 106.329 -5.691 9.967 1.00 0.00 H new ATOM 0 HB2 ASP A 88 107.569 -7.114 11.551 1.00 0.00 H new ATOM 0 HB3 ASP A 88 107.470 -7.870 9.973 1.00 0.00 H new ATOM 134 N SER A 89 107.764 -4.579 12.033 1.00 0.00 N ATOM 135 CA SER A 89 108.241 -3.515 12.909 1.00 0.00 C ATOM 136 C SER A 89 109.761 -3.406 12.855 1.00 0.00 C ATOM 137 O SER A 89 110.315 -2.308 12.872 1.00 0.00 O ATOM 138 CB SER A 89 107.787 -3.767 14.348 1.00 0.00 C ATOM 139 OG SER A 89 106.554 -3.120 14.615 1.00 0.00 O ATOM 0 H SER A 89 107.273 -5.333 12.513 1.00 0.00 H new ATOM 0 HA SER A 89 107.815 -2.574 12.561 1.00 0.00 H new ATOM 0 HB2 SER A 89 107.683 -4.839 14.517 1.00 0.00 H new ATOM 0 HB3 SER A 89 108.548 -3.407 15.041 1.00 0.00 H new ATOM 0 HG SER A 89 106.285 -3.298 15.540 1.00 0.00 H new ATOM 145 N LYS A 90 110.429 -4.554 12.788 1.00 0.00 N ATOM 146 CA LYS A 90 111.884 -4.588 12.730 1.00 0.00 C ATOM 147 C LYS A 90 112.396 -3.893 11.472 1.00 0.00 C ATOM 148 O LYS A 90 111.659 -3.725 10.500 1.00 0.00 O ATOM 149 CB LYS A 90 112.382 -6.033 12.765 1.00 0.00 C ATOM 150 CG LYS A 90 112.029 -6.769 14.047 1.00 0.00 C ATOM 151 CD LYS A 90 111.740 -8.239 13.784 1.00 0.00 C ATOM 152 CE LYS A 90 111.729 -9.043 15.074 1.00 0.00 C ATOM 153 NZ LYS A 90 110.608 -8.641 15.971 1.00 0.00 N ATOM 0 H LYS A 90 109.985 -5.472 12.773 1.00 0.00 H new ATOM 0 HA LYS A 90 112.269 -4.056 13.600 1.00 0.00 H new ATOM 0 HB2 LYS A 90 111.960 -6.574 11.918 1.00 0.00 H new ATOM 0 HB3 LYS A 90 113.465 -6.038 12.640 1.00 0.00 H new ATOM 0 HG2 LYS A 90 112.851 -6.680 14.757 1.00 0.00 H new ATOM 0 HG3 LYS A 90 111.158 -6.303 14.508 1.00 0.00 H new ATOM 0 HD2 LYS A 90 110.777 -8.338 13.284 1.00 0.00 H new ATOM 0 HD3 LYS A 90 112.493 -8.644 13.108 1.00 0.00 H new ATOM 0 HE2 LYS A 90 111.644 -10.104 14.840 1.00 0.00 H new ATOM 0 HE3 LYS A 90 112.677 -8.907 15.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 110.636 -9.213 16.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 110.703 -7.635 16.216 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 109.702 -8.795 15.484 1.00 0.00 H new ATOM 167 N GLY A 91 113.662 -3.490 11.499 1.00 0.00 N ATOM 168 CA GLY A 91 114.251 -2.817 10.355 1.00 0.00 C ATOM 169 C GLY A 91 115.091 -3.748 9.504 1.00 0.00 C ATOM 170 O GLY A 91 115.105 -4.959 9.725 1.00 0.00 O ATOM 0 H GLY A 91 114.291 -3.617 12.292 1.00 0.00 H new ATOM 0 HA2 GLY A 91 113.458 -2.386 9.743 1.00 0.00 H new ATOM 0 HA3 GLY A 91 114.870 -1.990 10.703 1.00 0.00 H new ATOM 174 N LYS A 92 115.791 -3.182 8.525 1.00 0.00 N ATOM 175 CA LYS A 92 116.638 -3.970 7.637 1.00 0.00 C ATOM 176 C LYS A 92 118.102 -3.881 8.059 1.00 0.00 C ATOM 177 O LYS A 92 118.641 -2.790 8.242 1.00 0.00 O ATOM 178 CB LYS A 92 116.474 -3.496 6.192 1.00 0.00 C ATOM 179 CG LYS A 92 115.102 -3.788 5.607 1.00 0.00 C ATOM 180 CD LYS A 92 115.039 -3.448 4.125 1.00 0.00 C ATOM 181 CE LYS A 92 114.879 -4.697 3.271 1.00 0.00 C ATOM 182 NZ LYS A 92 113.917 -4.485 2.154 1.00 0.00 N ATOM 0 H LYS A 92 115.788 -2.181 8.327 1.00 0.00 H new ATOM 0 HA LYS A 92 116.327 -5.012 7.705 1.00 0.00 H new ATOM 0 HB2 LYS A 92 116.657 -2.422 6.148 1.00 0.00 H new ATOM 0 HB3 LYS A 92 117.233 -3.975 5.573 1.00 0.00 H new ATOM 0 HG2 LYS A 92 114.862 -4.842 5.749 1.00 0.00 H new ATOM 0 HG3 LYS A 92 114.347 -3.214 6.145 1.00 0.00 H new ATOM 0 HD2 LYS A 92 114.204 -2.771 3.941 1.00 0.00 H new ATOM 0 HD3 LYS A 92 115.947 -2.921 3.833 1.00 0.00 H new ATOM 0 HE2 LYS A 92 115.848 -4.986 2.865 1.00 0.00 H new ATOM 0 HE3 LYS A 92 114.535 -5.522 3.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 113.836 -5.359 1.596 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 112.985 -4.234 2.541 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 114.258 -3.715 1.544 1.00 0.00 H new ATOM 196 N THR A 93 118.734 -5.038 8.222 1.00 0.00 N ATOM 197 CA THR A 93 120.133 -5.099 8.637 1.00 0.00 C ATOM 198 C THR A 93 121.049 -5.403 7.453 1.00 0.00 C ATOM 199 O THR A 93 121.651 -4.498 6.874 1.00 0.00 O ATOM 200 CB THR A 93 120.315 -6.162 9.726 1.00 0.00 C ATOM 201 OG1 THR A 93 119.218 -7.058 9.742 1.00 0.00 O ATOM 202 CG2 THR A 93 120.447 -5.575 11.116 1.00 0.00 C ATOM 0 H THR A 93 118.300 -5.949 8.073 1.00 0.00 H new ATOM 0 HA THR A 93 120.408 -4.123 9.037 1.00 0.00 H new ATOM 0 HB THR A 93 121.242 -6.678 9.475 1.00 0.00 H new ATOM 0 HG1 THR A 93 119.354 -7.730 10.443 1.00 0.00 H new ATOM 0 HG21 THR A 93 120.573 -6.380 11.840 1.00 0.00 H new ATOM 0 HG22 THR A 93 121.314 -4.916 11.152 1.00 0.00 H new ATOM 0 HG23 THR A 93 119.549 -5.007 11.358 1.00 0.00 H new ATOM 210 N GLU A 94 121.156 -6.681 7.099 1.00 0.00 N ATOM 211 CA GLU A 94 122.002 -7.101 5.986 1.00 0.00 C ATOM 212 C GLU A 94 121.348 -6.769 4.649 1.00 0.00 C ATOM 213 O GLU A 94 122.031 -6.505 3.660 1.00 0.00 O ATOM 214 CB GLU A 94 122.287 -8.601 6.072 1.00 0.00 C ATOM 215 CG GLU A 94 122.828 -9.041 7.422 1.00 0.00 C ATOM 216 CD GLU A 94 122.460 -10.473 7.760 1.00 0.00 C ATOM 217 OE1 GLU A 94 121.317 -10.878 7.463 1.00 0.00 O ATOM 218 OE2 GLU A 94 123.316 -11.188 8.322 1.00 0.00 O ATOM 0 H GLU A 94 120.667 -7.444 7.567 1.00 0.00 H new ATOM 0 HA GLU A 94 122.944 -6.556 6.053 1.00 0.00 H new ATOM 0 HB2 GLU A 94 121.369 -9.149 5.862 1.00 0.00 H new ATOM 0 HB3 GLU A 94 123.004 -8.871 5.297 1.00 0.00 H new ATOM 0 HG2 GLU A 94 123.913 -8.938 7.425 1.00 0.00 H new ATOM 0 HG3 GLU A 94 122.443 -8.378 8.197 1.00 0.00 H new ATOM 225 N GLU A 95 120.020 -6.779 4.630 1.00 0.00 N ATOM 226 CA GLU A 95 119.271 -6.472 3.417 1.00 0.00 C ATOM 227 C GLU A 95 119.239 -4.965 3.161 1.00 0.00 C ATOM 228 O GLU A 95 118.872 -4.519 2.074 1.00 0.00 O ATOM 229 CB GLU A 95 117.843 -7.015 3.522 1.00 0.00 C ATOM 230 CG GLU A 95 117.380 -7.752 2.276 1.00 0.00 C ATOM 231 CD GLU A 95 115.946 -8.231 2.382 1.00 0.00 C ATOM 232 OE1 GLU A 95 115.492 -8.503 3.514 1.00 0.00 O ATOM 233 OE2 GLU A 95 115.275 -8.334 1.333 1.00 0.00 O ATOM 0 H GLU A 95 119.440 -6.996 5.440 1.00 0.00 H new ATOM 0 HA GLU A 95 119.774 -6.953 2.578 1.00 0.00 H new ATOM 0 HB2 GLU A 95 117.781 -7.689 4.377 1.00 0.00 H new ATOM 0 HB3 GLU A 95 117.162 -6.187 3.719 1.00 0.00 H new ATOM 0 HG2 GLU A 95 117.477 -7.094 1.412 1.00 0.00 H new ATOM 0 HG3 GLU A 95 118.033 -8.607 2.100 1.00 0.00 H new ATOM 240 N GLU A 96 119.626 -4.188 4.170 1.00 0.00 N ATOM 241 CA GLU A 96 119.640 -2.734 4.056 1.00 0.00 C ATOM 242 C GLU A 96 120.936 -2.245 3.408 1.00 0.00 C ATOM 243 O GLU A 96 120.972 -1.175 2.799 1.00 0.00 O ATOM 244 CB GLU A 96 119.459 -2.100 5.440 1.00 0.00 C ATOM 245 CG GLU A 96 120.750 -1.941 6.232 1.00 0.00 C ATOM 246 CD GLU A 96 121.253 -0.511 6.245 1.00 0.00 C ATOM 247 OE1 GLU A 96 120.418 0.414 6.146 1.00 0.00 O ATOM 248 OE2 GLU A 96 122.482 -0.314 6.357 1.00 0.00 O ATOM 0 H GLU A 96 119.934 -4.542 5.076 1.00 0.00 H new ATOM 0 HA GLU A 96 118.812 -2.431 3.415 1.00 0.00 H new ATOM 0 HB2 GLU A 96 118.998 -1.120 5.320 1.00 0.00 H new ATOM 0 HB3 GLU A 96 118.765 -2.710 6.018 1.00 0.00 H new ATOM 0 HG2 GLU A 96 120.587 -2.274 7.257 1.00 0.00 H new ATOM 0 HG3 GLU A 96 121.516 -2.588 5.805 1.00 0.00 H new ATOM 255 N LEU A 97 121.998 -3.032 3.549 1.00 0.00 N ATOM 256 CA LEU A 97 123.297 -2.680 2.986 1.00 0.00 C ATOM 257 C LEU A 97 123.277 -2.711 1.459 1.00 0.00 C ATOM 258 O LEU A 97 124.205 -2.224 0.812 1.00 0.00 O ATOM 259 CB LEU A 97 124.374 -3.634 3.509 1.00 0.00 C ATOM 260 CG LEU A 97 124.693 -3.495 4.998 1.00 0.00 C ATOM 261 CD1 LEU A 97 125.140 -4.830 5.573 1.00 0.00 C ATOM 262 CD2 LEU A 97 125.759 -2.434 5.217 1.00 0.00 C ATOM 0 H LEU A 97 121.984 -3.920 4.050 1.00 0.00 H new ATOM 0 HA LEU A 97 123.527 -1.662 3.299 1.00 0.00 H new ATOM 0 HB2 LEU A 97 124.056 -4.658 3.315 1.00 0.00 H new ATOM 0 HB3 LEU A 97 125.289 -3.471 2.940 1.00 0.00 H new ATOM 0 HG LEU A 97 123.787 -3.183 5.518 1.00 0.00 H new ATOM 0 HD11 LEU A 97 125.363 -4.713 6.634 1.00 0.00 H new ATOM 0 HD12 LEU A 97 124.344 -5.565 5.448 1.00 0.00 H new ATOM 0 HD13 LEU A 97 126.033 -5.171 5.050 1.00 0.00 H new ATOM 0 HD21 LEU A 97 125.974 -2.348 6.282 1.00 0.00 H new ATOM 0 HD22 LEU A 97 126.668 -2.716 4.685 1.00 0.00 H new ATOM 0 HD23 LEU A 97 125.401 -1.476 4.841 1.00 0.00 H new ATOM 274 N SER A 98 122.222 -3.281 0.883 1.00 0.00 N ATOM 275 CA SER A 98 122.100 -3.365 -0.568 1.00 0.00 C ATOM 276 C SER A 98 121.817 -1.994 -1.173 1.00 0.00 C ATOM 277 O SER A 98 122.348 -1.649 -2.230 1.00 0.00 O ATOM 278 CB SER A 98 120.991 -4.345 -0.953 1.00 0.00 C ATOM 279 OG SER A 98 119.721 -3.860 -0.554 1.00 0.00 O ATOM 0 H SER A 98 121.442 -3.690 1.397 1.00 0.00 H new ATOM 0 HA SER A 98 123.048 -3.727 -0.965 1.00 0.00 H new ATOM 0 HB2 SER A 98 121.001 -4.505 -2.031 1.00 0.00 H new ATOM 0 HB3 SER A 98 121.178 -5.312 -0.486 1.00 0.00 H new ATOM 0 HG SER A 98 119.534 -4.148 0.364 1.00 0.00 H new ATOM 285 N ASP A 99 120.976 -1.216 -0.500 1.00 0.00 N ATOM 286 CA ASP A 99 120.621 0.116 -0.973 1.00 0.00 C ATOM 287 C ASP A 99 121.756 1.104 -0.724 1.00 0.00 C ATOM 288 O ASP A 99 121.939 2.057 -1.481 1.00 0.00 O ATOM 289 CB ASP A 99 119.345 0.602 -0.283 1.00 0.00 C ATOM 290 CG ASP A 99 118.469 1.432 -1.203 1.00 0.00 C ATOM 291 OD1 ASP A 99 118.800 2.614 -1.430 1.00 0.00 O ATOM 292 OD2 ASP A 99 117.453 0.897 -1.696 1.00 0.00 O ATOM 0 H ASP A 99 120.527 -1.486 0.375 1.00 0.00 H new ATOM 0 HA ASP A 99 120.445 0.057 -2.047 1.00 0.00 H new ATOM 0 HB2 ASP A 99 118.779 -0.258 0.075 1.00 0.00 H new ATOM 0 HB3 ASP A 99 119.612 1.195 0.592 1.00 0.00 H new ATOM 297 N LEU A 100 122.514 0.870 0.343 1.00 0.00 N ATOM 298 CA LEU A 100 123.629 1.741 0.693 1.00 0.00 C ATOM 299 C LEU A 100 124.759 1.619 -0.326 1.00 0.00 C ATOM 300 O LEU A 100 125.518 2.564 -0.541 1.00 0.00 O ATOM 301 CB LEU A 100 124.147 1.402 2.093 1.00 0.00 C ATOM 302 CG LEU A 100 123.726 2.379 3.192 1.00 0.00 C ATOM 303 CD1 LEU A 100 124.010 1.791 4.566 1.00 0.00 C ATOM 304 CD2 LEU A 100 124.440 3.711 3.022 1.00 0.00 C ATOM 0 H LEU A 100 122.376 0.085 0.979 1.00 0.00 H new ATOM 0 HA LEU A 100 123.270 2.770 0.685 1.00 0.00 H new ATOM 0 HB2 LEU A 100 123.799 0.405 2.361 1.00 0.00 H new ATOM 0 HB3 LEU A 100 125.236 1.361 2.061 1.00 0.00 H new ATOM 0 HG LEU A 100 122.653 2.551 3.108 1.00 0.00 H new ATOM 0 HD11 LEU A 100 123.704 2.500 5.335 1.00 0.00 H new ATOM 0 HD12 LEU A 100 123.453 0.862 4.686 1.00 0.00 H new ATOM 0 HD13 LEU A 100 125.077 1.589 4.662 1.00 0.00 H new ATOM 0 HD21 LEU A 100 124.129 4.394 3.812 1.00 0.00 H new ATOM 0 HD22 LEU A 100 125.517 3.556 3.080 1.00 0.00 H new ATOM 0 HD23 LEU A 100 124.186 4.139 2.052 1.00 0.00 H new ATOM 316 N PHE A 101 124.865 0.450 -0.952 1.00 0.00 N ATOM 317 CA PHE A 101 125.903 0.209 -1.948 1.00 0.00 C ATOM 318 C PHE A 101 125.784 1.188 -3.110 1.00 0.00 C ATOM 319 O PHE A 101 126.730 1.909 -3.426 1.00 0.00 O ATOM 320 CB PHE A 101 125.821 -1.228 -2.465 1.00 0.00 C ATOM 321 CG PHE A 101 126.916 -1.581 -3.430 1.00 0.00 C ATOM 322 CD1 PHE A 101 128.167 -1.960 -2.969 1.00 0.00 C ATOM 323 CD2 PHE A 101 126.695 -1.530 -4.796 1.00 0.00 C ATOM 324 CE1 PHE A 101 129.177 -2.285 -3.855 1.00 0.00 C ATOM 325 CE2 PHE A 101 127.702 -1.854 -5.686 1.00 0.00 C ATOM 326 CZ PHE A 101 128.944 -2.231 -5.215 1.00 0.00 C ATOM 0 H PHE A 101 124.246 -0.343 -0.787 1.00 0.00 H new ATOM 0 HA PHE A 101 126.870 0.360 -1.469 1.00 0.00 H new ATOM 0 HB2 PHE A 101 125.859 -1.913 -1.618 1.00 0.00 H new ATOM 0 HB3 PHE A 101 124.857 -1.376 -2.952 1.00 0.00 H new ATOM 0 HD1 PHE A 101 128.355 -2.002 -1.906 1.00 0.00 H new ATOM 0 HD2 PHE A 101 125.726 -1.234 -5.170 1.00 0.00 H new ATOM 0 HE1 PHE A 101 130.147 -2.581 -3.484 1.00 0.00 H new ATOM 0 HE2 PHE A 101 127.517 -1.812 -6.749 1.00 0.00 H new ATOM 0 HZ PHE A 101 129.732 -2.483 -5.909 1.00 0.00 H new ATOM 336 N ARG A 102 124.615 1.208 -3.744 1.00 0.00 N ATOM 337 CA ARG A 102 124.373 2.100 -4.874 1.00 0.00 C ATOM 338 C ARG A 102 124.618 3.553 -4.481 1.00 0.00 C ATOM 339 O ARG A 102 125.032 4.369 -5.304 1.00 0.00 O ATOM 340 CB ARG A 102 122.943 1.930 -5.387 1.00 0.00 C ATOM 341 CG ARG A 102 122.836 1.933 -6.904 1.00 0.00 C ATOM 342 CD ARG A 102 121.755 0.980 -7.392 1.00 0.00 C ATOM 343 NE ARG A 102 122.274 0.010 -8.354 1.00 0.00 N ATOM 344 CZ ARG A 102 122.959 -1.078 -8.014 1.00 0.00 C ATOM 345 NH1 ARG A 102 123.211 -1.340 -6.737 1.00 0.00 N ATOM 346 NH2 ARG A 102 123.395 -1.908 -8.952 1.00 0.00 N ATOM 0 H ARG A 102 123.821 0.618 -3.495 1.00 0.00 H new ATOM 0 HA ARG A 102 125.069 1.836 -5.670 1.00 0.00 H new ATOM 0 HB2 ARG A 102 122.538 0.993 -5.004 1.00 0.00 H new ATOM 0 HB3 ARG A 102 122.324 2.733 -4.986 1.00 0.00 H new ATOM 0 HG2 ARG A 102 122.616 2.942 -7.252 1.00 0.00 H new ATOM 0 HG3 ARG A 102 123.795 1.649 -7.337 1.00 0.00 H new ATOM 0 HD2 ARG A 102 121.326 0.452 -6.540 1.00 0.00 H new ATOM 0 HD3 ARG A 102 120.949 1.551 -7.852 1.00 0.00 H new ATOM 0 HE ARG A 102 122.101 0.177 -9.345 1.00 0.00 H new ATOM 0 HH11 ARG A 102 122.879 -0.705 -6.011 1.00 0.00 H new ATOM 0 HH12 ARG A 102 123.737 -2.176 -6.482 1.00 0.00 H new ATOM 0 HH21 ARG A 102 123.205 -1.712 -9.935 1.00 0.00 H new ATOM 0 HH22 ARG A 102 123.920 -2.742 -8.691 1.00 0.00 H new ATOM 360 N MET A 103 124.359 3.869 -3.215 1.00 0.00 N ATOM 361 CA MET A 103 124.553 5.223 -2.711 1.00 0.00 C ATOM 362 C MET A 103 126.027 5.620 -2.755 1.00 0.00 C ATOM 363 O MET A 103 126.359 6.806 -2.756 1.00 0.00 O ATOM 364 CB MET A 103 124.026 5.335 -1.278 1.00 0.00 C ATOM 365 CG MET A 103 122.509 5.326 -1.186 1.00 0.00 C ATOM 366 SD MET A 103 121.781 6.930 -1.566 1.00 0.00 S ATOM 367 CE MET A 103 122.216 7.857 -0.098 1.00 0.00 C ATOM 0 H MET A 103 124.015 3.206 -2.521 1.00 0.00 H new ATOM 0 HA MET A 103 123.995 5.904 -3.353 1.00 0.00 H new ATOM 0 HB2 MET A 103 124.422 4.509 -0.688 1.00 0.00 H new ATOM 0 HB3 MET A 103 124.403 6.255 -0.832 1.00 0.00 H new ATOM 0 HG2 MET A 103 122.112 4.579 -1.873 1.00 0.00 H new ATOM 0 HG3 MET A 103 122.212 5.025 -0.181 1.00 0.00 H new ATOM 0 HE1 MET A 103 121.573 8.733 -0.017 1.00 0.00 H new ATOM 0 HE2 MET A 103 122.084 7.228 0.782 1.00 0.00 H new ATOM 0 HE3 MET A 103 123.256 8.175 -0.164 1.00 0.00 H new ATOM 377 N PHE A 104 126.908 4.624 -2.794 1.00 0.00 N ATOM 378 CA PHE A 104 128.343 4.876 -2.838 1.00 0.00 C ATOM 379 C PHE A 104 128.864 4.821 -4.273 1.00 0.00 C ATOM 380 O PHE A 104 129.891 5.420 -4.593 1.00 0.00 O ATOM 381 CB PHE A 104 129.089 3.855 -1.976 1.00 0.00 C ATOM 382 CG PHE A 104 129.225 4.270 -0.539 1.00 0.00 C ATOM 383 CD1 PHE A 104 128.126 4.728 0.170 1.00 0.00 C ATOM 384 CD2 PHE A 104 130.451 4.202 0.103 1.00 0.00 C ATOM 385 CE1 PHE A 104 128.248 5.111 1.493 1.00 0.00 C ATOM 386 CE2 PHE A 104 130.579 4.583 1.425 1.00 0.00 C ATOM 387 CZ PHE A 104 129.476 5.037 2.121 1.00 0.00 C ATOM 0 H PHE A 104 126.653 3.637 -2.796 1.00 0.00 H new ATOM 0 HA PHE A 104 128.521 5.876 -2.443 1.00 0.00 H new ATOM 0 HB2 PHE A 104 128.565 2.900 -2.022 1.00 0.00 H new ATOM 0 HB3 PHE A 104 130.082 3.694 -2.395 1.00 0.00 H new ATOM 0 HD1 PHE A 104 127.163 4.786 -0.316 1.00 0.00 H new ATOM 0 HD2 PHE A 104 131.317 3.847 -0.436 1.00 0.00 H new ATOM 0 HE1 PHE A 104 127.384 5.468 2.035 1.00 0.00 H new ATOM 0 HE2 PHE A 104 131.541 4.526 1.913 1.00 0.00 H new ATOM 0 HZ PHE A 104 129.573 5.334 3.155 1.00 0.00 H new ATOM 397 N ASP A 105 128.150 4.098 -5.132 1.00 0.00 N ATOM 398 CA ASP A 105 128.542 3.968 -6.533 1.00 0.00 C ATOM 399 C ASP A 105 128.135 5.202 -7.331 1.00 0.00 C ATOM 400 O ASP A 105 127.178 5.892 -6.982 1.00 0.00 O ATOM 401 CB ASP A 105 127.905 2.717 -7.144 1.00 0.00 C ATOM 402 CG ASP A 105 128.816 2.032 -8.143 1.00 0.00 C ATOM 403 OD1 ASP A 105 129.011 2.583 -9.246 1.00 0.00 O ATOM 404 OD2 ASP A 105 129.335 0.942 -7.823 1.00 0.00 O ATOM 0 H ASP A 105 127.299 3.594 -4.883 1.00 0.00 H new ATOM 0 HA ASP A 105 129.627 3.875 -6.575 1.00 0.00 H new ATOM 0 HB2 ASP A 105 127.651 2.017 -6.348 1.00 0.00 H new ATOM 0 HB3 ASP A 105 126.972 2.992 -7.636 1.00 0.00 H new ATOM 409 N LYS A 106 128.870 5.474 -8.405 1.00 0.00 N ATOM 410 CA LYS A 106 128.587 6.624 -9.257 1.00 0.00 C ATOM 411 C LYS A 106 128.164 6.175 -10.652 1.00 0.00 C ATOM 412 O LYS A 106 127.137 6.611 -11.170 1.00 0.00 O ATOM 413 CB LYS A 106 129.815 7.529 -9.353 1.00 0.00 C ATOM 414 CG LYS A 106 129.966 8.481 -8.175 1.00 0.00 C ATOM 415 CD LYS A 106 129.697 9.921 -8.582 1.00 0.00 C ATOM 416 CE LYS A 106 129.212 10.750 -7.405 1.00 0.00 C ATOM 417 NZ LYS A 106 128.471 11.964 -7.850 1.00 0.00 N ATOM 0 H LYS A 106 129.667 4.913 -8.706 1.00 0.00 H new ATOM 0 HA LYS A 106 127.766 7.183 -8.808 1.00 0.00 H new ATOM 0 HB2 LYS A 106 130.708 6.908 -9.424 1.00 0.00 H new ATOM 0 HB3 LYS A 106 129.756 8.110 -10.273 1.00 0.00 H new ATOM 0 HG2 LYS A 106 129.277 8.192 -7.382 1.00 0.00 H new ATOM 0 HG3 LYS A 106 130.974 8.400 -7.767 1.00 0.00 H new ATOM 0 HD2 LYS A 106 130.607 10.362 -8.988 1.00 0.00 H new ATOM 0 HD3 LYS A 106 128.951 9.943 -9.376 1.00 0.00 H new ATOM 0 HE2 LYS A 106 128.565 10.141 -6.773 1.00 0.00 H new ATOM 0 HE3 LYS A 106 130.065 11.048 -6.795 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 128.157 12.503 -7.018 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 129.096 12.558 -8.432 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 127.643 11.679 -8.411 1.00 0.00 H new ATOM 431 N ASN A 107 128.962 5.300 -11.252 1.00 0.00 N ATOM 432 CA ASN A 107 128.673 4.790 -12.589 1.00 0.00 C ATOM 433 C ASN A 107 127.539 3.769 -12.552 1.00 0.00 C ATOM 434 O ASN A 107 126.874 3.531 -13.561 1.00 0.00 O ATOM 435 CB ASN A 107 129.926 4.156 -13.197 1.00 0.00 C ATOM 436 CG ASN A 107 131.037 5.165 -13.411 1.00 0.00 C ATOM 437 OD1 ASN A 107 132.171 4.959 -12.977 1.00 0.00 O ATOM 438 ND2 ASN A 107 130.717 6.265 -14.083 1.00 0.00 N ATOM 0 H ASN A 107 129.815 4.928 -10.835 1.00 0.00 H new ATOM 0 HA ASN A 107 128.360 5.629 -13.210 1.00 0.00 H new ATOM 0 HB2 ASN A 107 130.282 3.361 -12.542 1.00 0.00 H new ATOM 0 HB3 ASN A 107 129.670 3.693 -14.150 1.00 0.00 H new ATOM 0 HD21 ASN A 107 131.423 6.980 -14.257 1.00 0.00 H new ATOM 0 HD22 ASN A 107 129.765 6.395 -14.425 1.00 0.00 H new ATOM 445 N ALA A 108 127.322 3.164 -11.386 1.00 0.00 N ATOM 446 CA ALA A 108 126.268 2.169 -11.223 1.00 0.00 C ATOM 447 C ALA A 108 126.566 0.916 -12.043 1.00 0.00 C ATOM 448 O ALA A 108 125.710 0.428 -12.783 1.00 0.00 O ATOM 449 CB ALA A 108 124.919 2.754 -11.616 1.00 0.00 C ATOM 0 H ALA A 108 127.863 3.347 -10.541 1.00 0.00 H new ATOM 0 HA ALA A 108 126.232 1.884 -10.172 1.00 0.00 H new ATOM 0 HB1 ALA A 108 124.144 1.998 -11.488 1.00 0.00 H new ATOM 0 HB2 ALA A 108 124.696 3.613 -10.983 1.00 0.00 H new ATOM 0 HB3 ALA A 108 124.949 3.070 -12.659 1.00 0.00 H new ATOM 455 N ASP A 109 127.783 0.403 -11.906 1.00 0.00 N ATOM 456 CA ASP A 109 128.194 -0.793 -12.631 1.00 0.00 C ATOM 457 C ASP A 109 128.142 -2.023 -11.729 1.00 0.00 C ATOM 458 O ASP A 109 127.904 -3.137 -12.196 1.00 0.00 O ATOM 459 CB ASP A 109 129.608 -0.616 -13.189 1.00 0.00 C ATOM 460 CG ASP A 109 130.581 -0.105 -12.145 1.00 0.00 C ATOM 461 OD1 ASP A 109 130.534 1.102 -11.830 1.00 0.00 O ATOM 462 OD2 ASP A 109 131.391 -0.913 -11.642 1.00 0.00 O ATOM 0 H ASP A 109 128.502 0.797 -11.299 1.00 0.00 H new ATOM 0 HA ASP A 109 127.499 -0.942 -13.458 1.00 0.00 H new ATOM 0 HB2 ASP A 109 129.964 -1.570 -13.578 1.00 0.00 H new ATOM 0 HB3 ASP A 109 129.580 0.080 -14.028 1.00 0.00 H new ATOM 467 N GLY A 110 128.364 -1.813 -10.436 1.00 0.00 N ATOM 468 CA GLY A 110 128.337 -2.913 -9.489 1.00 0.00 C ATOM 469 C GLY A 110 129.628 -3.046 -8.700 1.00 0.00 C ATOM 470 O GLY A 110 129.778 -3.973 -7.904 1.00 0.00 O ATOM 0 H GLY A 110 128.562 -0.900 -10.026 1.00 0.00 H new ATOM 0 HA2 GLY A 110 127.507 -2.769 -8.797 1.00 0.00 H new ATOM 0 HA3 GLY A 110 128.148 -3.843 -10.025 1.00 0.00 H new ATOM 474 N TYR A 111 130.560 -2.123 -8.916 1.00 0.00 N ATOM 475 CA TYR A 111 131.837 -2.148 -8.214 1.00 0.00 C ATOM 476 C TYR A 111 132.324 -0.732 -7.924 1.00 0.00 C ATOM 477 O TYR A 111 132.032 0.200 -8.673 1.00 0.00 O ATOM 478 CB TYR A 111 132.883 -2.902 -9.039 1.00 0.00 C ATOM 479 CG TYR A 111 132.398 -4.236 -9.559 1.00 0.00 C ATOM 480 CD1 TYR A 111 131.763 -4.334 -10.789 1.00 0.00 C ATOM 481 CD2 TYR A 111 132.578 -5.398 -8.819 1.00 0.00 C ATOM 482 CE1 TYR A 111 131.318 -5.552 -11.269 1.00 0.00 C ATOM 483 CE2 TYR A 111 132.138 -6.620 -9.291 1.00 0.00 C ATOM 484 CZ TYR A 111 131.509 -6.691 -10.516 1.00 0.00 C ATOM 485 OH TYR A 111 131.070 -7.906 -10.988 1.00 0.00 O ATOM 0 H TYR A 111 130.454 -1.349 -9.572 1.00 0.00 H new ATOM 0 HA TYR A 111 131.693 -2.665 -7.266 1.00 0.00 H new ATOM 0 HB2 TYR A 111 133.185 -2.281 -9.882 1.00 0.00 H new ATOM 0 HB3 TYR A 111 133.771 -3.061 -8.427 1.00 0.00 H new ATOM 0 HD1 TYR A 111 131.614 -3.444 -11.382 1.00 0.00 H new ATOM 0 HD2 TYR A 111 133.070 -5.345 -7.859 1.00 0.00 H new ATOM 0 HE1 TYR A 111 130.824 -5.611 -12.228 1.00 0.00 H new ATOM 0 HE2 TYR A 111 132.286 -7.514 -8.704 1.00 0.00 H new ATOM 0 HH TYR A 111 131.284 -8.606 -10.337 1.00 0.00 H new ATOM 495 N ILE A 112 133.070 -0.577 -6.835 1.00 0.00 N ATOM 496 CA ILE A 112 133.594 0.727 -6.451 1.00 0.00 C ATOM 497 C ILE A 112 135.096 0.663 -6.191 1.00 0.00 C ATOM 498 O ILE A 112 135.641 -0.396 -5.884 1.00 0.00 O ATOM 499 CB ILE A 112 132.887 1.274 -5.195 1.00 0.00 C ATOM 500 CG1 ILE A 112 131.368 1.200 -5.363 1.00 0.00 C ATOM 501 CG2 ILE A 112 133.325 2.704 -4.918 1.00 0.00 C ATOM 502 CD1 ILE A 112 130.617 1.190 -4.049 1.00 0.00 C ATOM 0 H ILE A 112 133.324 -1.337 -6.204 1.00 0.00 H new ATOM 0 HA ILE A 112 133.402 1.401 -7.286 1.00 0.00 H new ATOM 0 HB ILE A 112 133.170 0.657 -4.342 1.00 0.00 H new ATOM 0 HG12 ILE A 112 131.034 2.050 -5.957 1.00 0.00 H new ATOM 0 HG13 ILE A 112 131.115 0.300 -5.924 1.00 0.00 H new ATOM 0 HG21 ILE A 112 132.816 3.074 -4.028 1.00 0.00 H new ATOM 0 HG22 ILE A 112 134.403 2.730 -4.757 1.00 0.00 H new ATOM 0 HG23 ILE A 112 133.070 3.334 -5.770 1.00 0.00 H new ATOM 0 HD11 ILE A 112 129.546 1.136 -4.243 1.00 0.00 H new ATOM 0 HD12 ILE A 112 130.923 0.325 -3.461 1.00 0.00 H new ATOM 0 HD13 ILE A 112 130.840 2.102 -3.495 1.00 0.00 H new ATOM 514 N ASP A 113 135.756 1.810 -6.318 1.00 0.00 N ATOM 515 CA ASP A 113 137.196 1.894 -6.100 1.00 0.00 C ATOM 516 C ASP A 113 137.581 3.248 -5.513 1.00 0.00 C ATOM 517 O ASP A 113 136.721 4.083 -5.232 1.00 0.00 O ATOM 518 CB ASP A 113 137.946 1.663 -7.413 1.00 0.00 C ATOM 519 CG ASP A 113 137.586 2.686 -8.471 1.00 0.00 C ATOM 520 OD1 ASP A 113 136.440 3.184 -8.451 1.00 0.00 O ATOM 521 OD2 ASP A 113 138.450 2.992 -9.322 1.00 0.00 O ATOM 0 H ASP A 113 135.316 2.695 -6.571 1.00 0.00 H new ATOM 0 HA ASP A 113 137.475 1.118 -5.388 1.00 0.00 H new ATOM 0 HB2 ASP A 113 139.019 1.699 -7.227 1.00 0.00 H new ATOM 0 HB3 ASP A 113 137.721 0.664 -7.786 1.00 0.00 H new ATOM 526 N LEU A 114 138.881 3.459 -5.330 1.00 0.00 N ATOM 527 CA LEU A 114 139.382 4.711 -4.777 1.00 0.00 C ATOM 528 C LEU A 114 138.987 5.891 -5.660 1.00 0.00 C ATOM 529 O LEU A 114 138.708 6.983 -5.165 1.00 0.00 O ATOM 530 CB LEU A 114 140.906 4.651 -4.628 1.00 0.00 C ATOM 531 CG LEU A 114 141.414 4.626 -3.183 1.00 0.00 C ATOM 532 CD1 LEU A 114 142.437 3.514 -2.994 1.00 0.00 C ATOM 533 CD2 LEU A 114 142.011 5.973 -2.805 1.00 0.00 C ATOM 0 H LEU A 114 139.606 2.778 -5.557 1.00 0.00 H new ATOM 0 HA LEU A 114 138.934 4.854 -3.793 1.00 0.00 H new ATOM 0 HB2 LEU A 114 141.272 3.762 -5.141 1.00 0.00 H new ATOM 0 HB3 LEU A 114 141.340 5.513 -5.135 1.00 0.00 H new ATOM 0 HG LEU A 114 140.568 4.428 -2.524 1.00 0.00 H new ATOM 0 HD11 LEU A 114 142.786 3.512 -1.961 1.00 0.00 H new ATOM 0 HD12 LEU A 114 141.976 2.553 -3.223 1.00 0.00 H new ATOM 0 HD13 LEU A 114 143.282 3.680 -3.662 1.00 0.00 H new ATOM 0 HD21 LEU A 114 142.367 5.937 -1.775 1.00 0.00 H new ATOM 0 HD22 LEU A 114 142.845 6.201 -3.469 1.00 0.00 H new ATOM 0 HD23 LEU A 114 141.250 6.748 -2.899 1.00 0.00 H new ATOM 545 N GLU A 115 138.966 5.664 -6.969 1.00 0.00 N ATOM 546 CA GLU A 115 138.603 6.708 -7.920 1.00 0.00 C ATOM 547 C GLU A 115 137.185 7.207 -7.663 1.00 0.00 C ATOM 548 O GLU A 115 136.953 8.409 -7.539 1.00 0.00 O ATOM 549 CB GLU A 115 138.722 6.185 -9.353 1.00 0.00 C ATOM 550 CG GLU A 115 139.193 7.234 -10.346 1.00 0.00 C ATOM 551 CD GLU A 115 140.699 7.419 -10.329 1.00 0.00 C ATOM 552 OE1 GLU A 115 141.326 7.073 -9.306 1.00 0.00 O ATOM 553 OE2 GLU A 115 141.248 7.908 -11.338 1.00 0.00 O ATOM 0 H GLU A 115 139.196 4.766 -7.395 1.00 0.00 H new ATOM 0 HA GLU A 115 139.292 7.542 -7.788 1.00 0.00 H new ATOM 0 HB2 GLU A 115 139.416 5.345 -9.368 1.00 0.00 H new ATOM 0 HB3 GLU A 115 137.753 5.803 -9.673 1.00 0.00 H new ATOM 0 HG2 GLU A 115 138.877 6.947 -11.349 1.00 0.00 H new ATOM 0 HG3 GLU A 115 138.711 8.185 -10.120 1.00 0.00 H new ATOM 560 N GLU A 116 136.240 6.278 -7.593 1.00 0.00 N ATOM 561 CA GLU A 116 134.842 6.622 -7.359 1.00 0.00 C ATOM 562 C GLU A 116 134.616 7.054 -5.913 1.00 0.00 C ATOM 563 O GLU A 116 133.941 8.048 -5.648 1.00 0.00 O ATOM 564 CB GLU A 116 133.945 5.426 -7.692 1.00 0.00 C ATOM 565 CG GLU A 116 132.718 5.795 -8.508 1.00 0.00 C ATOM 566 CD GLU A 116 132.305 4.695 -9.468 1.00 0.00 C ATOM 567 OE1 GLU A 116 132.843 4.657 -10.594 1.00 0.00 O ATOM 568 OE2 GLU A 116 131.443 3.872 -9.093 1.00 0.00 O ATOM 0 H GLU A 116 136.416 5.279 -7.695 1.00 0.00 H new ATOM 0 HA GLU A 116 134.586 7.459 -8.009 1.00 0.00 H new ATOM 0 HB2 GLU A 116 134.528 4.687 -8.242 1.00 0.00 H new ATOM 0 HB3 GLU A 116 133.625 4.953 -6.764 1.00 0.00 H new ATOM 0 HG2 GLU A 116 131.890 6.014 -7.834 1.00 0.00 H new ATOM 0 HG3 GLU A 116 132.921 6.706 -9.071 1.00 0.00 H new ATOM 575 N LEU A 117 135.180 6.291 -4.982 1.00 0.00 N ATOM 576 CA LEU A 117 135.037 6.580 -3.557 1.00 0.00 C ATOM 577 C LEU A 117 135.477 8.004 -3.228 1.00 0.00 C ATOM 578 O LEU A 117 134.828 8.697 -2.443 1.00 0.00 O ATOM 579 CB LEU A 117 135.848 5.581 -2.731 1.00 0.00 C ATOM 580 CG LEU A 117 135.379 5.406 -1.287 1.00 0.00 C ATOM 581 CD1 LEU A 117 134.057 4.653 -1.242 1.00 0.00 C ATOM 582 CD2 LEU A 117 136.436 4.681 -0.467 1.00 0.00 C ATOM 0 H LEU A 117 135.742 5.465 -5.188 1.00 0.00 H new ATOM 0 HA LEU A 117 133.981 6.486 -3.304 1.00 0.00 H new ATOM 0 HB2 LEU A 117 135.816 4.611 -3.228 1.00 0.00 H new ATOM 0 HB3 LEU A 117 136.890 5.901 -2.723 1.00 0.00 H new ATOM 0 HG LEU A 117 135.226 6.394 -0.853 1.00 0.00 H new ATOM 0 HD11 LEU A 117 133.739 4.538 -0.206 1.00 0.00 H new ATOM 0 HD12 LEU A 117 133.301 5.212 -1.794 1.00 0.00 H new ATOM 0 HD13 LEU A 117 134.183 3.669 -1.694 1.00 0.00 H new ATOM 0 HD21 LEU A 117 136.085 4.565 0.558 1.00 0.00 H new ATOM 0 HD22 LEU A 117 136.622 3.698 -0.900 1.00 0.00 H new ATOM 0 HD23 LEU A 117 137.360 5.260 -0.471 1.00 0.00 H new ATOM 594 N LYS A 118 136.583 8.433 -3.824 1.00 0.00 N ATOM 595 CA LYS A 118 137.108 9.774 -3.581 1.00 0.00 C ATOM 596 C LYS A 118 136.120 10.847 -4.032 1.00 0.00 C ATOM 597 O LYS A 118 136.128 11.964 -3.514 1.00 0.00 O ATOM 598 CB LYS A 118 138.450 9.961 -4.297 1.00 0.00 C ATOM 599 CG LYS A 118 138.341 9.965 -5.814 1.00 0.00 C ATOM 600 CD LYS A 118 139.171 11.081 -6.430 1.00 0.00 C ATOM 601 CE LYS A 118 138.292 12.189 -6.987 1.00 0.00 C ATOM 602 NZ LYS A 118 138.972 12.946 -8.073 1.00 0.00 N ATOM 0 H LYS A 118 137.133 7.875 -4.477 1.00 0.00 H new ATOM 0 HA LYS A 118 137.259 9.882 -2.507 1.00 0.00 H new ATOM 0 HB2 LYS A 118 138.897 10.900 -3.972 1.00 0.00 H new ATOM 0 HB3 LYS A 118 139.128 9.163 -3.993 1.00 0.00 H new ATOM 0 HG2 LYS A 118 138.674 9.004 -6.206 1.00 0.00 H new ATOM 0 HG3 LYS A 118 137.297 10.084 -6.104 1.00 0.00 H new ATOM 0 HD2 LYS A 118 139.844 11.493 -5.678 1.00 0.00 H new ATOM 0 HD3 LYS A 118 139.794 10.675 -7.227 1.00 0.00 H new ATOM 0 HE2 LYS A 118 137.366 11.760 -7.369 1.00 0.00 H new ATOM 0 HE3 LYS A 118 138.019 12.873 -6.184 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 138.339 13.692 -8.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 139.843 13.377 -7.703 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 139.210 12.298 -8.851 1.00 0.00 H new ATOM 616 N ILE A 119 135.273 10.506 -4.998 1.00 0.00 N ATOM 617 CA ILE A 119 134.284 11.448 -5.511 1.00 0.00 C ATOM 618 C ILE A 119 133.136 11.633 -4.523 1.00 0.00 C ATOM 619 O ILE A 119 132.804 12.757 -4.148 1.00 0.00 O ATOM 620 CB ILE A 119 133.714 10.984 -6.866 1.00 0.00 C ATOM 621 CG1 ILE A 119 134.850 10.674 -7.842 1.00 0.00 C ATOM 622 CG2 ILE A 119 132.787 12.044 -7.445 1.00 0.00 C ATOM 623 CD1 ILE A 119 134.434 9.783 -8.991 1.00 0.00 C ATOM 0 H ILE A 119 135.251 9.587 -5.440 1.00 0.00 H new ATOM 0 HA ILE A 119 134.796 12.400 -5.650 1.00 0.00 H new ATOM 0 HB ILE A 119 133.137 10.073 -6.706 1.00 0.00 H new ATOM 0 HG12 ILE A 119 135.240 11.610 -8.242 1.00 0.00 H new ATOM 0 HG13 ILE A 119 135.665 10.195 -7.298 1.00 0.00 H new ATOM 0 HG21 ILE A 119 132.394 11.700 -8.402 1.00 0.00 H new ATOM 0 HG22 ILE A 119 131.961 12.221 -6.756 1.00 0.00 H new ATOM 0 HG23 ILE A 119 133.341 12.971 -7.593 1.00 0.00 H new ATOM 0 HD11 ILE A 119 135.290 9.606 -9.642 1.00 0.00 H new ATOM 0 HD12 ILE A 119 134.071 8.832 -8.601 1.00 0.00 H new ATOM 0 HD13 ILE A 119 133.640 10.268 -9.559 1.00 0.00 H new ATOM 635 N MET A 120 132.531 10.525 -4.109 1.00 0.00 N ATOM 636 CA MET A 120 131.418 10.569 -3.167 1.00 0.00 C ATOM 637 C MET A 120 131.825 11.266 -1.872 1.00 0.00 C ATOM 638 O MET A 120 131.004 11.903 -1.214 1.00 0.00 O ATOM 639 CB MET A 120 130.920 9.154 -2.864 1.00 0.00 C ATOM 640 CG MET A 120 131.995 8.240 -2.299 1.00 0.00 C ATOM 641 SD MET A 120 131.325 6.975 -1.203 1.00 0.00 S ATOM 642 CE MET A 120 131.103 7.915 0.304 1.00 0.00 C ATOM 0 H MET A 120 132.792 9.586 -4.410 1.00 0.00 H new ATOM 0 HA MET A 120 130.611 11.140 -3.626 1.00 0.00 H new ATOM 0 HB2 MET A 120 130.094 9.212 -2.155 1.00 0.00 H new ATOM 0 HB3 MET A 120 130.524 8.713 -3.779 1.00 0.00 H new ATOM 0 HG2 MET A 120 132.526 7.759 -3.120 1.00 0.00 H new ATOM 0 HG3 MET A 120 132.725 8.838 -1.754 1.00 0.00 H new ATOM 0 HE1 MET A 120 131.840 7.598 1.042 1.00 0.00 H new ATOM 0 HE2 MET A 120 131.234 8.976 0.093 1.00 0.00 H new ATOM 0 HE3 MET A 120 130.100 7.744 0.695 1.00 0.00 H new ATOM 652 N LEU A 121 133.098 11.141 -1.514 1.00 0.00 N ATOM 653 CA LEU A 121 133.614 11.759 -0.298 1.00 0.00 C ATOM 654 C LEU A 121 133.624 13.280 -0.427 1.00 0.00 C ATOM 655 O LEU A 121 133.472 13.997 0.562 1.00 0.00 O ATOM 656 CB LEU A 121 135.022 11.246 0.004 1.00 0.00 C ATOM 657 CG LEU A 121 135.101 10.177 1.096 1.00 0.00 C ATOM 658 CD1 LEU A 121 134.196 9.002 0.757 1.00 0.00 C ATOM 659 CD2 LEU A 121 136.537 9.711 1.281 1.00 0.00 C ATOM 0 H LEU A 121 133.792 10.618 -2.048 1.00 0.00 H new ATOM 0 HA LEU A 121 132.957 11.487 0.528 1.00 0.00 H new ATOM 0 HB2 LEU A 121 135.449 10.839 -0.913 1.00 0.00 H new ATOM 0 HB3 LEU A 121 135.645 12.091 0.298 1.00 0.00 H new ATOM 0 HG LEU A 121 134.758 10.614 2.034 1.00 0.00 H new ATOM 0 HD11 LEU A 121 134.264 8.251 1.544 1.00 0.00 H new ATOM 0 HD12 LEU A 121 133.166 9.348 0.674 1.00 0.00 H new ATOM 0 HD13 LEU A 121 134.509 8.564 -0.191 1.00 0.00 H new ATOM 0 HD21 LEU A 121 136.575 8.951 2.061 1.00 0.00 H new ATOM 0 HD22 LEU A 121 136.906 9.290 0.346 1.00 0.00 H new ATOM 0 HD23 LEU A 121 137.160 10.558 1.569 1.00 0.00 H new ATOM 671 N GLN A 122 133.797 13.765 -1.651 1.00 0.00 N ATOM 672 CA GLN A 122 133.817 15.201 -1.902 1.00 0.00 C ATOM 673 C GLN A 122 132.471 15.829 -1.553 1.00 0.00 C ATOM 674 O GLN A 122 132.387 17.022 -1.265 1.00 0.00 O ATOM 675 CB GLN A 122 134.162 15.482 -3.366 1.00 0.00 C ATOM 676 CG GLN A 122 135.619 15.222 -3.709 1.00 0.00 C ATOM 677 CD GLN A 122 136.038 15.879 -5.010 1.00 0.00 C ATOM 678 OE1 GLN A 122 135.898 15.296 -6.086 1.00 0.00 O ATOM 679 NE2 GLN A 122 136.557 17.097 -4.919 1.00 0.00 N ATOM 0 H GLN A 122 133.925 13.188 -2.482 1.00 0.00 H new ATOM 0 HA GLN A 122 134.583 15.646 -1.267 1.00 0.00 H new ATOM 0 HB2 GLN A 122 133.531 14.863 -4.004 1.00 0.00 H new ATOM 0 HB3 GLN A 122 133.924 16.521 -3.594 1.00 0.00 H new ATOM 0 HG2 GLN A 122 136.250 15.591 -2.900 1.00 0.00 H new ATOM 0 HG3 GLN A 122 135.786 14.147 -3.779 1.00 0.00 H new ATOM 0 HE21 GLN A 122 136.655 17.543 -4.007 1.00 0.00 H new ATOM 0 HE22 GLN A 122 136.858 17.587 -5.761 1.00 0.00 H new ATOM 688 N ALA A 123 131.420 15.013 -1.577 1.00 0.00 N ATOM 689 CA ALA A 123 130.077 15.485 -1.257 1.00 0.00 C ATOM 690 C ALA A 123 130.034 16.104 0.135 1.00 0.00 C ATOM 691 O ALA A 123 129.437 17.163 0.335 1.00 0.00 O ATOM 692 CB ALA A 123 129.077 14.344 -1.363 1.00 0.00 C ATOM 0 H ALA A 123 131.473 14.023 -1.815 1.00 0.00 H new ATOM 0 HA ALA A 123 129.806 16.256 -1.978 1.00 0.00 H new ATOM 0 HB1 ALA A 123 128.079 14.711 -1.122 1.00 0.00 H new ATOM 0 HB2 ALA A 123 129.082 13.949 -2.379 1.00 0.00 H new ATOM 0 HB3 ALA A 123 129.352 13.553 -0.665 1.00 0.00 H new ATOM 698 N THR A 124 130.673 15.441 1.093 1.00 0.00 N ATOM 699 CA THR A 124 130.709 15.935 2.466 1.00 0.00 C ATOM 700 C THR A 124 131.473 17.252 2.538 1.00 0.00 C ATOM 701 O THR A 124 131.979 17.741 1.527 1.00 0.00 O ATOM 702 CB THR A 124 131.361 14.900 3.385 1.00 0.00 C ATOM 703 OG1 THR A 124 132.729 14.731 3.059 1.00 0.00 O ATOM 704 CG2 THR A 124 130.701 13.539 3.316 1.00 0.00 C ATOM 0 H THR A 124 131.171 14.563 0.946 1.00 0.00 H new ATOM 0 HA THR A 124 129.685 16.106 2.798 1.00 0.00 H new ATOM 0 HB THR A 124 131.241 15.294 4.394 1.00 0.00 H new ATOM 0 HG1 THR A 124 132.808 14.403 2.139 1.00 0.00 H new ATOM 0 HG21 THR A 124 131.212 12.852 3.991 1.00 0.00 H new ATOM 0 HG22 THR A 124 129.655 13.627 3.610 1.00 0.00 H new ATOM 0 HG23 THR A 124 130.761 13.157 2.297 1.00 0.00 H new ATOM 712 N GLY A 125 131.561 17.824 3.735 1.00 0.00 N ATOM 713 CA GLY A 125 132.272 19.076 3.906 1.00 0.00 C ATOM 714 C GLY A 125 133.509 18.926 4.770 1.00 0.00 C ATOM 715 O GLY A 125 133.958 19.886 5.396 1.00 0.00 O ATOM 0 H GLY A 125 131.153 17.442 4.588 1.00 0.00 H new ATOM 0 HA2 GLY A 125 132.560 19.463 2.929 1.00 0.00 H new ATOM 0 HA3 GLY A 125 131.605 19.811 4.356 1.00 0.00 H new ATOM 719 N GLU A 126 134.058 17.715 4.807 1.00 0.00 N ATOM 720 CA GLU A 126 135.249 17.439 5.604 1.00 0.00 C ATOM 721 C GLU A 126 136.509 17.520 4.749 1.00 0.00 C ATOM 722 O GLU A 126 136.453 17.887 3.576 1.00 0.00 O ATOM 723 CB GLU A 126 135.145 16.057 6.251 1.00 0.00 C ATOM 724 CG GLU A 126 133.882 15.863 7.074 1.00 0.00 C ATOM 725 CD GLU A 126 134.141 15.952 8.565 1.00 0.00 C ATOM 726 OE1 GLU A 126 135.260 15.608 8.996 1.00 0.00 O ATOM 727 OE2 GLU A 126 133.221 16.367 9.304 1.00 0.00 O ATOM 0 H GLU A 126 133.697 16.910 4.295 1.00 0.00 H new ATOM 0 HA GLU A 126 135.315 18.195 6.386 1.00 0.00 H new ATOM 0 HB2 GLU A 126 135.181 15.296 5.471 1.00 0.00 H new ATOM 0 HB3 GLU A 126 136.013 15.898 6.891 1.00 0.00 H new ATOM 0 HG2 GLU A 126 133.148 16.617 6.790 1.00 0.00 H new ATOM 0 HG3 GLU A 126 133.446 14.891 6.842 1.00 0.00 H new ATOM 734 N THR A 127 137.645 17.174 5.347 1.00 0.00 N ATOM 735 CA THR A 127 138.921 17.206 4.643 1.00 0.00 C ATOM 736 C THR A 127 139.558 15.820 4.611 1.00 0.00 C ATOM 737 O THR A 127 140.157 15.380 5.592 1.00 0.00 O ATOM 738 CB THR A 127 139.873 18.197 5.317 1.00 0.00 C ATOM 739 OG1 THR A 127 139.958 17.942 6.708 1.00 0.00 O ATOM 740 CG2 THR A 127 139.456 19.641 5.140 1.00 0.00 C ATOM 0 H THR A 127 137.707 16.868 6.318 1.00 0.00 H new ATOM 0 HA THR A 127 138.735 17.527 3.618 1.00 0.00 H new ATOM 0 HB THR A 127 140.837 18.051 4.829 1.00 0.00 H new ATOM 0 HG1 THR A 127 140.136 16.990 6.856 1.00 0.00 H new ATOM 0 HG21 THR A 127 140.173 20.291 5.642 1.00 0.00 H new ATOM 0 HG22 THR A 127 139.427 19.884 4.078 1.00 0.00 H new ATOM 0 HG23 THR A 127 138.467 19.790 5.573 1.00 0.00 H new ATOM 748 N ILE A 128 139.424 15.134 3.480 1.00 0.00 N ATOM 749 CA ILE A 128 139.986 13.799 3.329 1.00 0.00 C ATOM 750 C ILE A 128 141.119 13.791 2.308 1.00 0.00 C ATOM 751 O ILE A 128 141.101 14.554 1.343 1.00 0.00 O ATOM 752 CB ILE A 128 138.914 12.781 2.891 1.00 0.00 C ATOM 753 CG1 ILE A 128 137.670 12.909 3.769 1.00 0.00 C ATOM 754 CG2 ILE A 128 139.471 11.367 2.953 1.00 0.00 C ATOM 755 CD1 ILE A 128 136.435 12.278 3.163 1.00 0.00 C ATOM 0 H ILE A 128 138.932 15.481 2.657 1.00 0.00 H new ATOM 0 HA ILE A 128 140.375 13.510 4.306 1.00 0.00 H new ATOM 0 HB ILE A 128 138.631 12.994 1.860 1.00 0.00 H new ATOM 0 HG12 ILE A 128 137.868 12.445 4.735 1.00 0.00 H new ATOM 0 HG13 ILE A 128 137.474 13.965 3.956 1.00 0.00 H new ATOM 0 HG21 ILE A 128 138.703 10.659 2.641 1.00 0.00 H new ATOM 0 HG22 ILE A 128 140.331 11.285 2.288 1.00 0.00 H new ATOM 0 HG23 ILE A 128 139.779 11.142 3.974 1.00 0.00 H new ATOM 0 HD11 ILE A 128 135.591 12.407 3.840 1.00 0.00 H new ATOM 0 HD12 ILE A 128 136.212 12.758 2.210 1.00 0.00 H new ATOM 0 HD13 ILE A 128 136.612 11.215 3.002 1.00 0.00 H new ATOM 767 N THR A 129 142.101 12.924 2.528 1.00 0.00 N ATOM 768 CA THR A 129 143.241 12.815 1.626 1.00 0.00 C ATOM 769 C THR A 129 143.235 11.469 0.906 1.00 0.00 C ATOM 770 O THR A 129 142.537 10.540 1.313 1.00 0.00 O ATOM 771 CB THR A 129 144.549 12.994 2.398 1.00 0.00 C ATOM 772 OG1 THR A 129 145.661 12.653 1.589 1.00 0.00 O ATOM 773 CG2 THR A 129 144.623 12.159 3.658 1.00 0.00 C ATOM 0 H THR A 129 142.130 12.286 3.324 1.00 0.00 H new ATOM 0 HA THR A 129 143.162 13.605 0.879 1.00 0.00 H new ATOM 0 HB THR A 129 144.574 14.047 2.680 1.00 0.00 H new ATOM 0 HG1 THR A 129 146.488 12.776 2.101 1.00 0.00 H new ATOM 0 HG21 THR A 129 145.577 12.335 4.156 1.00 0.00 H new ATOM 0 HG22 THR A 129 143.808 12.436 4.327 1.00 0.00 H new ATOM 0 HG23 THR A 129 144.537 11.103 3.400 1.00 0.00 H new ATOM 781 N GLU A 130 144.012 11.374 -0.169 1.00 0.00 N ATOM 782 CA GLU A 130 144.092 10.142 -0.946 1.00 0.00 C ATOM 783 C GLU A 130 144.606 8.987 -0.094 1.00 0.00 C ATOM 784 O GLU A 130 143.991 7.921 -0.036 1.00 0.00 O ATOM 785 CB GLU A 130 145.002 10.340 -2.161 1.00 0.00 C ATOM 786 CG GLU A 130 144.459 9.716 -3.437 1.00 0.00 C ATOM 787 CD GLU A 130 144.541 10.652 -4.626 1.00 0.00 C ATOM 788 OE1 GLU A 130 145.643 10.792 -5.196 1.00 0.00 O ATOM 789 OE2 GLU A 130 143.504 11.245 -4.987 1.00 0.00 O ATOM 0 H GLU A 130 144.594 12.134 -0.521 1.00 0.00 H new ATOM 0 HA GLU A 130 143.087 9.894 -1.287 1.00 0.00 H new ATOM 0 HB2 GLU A 130 145.150 11.408 -2.323 1.00 0.00 H new ATOM 0 HB3 GLU A 130 145.981 9.912 -1.945 1.00 0.00 H new ATOM 0 HG2 GLU A 130 145.016 8.806 -3.657 1.00 0.00 H new ATOM 0 HG3 GLU A 130 143.421 9.424 -3.281 1.00 0.00 H new ATOM 796 N ASP A 131 145.739 9.206 0.568 1.00 0.00 N ATOM 797 CA ASP A 131 146.341 8.185 1.418 1.00 0.00 C ATOM 798 C ASP A 131 145.341 7.666 2.450 1.00 0.00 C ATOM 799 O ASP A 131 145.440 6.527 2.908 1.00 0.00 O ATOM 800 CB ASP A 131 147.575 8.748 2.126 1.00 0.00 C ATOM 801 CG ASP A 131 148.866 8.360 1.431 1.00 0.00 C ATOM 802 OD1 ASP A 131 149.170 8.948 0.372 1.00 0.00 O ATOM 803 OD2 ASP A 131 149.572 7.468 1.945 1.00 0.00 O ATOM 0 H ASP A 131 146.259 10.083 0.531 1.00 0.00 H new ATOM 0 HA ASP A 131 146.639 7.351 0.782 1.00 0.00 H new ATOM 0 HB2 ASP A 131 147.501 9.835 2.170 1.00 0.00 H new ATOM 0 HB3 ASP A 131 147.597 8.388 3.155 1.00 0.00 H new ATOM 808 N ASP A 132 144.375 8.507 2.808 1.00 0.00 N ATOM 809 CA ASP A 132 143.357 8.132 3.782 1.00 0.00 C ATOM 810 C ASP A 132 142.368 7.139 3.177 1.00 0.00 C ATOM 811 O ASP A 132 142.092 6.090 3.758 1.00 0.00 O ATOM 812 CB ASP A 132 142.614 9.374 4.281 1.00 0.00 C ATOM 813 CG ASP A 132 143.026 9.765 5.687 1.00 0.00 C ATOM 814 OD1 ASP A 132 143.141 8.865 6.544 1.00 0.00 O ATOM 815 OD2 ASP A 132 143.235 10.973 5.931 1.00 0.00 O ATOM 0 H ASP A 132 144.276 9.452 2.438 1.00 0.00 H new ATOM 0 HA ASP A 132 143.854 7.654 4.626 1.00 0.00 H new ATOM 0 HB2 ASP A 132 142.806 10.206 3.604 1.00 0.00 H new ATOM 0 HB3 ASP A 132 141.541 9.186 4.258 1.00 0.00 H new ATOM 820 N ILE A 133 141.840 7.479 2.005 1.00 0.00 N ATOM 821 CA ILE A 133 140.883 6.619 1.320 1.00 0.00 C ATOM 822 C ILE A 133 141.504 5.269 0.963 1.00 0.00 C ATOM 823 O ILE A 133 140.792 4.301 0.696 1.00 0.00 O ATOM 824 CB ILE A 133 140.354 7.285 0.032 1.00 0.00 C ATOM 825 CG1 ILE A 133 139.813 8.683 0.342 1.00 0.00 C ATOM 826 CG2 ILE A 133 139.274 6.423 -0.609 1.00 0.00 C ATOM 827 CD1 ILE A 133 140.068 9.687 -0.760 1.00 0.00 C ATOM 0 H ILE A 133 142.059 8.344 1.511 1.00 0.00 H new ATOM 0 HA ILE A 133 140.053 6.460 2.009 1.00 0.00 H new ATOM 0 HB ILE A 133 141.179 7.381 -0.674 1.00 0.00 H new ATOM 0 HG12 ILE A 133 138.740 8.617 0.521 1.00 0.00 H new ATOM 0 HG13 ILE A 133 140.269 9.044 1.264 1.00 0.00 H new ATOM 0 HG21 ILE A 133 138.912 6.908 -1.516 1.00 0.00 H new ATOM 0 HG22 ILE A 133 139.689 5.447 -0.860 1.00 0.00 H new ATOM 0 HG23 ILE A 133 138.447 6.297 0.090 1.00 0.00 H new ATOM 0 HD11 ILE A 133 139.658 10.655 -0.472 1.00 0.00 H new ATOM 0 HD12 ILE A 133 141.141 9.782 -0.924 1.00 0.00 H new ATOM 0 HD13 ILE A 133 139.589 9.349 -1.679 1.00 0.00 H new ATOM 839 N GLU A 134 142.834 5.210 0.960 1.00 0.00 N ATOM 840 CA GLU A 134 143.543 3.977 0.637 1.00 0.00 C ATOM 841 C GLU A 134 143.234 2.886 1.658 1.00 0.00 C ATOM 842 O GLU A 134 142.823 1.782 1.298 1.00 0.00 O ATOM 843 CB GLU A 134 145.050 4.228 0.583 1.00 0.00 C ATOM 844 CG GLU A 134 145.514 4.875 -0.711 1.00 0.00 C ATOM 845 CD GLU A 134 146.984 4.624 -0.992 1.00 0.00 C ATOM 846 OE1 GLU A 134 147.319 3.508 -1.443 1.00 0.00 O ATOM 847 OE2 GLU A 134 147.797 5.543 -0.762 1.00 0.00 O ATOM 0 H GLU A 134 143.440 6.001 1.177 1.00 0.00 H new ATOM 0 HA GLU A 134 143.203 3.640 -0.342 1.00 0.00 H new ATOM 0 HB2 GLU A 134 145.334 4.866 1.420 1.00 0.00 H new ATOM 0 HB3 GLU A 134 145.572 3.280 0.713 1.00 0.00 H new ATOM 0 HG2 GLU A 134 144.918 4.491 -1.539 1.00 0.00 H new ATOM 0 HG3 GLU A 134 145.335 5.949 -0.661 1.00 0.00 H new ATOM 854 N GLU A 135 143.437 3.203 2.933 1.00 0.00 N ATOM 855 CA GLU A 135 143.184 2.250 4.009 1.00 0.00 C ATOM 856 C GLU A 135 141.701 1.894 4.096 1.00 0.00 C ATOM 857 O GLU A 135 141.336 0.848 4.633 1.00 0.00 O ATOM 858 CB GLU A 135 143.662 2.820 5.344 1.00 0.00 C ATOM 859 CG GLU A 135 143.121 4.209 5.643 1.00 0.00 C ATOM 860 CD GLU A 135 143.405 4.651 7.065 1.00 0.00 C ATOM 861 OE1 GLU A 135 142.991 3.937 8.002 1.00 0.00 O ATOM 862 OE2 GLU A 135 144.041 5.713 7.241 1.00 0.00 O ATOM 0 H GLU A 135 143.776 4.112 3.247 1.00 0.00 H new ATOM 0 HA GLU A 135 143.741 1.339 3.787 1.00 0.00 H new ATOM 0 HB2 GLU A 135 143.365 2.143 6.145 1.00 0.00 H new ATOM 0 HB3 GLU A 135 144.751 2.856 5.345 1.00 0.00 H new ATOM 0 HG2 GLU A 135 143.563 4.924 4.949 1.00 0.00 H new ATOM 0 HG3 GLU A 135 142.045 4.221 5.471 1.00 0.00 H new ATOM 869 N LEU A 136 140.850 2.768 3.566 1.00 0.00 N ATOM 870 CA LEU A 136 139.410 2.539 3.590 1.00 0.00 C ATOM 871 C LEU A 136 139.044 1.294 2.789 1.00 0.00 C ATOM 872 O LEU A 136 138.421 0.369 3.308 1.00 0.00 O ATOM 873 CB LEU A 136 138.669 3.759 3.036 1.00 0.00 C ATOM 874 CG LEU A 136 138.075 4.690 4.094 1.00 0.00 C ATOM 875 CD1 LEU A 136 137.560 5.968 3.453 1.00 0.00 C ATOM 876 CD2 LEU A 136 136.962 3.988 4.857 1.00 0.00 C ATOM 0 H LEU A 136 141.132 3.639 3.116 1.00 0.00 H new ATOM 0 HA LEU A 136 139.108 2.382 4.625 1.00 0.00 H new ATOM 0 HB2 LEU A 136 139.357 4.332 2.415 1.00 0.00 H new ATOM 0 HB3 LEU A 136 137.865 3.413 2.386 1.00 0.00 H new ATOM 0 HG LEU A 136 138.862 4.955 4.800 1.00 0.00 H new ATOM 0 HD11 LEU A 136 137.141 6.617 4.222 1.00 0.00 H new ATOM 0 HD12 LEU A 136 138.382 6.481 2.953 1.00 0.00 H new ATOM 0 HD13 LEU A 136 136.787 5.724 2.724 1.00 0.00 H new ATOM 0 HD21 LEU A 136 136.551 4.665 5.606 1.00 0.00 H new ATOM 0 HD22 LEU A 136 136.175 3.693 4.163 1.00 0.00 H new ATOM 0 HD23 LEU A 136 137.362 3.102 5.350 1.00 0.00 H new ATOM 888 N MET A 137 139.437 1.280 1.519 1.00 0.00 N ATOM 889 CA MET A 137 139.152 0.147 0.645 1.00 0.00 C ATOM 890 C MET A 137 140.050 -1.041 0.976 1.00 0.00 C ATOM 891 O MET A 137 139.726 -2.185 0.651 1.00 0.00 O ATOM 892 CB MET A 137 139.341 0.550 -0.820 1.00 0.00 C ATOM 893 CG MET A 137 138.543 1.781 -1.218 1.00 0.00 C ATOM 894 SD MET A 137 136.763 1.496 -1.183 1.00 0.00 S ATOM 895 CE MET A 137 136.436 1.184 -2.916 1.00 0.00 C ATOM 0 H MET A 137 139.953 2.039 1.073 1.00 0.00 H new ATOM 0 HA MET A 137 138.116 -0.151 0.806 1.00 0.00 H new ATOM 0 HB2 MET A 137 140.399 0.738 -1.003 1.00 0.00 H new ATOM 0 HB3 MET A 137 139.050 -0.284 -1.458 1.00 0.00 H new ATOM 0 HG2 MET A 137 138.789 2.602 -0.544 1.00 0.00 H new ATOM 0 HG3 MET A 137 138.838 2.092 -2.220 1.00 0.00 H new ATOM 0 HE1 MET A 137 135.545 0.563 -3.012 1.00 0.00 H new ATOM 0 HE2 MET A 137 136.276 2.131 -3.432 1.00 0.00 H new ATOM 0 HE3 MET A 137 137.287 0.668 -3.360 1.00 0.00 H new ATOM 905 N LYS A 138 141.183 -0.766 1.620 1.00 0.00 N ATOM 906 CA LYS A 138 142.134 -1.812 1.991 1.00 0.00 C ATOM 907 C LYS A 138 141.432 -3.001 2.642 1.00 0.00 C ATOM 908 O LYS A 138 141.487 -4.121 2.131 1.00 0.00 O ATOM 909 CB LYS A 138 143.193 -1.247 2.939 1.00 0.00 C ATOM 910 CG LYS A 138 144.466 -0.804 2.236 1.00 0.00 C ATOM 911 CD LYS A 138 145.624 -0.669 3.212 1.00 0.00 C ATOM 912 CE LYS A 138 146.949 -1.025 2.558 1.00 0.00 C ATOM 913 NZ LYS A 138 148.109 -0.555 3.364 1.00 0.00 N ATOM 0 H LYS A 138 141.465 0.175 1.896 1.00 0.00 H new ATOM 0 HA LYS A 138 142.615 -2.164 1.079 1.00 0.00 H new ATOM 0 HB2 LYS A 138 142.771 -0.398 3.477 1.00 0.00 H new ATOM 0 HB3 LYS A 138 143.443 -2.003 3.683 1.00 0.00 H new ATOM 0 HG2 LYS A 138 144.725 -1.525 1.461 1.00 0.00 H new ATOM 0 HG3 LYS A 138 144.295 0.151 1.739 1.00 0.00 H new ATOM 0 HD2 LYS A 138 145.666 0.353 3.589 1.00 0.00 H new ATOM 0 HD3 LYS A 138 145.455 -1.319 4.071 1.00 0.00 H new ATOM 0 HE2 LYS A 138 147.011 -2.105 2.428 1.00 0.00 H new ATOM 0 HE3 LYS A 138 146.994 -0.581 1.564 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 148.994 -0.817 2.884 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 148.064 0.479 3.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 148.081 -0.998 4.304 1.00 0.00 H new ATOM 927 N ASP A 139 140.778 -2.757 3.774 1.00 0.00 N ATOM 928 CA ASP A 139 140.074 -3.816 4.488 1.00 0.00 C ATOM 929 C ASP A 139 138.954 -4.389 3.620 1.00 0.00 C ATOM 930 O ASP A 139 138.696 -5.593 3.638 1.00 0.00 O ATOM 931 CB ASP A 139 139.531 -3.284 5.827 1.00 0.00 C ATOM 932 CG ASP A 139 138.099 -3.701 6.119 1.00 0.00 C ATOM 933 OD1 ASP A 139 137.790 -4.904 5.988 1.00 0.00 O ATOM 934 OD2 ASP A 139 137.291 -2.824 6.489 1.00 0.00 O ATOM 0 H ASP A 139 140.721 -1.839 4.215 1.00 0.00 H new ATOM 0 HA ASP A 139 140.773 -4.624 4.706 1.00 0.00 H new ATOM 0 HB2 ASP A 139 140.173 -3.636 6.634 1.00 0.00 H new ATOM 0 HB3 ASP A 139 139.589 -2.196 5.825 1.00 0.00 H new ATOM 939 N GLY A 140 138.296 -3.520 2.862 1.00 0.00 N ATOM 940 CA GLY A 140 137.215 -3.959 1.999 1.00 0.00 C ATOM 941 C GLY A 140 137.695 -4.863 0.880 1.00 0.00 C ATOM 942 O GLY A 140 136.938 -5.691 0.375 1.00 0.00 O ATOM 0 H GLY A 140 138.491 -2.519 2.829 1.00 0.00 H new ATOM 0 HA2 GLY A 140 136.471 -4.488 2.595 1.00 0.00 H new ATOM 0 HA3 GLY A 140 136.720 -3.088 1.571 1.00 0.00 H new ATOM 946 N ASP A 141 138.956 -4.701 0.491 1.00 0.00 N ATOM 947 CA ASP A 141 139.536 -5.508 -0.576 1.00 0.00 C ATOM 948 C ASP A 141 139.800 -6.933 -0.101 1.00 0.00 C ATOM 949 O ASP A 141 140.715 -7.178 0.685 1.00 0.00 O ATOM 950 CB ASP A 141 140.838 -4.874 -1.071 1.00 0.00 C ATOM 951 CG ASP A 141 141.345 -5.512 -2.349 1.00 0.00 C ATOM 952 OD1 ASP A 141 140.663 -6.416 -2.876 1.00 0.00 O ATOM 953 OD2 ASP A 141 142.428 -5.108 -2.824 1.00 0.00 O ATOM 0 H ASP A 141 139.595 -4.019 0.899 1.00 0.00 H new ATOM 0 HA ASP A 141 138.821 -5.546 -1.398 1.00 0.00 H new ATOM 0 HB2 ASP A 141 140.679 -3.809 -1.239 1.00 0.00 H new ATOM 0 HB3 ASP A 141 141.600 -4.964 -0.297 1.00 0.00 H new ATOM 958 N LYS A 142 138.992 -7.873 -0.585 1.00 0.00 N ATOM 959 CA LYS A 142 139.140 -9.275 -0.212 1.00 0.00 C ATOM 960 C LYS A 142 139.738 -10.080 -1.362 1.00 0.00 C ATOM 961 O LYS A 142 140.464 -11.050 -1.141 1.00 0.00 O ATOM 962 CB LYS A 142 137.788 -9.865 0.192 1.00 0.00 C ATOM 963 CG LYS A 142 137.176 -9.202 1.416 1.00 0.00 C ATOM 964 CD LYS A 142 138.118 -9.257 2.608 1.00 0.00 C ATOM 965 CE LYS A 142 137.356 -9.227 3.923 1.00 0.00 C ATOM 966 NZ LYS A 142 137.114 -10.597 4.457 1.00 0.00 N ATOM 0 H LYS A 142 138.229 -7.688 -1.236 1.00 0.00 H new ATOM 0 HA LYS A 142 139.818 -9.330 0.640 1.00 0.00 H new ATOM 0 HB2 LYS A 142 137.096 -9.773 -0.645 1.00 0.00 H new ATOM 0 HB3 LYS A 142 137.910 -10.930 0.389 1.00 0.00 H new ATOM 0 HG2 LYS A 142 136.937 -8.163 1.187 1.00 0.00 H new ATOM 0 HG3 LYS A 142 136.238 -9.697 1.669 1.00 0.00 H new ATOM 0 HD2 LYS A 142 138.720 -10.164 2.556 1.00 0.00 H new ATOM 0 HD3 LYS A 142 138.808 -8.414 2.567 1.00 0.00 H new ATOM 0 HE2 LYS A 142 137.918 -8.646 4.655 1.00 0.00 H new ATOM 0 HE3 LYS A 142 136.402 -8.720 3.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 136.592 -10.533 5.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 136.556 -11.144 3.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 138.025 -11.072 4.620 1.00 0.00 H new ATOM 980 N ASN A 143 139.431 -9.669 -2.588 1.00 0.00 N ATOM 981 CA ASN A 143 139.941 -10.352 -3.774 1.00 0.00 C ATOM 982 C ASN A 143 141.258 -9.732 -4.247 1.00 0.00 C ATOM 983 O ASN A 143 141.855 -10.194 -5.219 1.00 0.00 O ATOM 984 CB ASN A 143 138.908 -10.305 -4.901 1.00 0.00 C ATOM 985 CG ASN A 143 138.335 -8.916 -5.109 1.00 0.00 C ATOM 986 OD1 ASN A 143 138.670 -7.979 -4.384 1.00 0.00 O ATOM 987 ND2 ASN A 143 137.465 -8.778 -6.103 1.00 0.00 N ATOM 0 H ASN A 143 138.832 -8.868 -2.787 1.00 0.00 H new ATOM 0 HA ASN A 143 140.130 -11.391 -3.505 1.00 0.00 H new ATOM 0 HB2 ASN A 143 139.371 -10.646 -5.827 1.00 0.00 H new ATOM 0 HB3 ASN A 143 138.098 -10.998 -4.675 1.00 0.00 H new ATOM 0 HD21 ASN A 143 137.045 -7.867 -6.291 1.00 0.00 H new ATOM 0 HD22 ASN A 143 137.217 -9.583 -6.679 1.00 0.00 H new ATOM 994 N ASN A 144 141.706 -8.687 -3.553 1.00 0.00 N ATOM 995 CA ASN A 144 142.951 -8.012 -3.901 1.00 0.00 C ATOM 996 C ASN A 144 142.885 -7.415 -5.304 1.00 0.00 C ATOM 997 O ASN A 144 143.907 -7.267 -5.973 1.00 0.00 O ATOM 998 CB ASN A 144 144.128 -8.985 -3.803 1.00 0.00 C ATOM 999 CG ASN A 144 144.545 -9.247 -2.369 1.00 0.00 C ATOM 1000 OD1 ASN A 144 143.706 -9.314 -1.470 1.00 0.00 O ATOM 1001 ND2 ASN A 144 145.845 -9.394 -2.148 1.00 0.00 N ATOM 0 H ASN A 144 141.224 -8.291 -2.746 1.00 0.00 H new ATOM 0 HA ASN A 144 143.098 -7.198 -3.191 1.00 0.00 H new ATOM 0 HB2 ASN A 144 143.856 -9.928 -4.277 1.00 0.00 H new ATOM 0 HB3 ASN A 144 144.976 -8.582 -4.357 1.00 0.00 H new ATOM 0 HD21 ASN A 144 146.185 -9.570 -1.203 1.00 0.00 H new ATOM 0 HD22 ASN A 144 146.505 -9.331 -2.924 1.00 0.00 H new ATOM 1008 N ASP A 145 141.680 -7.068 -5.744 1.00 0.00 N ATOM 1009 CA ASP A 145 141.490 -6.481 -7.064 1.00 0.00 C ATOM 1010 C ASP A 145 141.594 -4.960 -7.000 1.00 0.00 C ATOM 1011 O ASP A 145 141.961 -4.309 -7.978 1.00 0.00 O ATOM 1012 CB ASP A 145 140.133 -6.891 -7.641 1.00 0.00 C ATOM 1013 CG ASP A 145 138.969 -6.363 -6.824 1.00 0.00 C ATOM 1014 OD1 ASP A 145 139.198 -5.932 -5.674 1.00 0.00 O ATOM 1015 OD2 ASP A 145 137.829 -6.381 -7.333 1.00 0.00 O ATOM 0 H ASP A 145 140.821 -7.183 -5.206 1.00 0.00 H new ATOM 0 HA ASP A 145 142.278 -6.854 -7.718 1.00 0.00 H new ATOM 0 HB2 ASP A 145 140.051 -6.523 -8.664 1.00 0.00 H new ATOM 0 HB3 ASP A 145 140.076 -7.978 -7.688 1.00 0.00 H new ATOM 1020 N GLY A 146 141.268 -4.400 -5.837 1.00 0.00 N ATOM 1021 CA GLY A 146 141.329 -2.962 -5.662 1.00 0.00 C ATOM 1022 C GLY A 146 139.976 -2.299 -5.823 1.00 0.00 C ATOM 1023 O GLY A 146 139.892 -1.136 -6.219 1.00 0.00 O ATOM 0 H GLY A 146 140.963 -4.919 -5.014 1.00 0.00 H new ATOM 0 HA2 GLY A 146 141.725 -2.736 -4.672 1.00 0.00 H new ATOM 0 HA3 GLY A 146 142.025 -2.540 -6.387 1.00 0.00 H new ATOM 1027 N ARG A 147 138.915 -3.037 -5.517 1.00 0.00 N ATOM 1028 CA ARG A 147 137.559 -2.514 -5.630 1.00 0.00 C ATOM 1029 C ARG A 147 136.645 -3.132 -4.578 1.00 0.00 C ATOM 1030 O ARG A 147 137.090 -3.912 -3.737 1.00 0.00 O ATOM 1031 CB ARG A 147 137.002 -2.782 -7.030 1.00 0.00 C ATOM 1032 CG ARG A 147 137.971 -2.438 -8.149 1.00 0.00 C ATOM 1033 CD ARG A 147 137.378 -2.750 -9.513 1.00 0.00 C ATOM 1034 NE ARG A 147 138.076 -2.048 -10.587 1.00 0.00 N ATOM 1035 CZ ARG A 147 137.609 -1.939 -11.829 1.00 0.00 C ATOM 1036 NH1 ARG A 147 136.443 -2.484 -12.156 1.00 0.00 N ATOM 1037 NH2 ARG A 147 138.308 -1.283 -12.745 1.00 0.00 N ATOM 0 H ARG A 147 138.968 -4.001 -5.188 1.00 0.00 H new ATOM 0 HA ARG A 147 137.597 -1.438 -5.461 1.00 0.00 H new ATOM 0 HB2 ARG A 147 136.730 -3.835 -7.108 1.00 0.00 H new ATOM 0 HB3 ARG A 147 136.087 -2.205 -7.164 1.00 0.00 H new ATOM 0 HG2 ARG A 147 138.229 -1.380 -8.096 1.00 0.00 H new ATOM 0 HG3 ARG A 147 138.896 -2.999 -8.016 1.00 0.00 H new ATOM 0 HD2 ARG A 147 137.425 -3.824 -9.692 1.00 0.00 H new ATOM 0 HD3 ARG A 147 136.324 -2.471 -9.523 1.00 0.00 H new ATOM 0 HE ARG A 147 138.975 -1.616 -10.373 1.00 0.00 H new ATOM 0 HH11 ARG A 147 135.901 -2.989 -11.454 1.00 0.00 H new ATOM 0 HH12 ARG A 147 136.089 -2.398 -13.109 1.00 0.00 H new ATOM 0 HH21 ARG A 147 139.204 -0.862 -12.498 1.00 0.00 H new ATOM 0 HH22 ARG A 147 137.950 -1.200 -13.697 1.00 0.00 H new ATOM 1051 N ILE A 148 135.365 -2.781 -4.634 1.00 0.00 N ATOM 1052 CA ILE A 148 134.386 -3.302 -3.687 1.00 0.00 C ATOM 1053 C ILE A 148 133.032 -3.509 -4.359 1.00 0.00 C ATOM 1054 O ILE A 148 132.619 -2.716 -5.203 1.00 0.00 O ATOM 1055 CB ILE A 148 134.213 -2.359 -2.479 1.00 0.00 C ATOM 1056 CG1 ILE A 148 135.572 -2.060 -1.839 1.00 0.00 C ATOM 1057 CG2 ILE A 148 133.262 -2.967 -1.456 1.00 0.00 C ATOM 1058 CD1 ILE A 148 136.223 -3.271 -1.206 1.00 0.00 C ATOM 0 H ILE A 148 134.981 -2.137 -5.326 1.00 0.00 H new ATOM 0 HA ILE A 148 134.764 -4.261 -3.334 1.00 0.00 H new ATOM 0 HB ILE A 148 133.782 -1.422 -2.831 1.00 0.00 H new ATOM 0 HG12 ILE A 148 136.240 -1.654 -2.598 1.00 0.00 H new ATOM 0 HG13 ILE A 148 135.445 -1.288 -1.080 1.00 0.00 H new ATOM 0 HG21 ILE A 148 133.153 -2.287 -0.611 1.00 0.00 H new ATOM 0 HG22 ILE A 148 132.288 -3.132 -1.917 1.00 0.00 H new ATOM 0 HG23 ILE A 148 133.663 -3.918 -1.106 1.00 0.00 H new ATOM 0 HD11 ILE A 148 137.181 -2.984 -0.773 1.00 0.00 H new ATOM 0 HD12 ILE A 148 135.575 -3.665 -0.423 1.00 0.00 H new ATOM 0 HD13 ILE A 148 136.382 -4.037 -1.965 1.00 0.00 H new ATOM 1070 N ASP A 149 132.346 -4.582 -3.976 1.00 0.00 N ATOM 1071 CA ASP A 149 131.038 -4.893 -4.539 1.00 0.00 C ATOM 1072 C ASP A 149 130.051 -5.277 -3.440 1.00 0.00 C ATOM 1073 O ASP A 149 130.374 -5.218 -2.254 1.00 0.00 O ATOM 1074 CB ASP A 149 131.156 -6.030 -5.558 1.00 0.00 C ATOM 1075 CG ASP A 149 131.789 -7.273 -4.968 1.00 0.00 C ATOM 1076 OD1 ASP A 149 131.615 -7.509 -3.754 1.00 0.00 O ATOM 1077 OD2 ASP A 149 132.459 -8.012 -5.719 1.00 0.00 O ATOM 0 H ASP A 149 132.675 -5.250 -3.279 1.00 0.00 H new ATOM 0 HA ASP A 149 130.664 -4.002 -5.042 1.00 0.00 H new ATOM 0 HB2 ASP A 149 130.165 -6.277 -5.939 1.00 0.00 H new ATOM 0 HB3 ASP A 149 131.749 -5.692 -6.408 1.00 0.00 H new ATOM 1082 N TYR A 150 128.846 -5.668 -3.843 1.00 0.00 N ATOM 1083 CA TYR A 150 127.810 -6.059 -2.893 1.00 0.00 C ATOM 1084 C TYR A 150 128.279 -7.210 -2.006 1.00 0.00 C ATOM 1085 O TYR A 150 127.778 -7.390 -0.895 1.00 0.00 O ATOM 1086 CB TYR A 150 126.534 -6.461 -3.638 1.00 0.00 C ATOM 1087 CG TYR A 150 125.404 -6.878 -2.724 1.00 0.00 C ATOM 1088 CD1 TYR A 150 124.800 -5.964 -1.870 1.00 0.00 C ATOM 1089 CD2 TYR A 150 124.938 -8.188 -2.717 1.00 0.00 C ATOM 1090 CE1 TYR A 150 123.767 -6.341 -1.035 1.00 0.00 C ATOM 1091 CE2 TYR A 150 123.905 -8.573 -1.885 1.00 0.00 C ATOM 1092 CZ TYR A 150 123.322 -7.646 -1.046 1.00 0.00 C ATOM 1093 OH TYR A 150 122.293 -8.027 -0.215 1.00 0.00 O ATOM 0 H TYR A 150 128.563 -5.723 -4.821 1.00 0.00 H new ATOM 0 HA TYR A 150 127.599 -5.201 -2.255 1.00 0.00 H new ATOM 0 HB2 TYR A 150 126.203 -5.624 -4.252 1.00 0.00 H new ATOM 0 HB3 TYR A 150 126.763 -7.283 -4.316 1.00 0.00 H new ATOM 0 HD1 TYR A 150 125.144 -4.940 -1.859 1.00 0.00 H new ATOM 0 HD2 TYR A 150 125.391 -8.916 -3.373 1.00 0.00 H new ATOM 0 HE1 TYR A 150 123.310 -5.617 -0.377 1.00 0.00 H new ATOM 0 HE2 TYR A 150 123.555 -9.595 -1.891 1.00 0.00 H new ATOM 0 HH TYR A 150 122.101 -8.979 -0.347 1.00 0.00 H new ATOM 1103 N ASP A 151 129.240 -7.985 -2.499 1.00 0.00 N ATOM 1104 CA ASP A 151 129.769 -9.115 -1.743 1.00 0.00 C ATOM 1105 C ASP A 151 130.803 -8.650 -0.723 1.00 0.00 C ATOM 1106 O ASP A 151 130.781 -9.066 0.434 1.00 0.00 O ATOM 1107 CB ASP A 151 130.393 -10.143 -2.689 1.00 0.00 C ATOM 1108 CG ASP A 151 129.353 -10.874 -3.517 1.00 0.00 C ATOM 1109 OD1 ASP A 151 128.473 -11.528 -2.920 1.00 0.00 O ATOM 1110 OD2 ASP A 151 129.419 -10.789 -4.760 1.00 0.00 O ATOM 0 H ASP A 151 129.667 -7.852 -3.416 1.00 0.00 H new ATOM 0 HA ASP A 151 128.942 -9.581 -1.208 1.00 0.00 H new ATOM 0 HB2 ASP A 151 131.096 -9.641 -3.354 1.00 0.00 H new ATOM 0 HB3 ASP A 151 130.965 -10.867 -2.108 1.00 0.00 H new ATOM 1115 N GLU A 152 131.712 -7.783 -1.163 1.00 0.00 N ATOM 1116 CA GLU A 152 132.756 -7.262 -0.290 1.00 0.00 C ATOM 1117 C GLU A 152 132.178 -6.293 0.738 1.00 0.00 C ATOM 1118 O GLU A 152 132.714 -6.148 1.837 1.00 0.00 O ATOM 1119 CB GLU A 152 133.837 -6.560 -1.114 1.00 0.00 C ATOM 1120 CG GLU A 152 134.339 -7.384 -2.288 1.00 0.00 C ATOM 1121 CD GLU A 152 135.466 -8.323 -1.902 1.00 0.00 C ATOM 1122 OE1 GLU A 152 136.591 -7.835 -1.668 1.00 0.00 O ATOM 1123 OE2 GLU A 152 135.222 -9.547 -1.835 1.00 0.00 O ATOM 0 H GLU A 152 131.745 -7.428 -2.119 1.00 0.00 H new ATOM 0 HA GLU A 152 133.200 -8.104 0.241 1.00 0.00 H new ATOM 0 HB2 GLU A 152 133.441 -5.615 -1.487 1.00 0.00 H new ATOM 0 HB3 GLU A 152 134.678 -6.319 -0.464 1.00 0.00 H new ATOM 0 HG2 GLU A 152 133.513 -7.964 -2.700 1.00 0.00 H new ATOM 0 HG3 GLU A 152 134.683 -6.714 -3.076 1.00 0.00 H new ATOM 1130 N PHE A 153 131.083 -5.631 0.376 1.00 0.00 N ATOM 1131 CA PHE A 153 130.438 -4.678 1.271 1.00 0.00 C ATOM 1132 C PHE A 153 129.726 -5.397 2.412 1.00 0.00 C ATOM 1133 O PHE A 153 129.744 -4.941 3.555 1.00 0.00 O ATOM 1134 CB PHE A 153 129.442 -3.811 0.498 1.00 0.00 C ATOM 1135 CG PHE A 153 128.833 -2.712 1.325 1.00 0.00 C ATOM 1136 CD1 PHE A 153 129.610 -1.980 2.209 1.00 0.00 C ATOM 1137 CD2 PHE A 153 127.484 -2.414 1.218 1.00 0.00 C ATOM 1138 CE1 PHE A 153 129.051 -0.970 2.968 1.00 0.00 C ATOM 1139 CE2 PHE A 153 126.921 -1.405 1.975 1.00 0.00 C ATOM 1140 CZ PHE A 153 127.705 -0.682 2.852 1.00 0.00 C ATOM 0 H PHE A 153 130.625 -5.737 -0.529 1.00 0.00 H new ATOM 0 HA PHE A 153 131.212 -4.038 1.696 1.00 0.00 H new ATOM 0 HB2 PHE A 153 129.947 -3.370 -0.362 1.00 0.00 H new ATOM 0 HB3 PHE A 153 128.646 -4.446 0.109 1.00 0.00 H new ATOM 0 HD1 PHE A 153 130.663 -2.201 2.305 1.00 0.00 H new ATOM 0 HD2 PHE A 153 126.866 -2.977 0.535 1.00 0.00 H new ATOM 0 HE1 PHE A 153 129.667 -0.405 3.652 1.00 0.00 H new ATOM 0 HE2 PHE A 153 125.869 -1.182 1.881 1.00 0.00 H new ATOM 0 HZ PHE A 153 127.267 0.107 3.446 1.00 0.00 H new ATOM 1150 N LEU A 154 129.099 -6.525 2.094 1.00 0.00 N ATOM 1151 CA LEU A 154 128.380 -7.308 3.093 1.00 0.00 C ATOM 1152 C LEU A 154 129.312 -7.740 4.222 1.00 0.00 C ATOM 1153 O LEU A 154 128.883 -7.911 5.363 1.00 0.00 O ATOM 1154 CB LEU A 154 127.739 -8.537 2.441 1.00 0.00 C ATOM 1155 CG LEU A 154 126.219 -8.467 2.281 1.00 0.00 C ATOM 1156 CD1 LEU A 154 125.537 -8.532 3.637 1.00 0.00 C ATOM 1157 CD2 LEU A 154 125.821 -7.198 1.540 1.00 0.00 C ATOM 0 H LEU A 154 129.074 -6.917 1.153 1.00 0.00 H new ATOM 0 HA LEU A 154 127.596 -6.680 3.517 1.00 0.00 H new ATOM 0 HB2 LEU A 154 128.186 -8.682 1.458 1.00 0.00 H new ATOM 0 HB3 LEU A 154 127.986 -9.416 3.037 1.00 0.00 H new ATOM 0 HG LEU A 154 125.893 -9.325 1.693 1.00 0.00 H new ATOM 0 HD11 LEU A 154 124.456 -8.481 3.504 1.00 0.00 H new ATOM 0 HD12 LEU A 154 125.798 -9.468 4.131 1.00 0.00 H new ATOM 0 HD13 LEU A 154 125.867 -7.694 4.251 1.00 0.00 H new ATOM 0 HD21 LEU A 154 124.737 -7.163 1.434 1.00 0.00 H new ATOM 0 HD22 LEU A 154 126.159 -6.327 2.102 1.00 0.00 H new ATOM 0 HD23 LEU A 154 126.282 -7.194 0.552 1.00 0.00 H new ATOM 1169 N GLU A 155 130.589 -7.914 3.895 1.00 0.00 N ATOM 1170 CA GLU A 155 131.580 -8.327 4.881 1.00 0.00 C ATOM 1171 C GLU A 155 132.193 -7.116 5.578 1.00 0.00 C ATOM 1172 O GLU A 155 132.543 -7.178 6.756 1.00 0.00 O ATOM 1173 CB GLU A 155 132.680 -9.156 4.214 1.00 0.00 C ATOM 1174 CG GLU A 155 132.185 -10.472 3.638 1.00 0.00 C ATOM 1175 CD GLU A 155 133.276 -11.240 2.919 1.00 0.00 C ATOM 1176 OE1 GLU A 155 133.730 -10.770 1.854 1.00 0.00 O ATOM 1177 OE2 GLU A 155 133.677 -12.312 3.419 1.00 0.00 O ATOM 0 H GLU A 155 130.961 -7.775 2.955 1.00 0.00 H new ATOM 0 HA GLU A 155 131.077 -8.939 5.630 1.00 0.00 H new ATOM 0 HB2 GLU A 155 133.134 -8.568 3.416 1.00 0.00 H new ATOM 0 HB3 GLU A 155 133.463 -9.360 4.944 1.00 0.00 H new ATOM 0 HG2 GLU A 155 131.782 -11.088 4.442 1.00 0.00 H new ATOM 0 HG3 GLU A 155 131.366 -10.276 2.945 1.00 0.00 H new ATOM 1184 N PHE A 156 132.320 -6.016 4.841 1.00 0.00 N ATOM 1185 CA PHE A 156 132.893 -4.792 5.389 1.00 0.00 C ATOM 1186 C PHE A 156 132.083 -4.302 6.585 1.00 0.00 C ATOM 1187 O PHE A 156 132.644 -3.853 7.585 1.00 0.00 O ATOM 1188 CB PHE A 156 132.949 -3.704 4.315 1.00 0.00 C ATOM 1189 CG PHE A 156 134.093 -2.746 4.489 1.00 0.00 C ATOM 1190 CD1 PHE A 156 134.231 -2.011 5.655 1.00 0.00 C ATOM 1191 CD2 PHE A 156 135.034 -2.583 3.485 1.00 0.00 C ATOM 1192 CE1 PHE A 156 135.285 -1.133 5.817 1.00 0.00 C ATOM 1193 CE2 PHE A 156 136.090 -1.705 3.641 1.00 0.00 C ATOM 1194 CZ PHE A 156 136.215 -0.979 4.808 1.00 0.00 C ATOM 0 H PHE A 156 132.034 -5.948 3.864 1.00 0.00 H new ATOM 0 HA PHE A 156 133.906 -5.013 5.724 1.00 0.00 H new ATOM 0 HB2 PHE A 156 133.027 -4.176 3.335 1.00 0.00 H new ATOM 0 HB3 PHE A 156 132.013 -3.145 4.326 1.00 0.00 H new ATOM 0 HD1 PHE A 156 133.506 -2.126 6.447 1.00 0.00 H new ATOM 0 HD2 PHE A 156 134.941 -3.149 2.570 1.00 0.00 H new ATOM 0 HE1 PHE A 156 135.382 -0.567 6.732 1.00 0.00 H new ATOM 0 HE2 PHE A 156 136.816 -1.587 2.851 1.00 0.00 H new ATOM 0 HZ PHE A 156 137.039 -0.292 4.932 1.00 0.00 H new ATOM 1204 N MET A 157 130.763 -4.396 6.478 1.00 0.00 N ATOM 1205 CA MET A 157 129.877 -3.964 7.553 1.00 0.00 C ATOM 1206 C MET A 157 129.548 -5.124 8.495 1.00 0.00 C ATOM 1207 O MET A 157 128.635 -5.027 9.315 1.00 0.00 O ATOM 1208 CB MET A 157 128.587 -3.376 6.975 1.00 0.00 C ATOM 1209 CG MET A 157 128.292 -1.965 7.459 1.00 0.00 C ATOM 1210 SD MET A 157 128.505 -0.724 6.168 1.00 0.00 S ATOM 1211 CE MET A 157 129.436 0.525 7.050 1.00 0.00 C ATOM 0 H MET A 157 130.282 -4.767 5.658 1.00 0.00 H new ATOM 0 HA MET A 157 130.394 -3.194 8.126 1.00 0.00 H new ATOM 0 HB2 MET A 157 128.655 -3.371 5.887 1.00 0.00 H new ATOM 0 HB3 MET A 157 127.752 -4.024 7.239 1.00 0.00 H new ATOM 0 HG2 MET A 157 127.269 -1.921 7.834 1.00 0.00 H new ATOM 0 HG3 MET A 157 128.949 -1.728 8.296 1.00 0.00 H new ATOM 0 HE1 MET A 157 129.646 1.361 6.383 1.00 0.00 H new ATOM 0 HE2 MET A 157 128.855 0.878 7.902 1.00 0.00 H new ATOM 0 HE3 MET A 157 130.375 0.098 7.403 1.00 0.00 H new ATOM 1221 N LYS A 158 130.294 -6.221 8.370 1.00 0.00 N ATOM 1222 CA LYS A 158 130.073 -7.394 9.208 1.00 0.00 C ATOM 1223 C LYS A 158 130.946 -7.352 10.460 1.00 0.00 C ATOM 1224 O LYS A 158 131.425 -8.386 10.929 1.00 0.00 O ATOM 1225 CB LYS A 158 130.368 -8.670 8.414 1.00 0.00 C ATOM 1226 CG LYS A 158 129.462 -9.835 8.777 1.00 0.00 C ATOM 1227 CD LYS A 158 129.175 -10.712 7.568 1.00 0.00 C ATOM 1228 CE LYS A 158 130.444 -11.358 7.034 1.00 0.00 C ATOM 1229 NZ LYS A 158 131.088 -12.238 8.049 1.00 0.00 N ATOM 0 H LYS A 158 131.054 -6.320 7.697 1.00 0.00 H new ATOM 0 HA LYS A 158 129.028 -7.392 9.519 1.00 0.00 H new ATOM 0 HB2 LYS A 158 130.265 -8.458 7.350 1.00 0.00 H new ATOM 0 HB3 LYS A 158 131.405 -8.961 8.582 1.00 0.00 H new ATOM 0 HG2 LYS A 158 129.931 -10.433 9.559 1.00 0.00 H new ATOM 0 HG3 LYS A 158 128.525 -9.456 9.184 1.00 0.00 H new ATOM 0 HD2 LYS A 158 128.458 -11.487 7.841 1.00 0.00 H new ATOM 0 HD3 LYS A 158 128.713 -10.112 6.784 1.00 0.00 H new ATOM 0 HE2 LYS A 158 130.208 -11.942 6.145 1.00 0.00 H new ATOM 0 HE3 LYS A 158 131.146 -10.582 6.729 1.00 0.00 H new ATOM 0 HZ1 LYS A 158 131.813 -12.825 7.589 1.00 0.00 H new ATOM 0 HZ2 LYS A 158 131.532 -11.652 8.785 1.00 0.00 H new ATOM 0 HZ3 LYS A 158 130.369 -12.852 8.482 1.00 0.00 H new ATOM 1243 N GLY A 159 131.147 -6.155 11.001 1.00 0.00 N ATOM 1244 CA GLY A 159 131.959 -6.008 12.195 1.00 0.00 C ATOM 1245 C GLY A 159 133.375 -5.565 11.887 1.00 0.00 C ATOM 1246 O GLY A 159 134.299 -6.379 11.877 1.00 0.00 O ATOM 0 H GLY A 159 130.762 -5.284 10.634 1.00 0.00 H new ATOM 0 HA2 GLY A 159 131.492 -5.282 12.860 1.00 0.00 H new ATOM 0 HA3 GLY A 159 131.988 -6.958 12.729 1.00 0.00 H new ATOM 1250 N VAL A 160 133.547 -4.271 11.636 1.00 0.00 N ATOM 1251 CA VAL A 160 134.861 -3.720 11.329 1.00 0.00 C ATOM 1252 C VAL A 160 135.331 -2.776 12.431 1.00 0.00 C ATOM 1253 O VAL A 160 136.062 -1.820 12.172 1.00 0.00 O ATOM 1254 CB VAL A 160 134.856 -2.960 9.987 1.00 0.00 C ATOM 1255 CG1 VAL A 160 135.078 -3.920 8.829 1.00 0.00 C ATOM 1256 CG2 VAL A 160 133.558 -2.186 9.809 1.00 0.00 C ATOM 0 H VAL A 160 132.792 -3.585 11.639 1.00 0.00 H new ATOM 0 HA VAL A 160 135.547 -4.564 11.257 1.00 0.00 H new ATOM 0 HB VAL A 160 135.676 -2.242 9.997 1.00 0.00 H new ATOM 0 HG11 VAL A 160 135.071 -3.366 7.890 1.00 0.00 H new ATOM 0 HG12 VAL A 160 136.040 -4.419 8.949 1.00 0.00 H new ATOM 0 HG13 VAL A 160 134.282 -4.665 8.816 1.00 0.00 H new ATOM 0 HG21 VAL A 160 133.577 -1.658 8.856 1.00 0.00 H new ATOM 0 HG22 VAL A 160 132.716 -2.879 9.823 1.00 0.00 H new ATOM 0 HG23 VAL A 160 133.449 -1.466 10.620 1.00 0.00 H new ATOM 1266 N GLU A 161 134.908 -3.052 13.660 1.00 0.00 N ATOM 1267 CA GLU A 161 135.285 -2.228 14.802 1.00 0.00 C ATOM 1268 C GLU A 161 136.665 -2.618 15.322 1.00 0.00 C ATOM 1269 O GLU A 161 137.311 -1.847 16.033 1.00 0.00 O ATOM 1270 CB GLU A 161 134.248 -2.362 15.920 1.00 0.00 C ATOM 1271 CG GLU A 161 132.874 -1.837 15.541 1.00 0.00 C ATOM 1272 CD GLU A 161 131.998 -1.572 16.750 1.00 0.00 C ATOM 1273 OE1 GLU A 161 132.389 -0.742 17.597 1.00 0.00 O ATOM 1274 OE2 GLU A 161 130.921 -2.196 16.849 1.00 0.00 O ATOM 0 H GLU A 161 134.304 -3.841 13.891 1.00 0.00 H new ATOM 0 HA GLU A 161 135.321 -1.189 14.473 1.00 0.00 H new ATOM 0 HB2 GLU A 161 134.162 -3.412 16.200 1.00 0.00 H new ATOM 0 HB3 GLU A 161 134.603 -1.825 16.800 1.00 0.00 H new ATOM 0 HG2 GLU A 161 132.986 -0.916 14.969 1.00 0.00 H new ATOM 0 HG3 GLU A 161 132.380 -2.558 14.890 1.00 0.00 H new TER 1281 GLU A 161 HETATM 1282 CA CA A 162 131.998 2.283 -11.518 1.00 0.00 CA HETATM 1283 CA CA A 163 136.317 -7.427 -3.602 1.00 0.00 CA