USER MOD reduce.3.24.130724 H: found=0, std=0, add=127, rem=0, adj=3 USER MOD reduce.3.24.130724 removed 128 hydrogens (3 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 THR OG1 : rot 43:sc= 0.435 USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD Single : A 133 GLN : amide:sc= 0 X(o=0,f=-0.3) USER MOD Single : A 136 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 SER OG : rot 180:sc= 0 USER MOD Single : A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- HETATM 1 C ACE A 127 -0.108 -3.479 6.125 1.00 0.00 C HETATM 2 O ACE A 127 -0.572 -2.428 6.576 1.00 0.00 O HETATM 3 CH3 ACE A 127 -0.862 -4.797 6.302 1.00 0.00 C HETATM 0 H1 ACE A 127 -1.096 -5.217 5.324 1.00 0.00 H new HETATM 0 H2 ACE A 127 -0.242 -5.499 6.859 1.00 0.00 H new HETATM 0 H3 ACE A 127 -1.787 -4.616 6.849 1.00 0.00 H new ATOM 7 N LYS A 128 1.053 -3.561 5.457 1.00 0.00 N ATOM 8 CA LYS A 128 1.923 -2.380 5.198 1.00 0.00 C ATOM 9 C LYS A 128 1.447 -1.584 3.944 1.00 0.00 C ATOM 10 O LYS A 128 1.139 -2.162 2.895 1.00 0.00 O ATOM 11 CB LYS A 128 3.418 -2.800 5.070 1.00 0.00 C ATOM 12 CG LYS A 128 3.775 -3.824 3.962 1.00 0.00 C ATOM 13 CD LYS A 128 5.289 -4.041 3.793 1.00 0.00 C ATOM 14 CE LYS A 128 5.612 -5.074 2.697 1.00 0.00 C ATOM 15 NZ LYS A 128 7.064 -5.217 2.495 1.00 0.00 N ATOM 0 H LYS A 128 1.422 -4.434 5.080 1.00 0.00 H new ATOM 0 HA LYS A 128 1.838 -1.714 6.057 1.00 0.00 H new ATOM 0 HB2 LYS A 128 4.008 -1.900 4.900 1.00 0.00 H new ATOM 0 HB3 LYS A 128 3.736 -3.214 6.027 1.00 0.00 H new ATOM 0 HG2 LYS A 128 3.303 -4.778 4.194 1.00 0.00 H new ATOM 0 HG3 LYS A 128 3.357 -3.483 3.015 1.00 0.00 H new ATOM 0 HD2 LYS A 128 5.765 -3.092 3.546 1.00 0.00 H new ATOM 0 HD3 LYS A 128 5.714 -4.374 4.740 1.00 0.00 H new ATOM 0 HE2 LYS A 128 5.186 -6.039 2.970 1.00 0.00 H new ATOM 0 HE3 LYS A 128 5.142 -4.771 1.761 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 7.243 -5.920 1.750 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 7.467 -4.301 2.211 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 7.509 -5.530 3.381 1.00 0.00 H new ATOM 28 N CYS A 129 1.406 -0.248 4.085 1.00 0.00 N ATOM 29 CA CYS A 129 1.050 0.688 2.984 1.00 0.00 C ATOM 30 C CYS A 129 2.245 1.644 2.714 1.00 0.00 C ATOM 31 O CYS A 129 2.830 1.581 1.629 1.00 0.00 O ATOM 32 CB CYS A 129 -0.282 1.412 3.294 1.00 0.00 C ATOM 33 SG CYS A 129 -1.627 0.223 3.496 1.00 0.00 S ATOM 0 H CYS A 129 1.618 0.223 4.965 1.00 0.00 H new ATOM 0 HA CYS A 129 0.872 0.140 2.059 1.00 0.00 H new ATOM 0 HB2 CYS A 129 -0.176 2.005 4.202 1.00 0.00 H new ATOM 0 HB3 CYS A 129 -0.521 2.105 2.487 1.00 0.00 H new ATOM 38 N THR A 130 2.605 2.503 3.689 1.00 0.00 N ATOM 39 CA THR A 130 3.793 3.401 3.595 1.00 0.00 C ATOM 40 C THR A 130 4.767 3.031 4.753 1.00 0.00 C ATOM 41 O THR A 130 4.692 3.593 5.851 1.00 0.00 O ATOM 42 CB THR A 130 3.401 4.914 3.605 1.00 0.00 C ATOM 43 OG1 THR A 130 2.680 5.259 4.785 1.00 0.00 O ATOM 44 CG2 THR A 130 2.547 5.344 2.403 1.00 0.00 C ATOM 0 H THR A 130 2.089 2.600 4.563 1.00 0.00 H new ATOM 0 HA THR A 130 4.290 3.249 2.637 1.00 0.00 H new ATOM 0 HB THR A 130 4.355 5.439 3.559 1.00 0.00 H new ATOM 0 HG1 THR A 130 3.103 4.837 5.562 1.00 0.00 H new ATOM 0 HG21 THR A 130 2.316 6.406 2.482 1.00 0.00 H new ATOM 0 HG22 THR A 130 3.098 5.160 1.481 1.00 0.00 H new ATOM 0 HG23 THR A 130 1.620 4.771 2.392 1.00 0.00 H new ATOM 52 N SER A 131 5.675 2.064 4.503 1.00 0.00 N ATOM 53 CA SER A 131 6.690 1.629 5.500 1.00 0.00 C ATOM 54 C SER A 131 7.854 0.967 4.706 1.00 0.00 C ATOM 55 O SER A 131 8.776 1.677 4.292 1.00 0.00 O ATOM 56 CB SER A 131 6.045 0.758 6.619 1.00 0.00 C ATOM 57 OG SER A 131 7.016 0.382 7.587 1.00 0.00 O ATOM 0 H SER A 131 5.730 1.564 3.616 1.00 0.00 H new ATOM 0 HA SER A 131 7.111 2.465 6.058 1.00 0.00 H new ATOM 0 HB2 SER A 131 5.241 1.314 7.101 1.00 0.00 H new ATOM 0 HB3 SER A 131 5.598 -0.134 6.180 1.00 0.00 H new ATOM 0 HG SER A 131 6.591 -0.163 8.282 1.00 0.00 H new ATOM 63 N ASP A 132 7.814 -0.363 4.483 1.00 0.00 N ATOM 64 CA ASP A 132 8.873 -1.107 3.738 1.00 0.00 C ATOM 65 C ASP A 132 8.658 -1.181 2.191 1.00 0.00 C ATOM 66 O ASP A 132 9.656 -1.301 1.473 1.00 0.00 O ATOM 67 CB ASP A 132 9.000 -2.543 4.319 1.00 0.00 C ATOM 68 CG ASP A 132 9.539 -2.629 5.756 1.00 0.00 C ATOM 69 OD1 ASP A 132 8.815 -2.744 6.744 1.00 0.00 O ATOM 70 OD2 ASP A 132 10.908 -2.555 5.803 1.00 0.00 O ATOM 0 H ASP A 132 7.053 -0.958 4.810 1.00 0.00 H new ATOM 0 HA ASP A 132 9.792 -0.538 3.878 1.00 0.00 H new ATOM 0 HB2 ASP A 132 8.019 -3.017 4.288 1.00 0.00 H new ATOM 0 HB3 ASP A 132 9.655 -3.123 3.668 1.00 0.00 H new ATOM 76 N GLN A 133 7.412 -1.120 1.666 1.00 0.00 N ATOM 77 CA GLN A 133 7.119 -1.159 0.213 1.00 0.00 C ATOM 78 C GLN A 133 7.279 0.272 -0.396 1.00 0.00 C ATOM 79 O GLN A 133 8.324 0.913 -0.239 1.00 0.00 O ATOM 80 CB GLN A 133 5.765 -1.930 0.028 1.00 0.00 C ATOM 81 CG GLN A 133 4.507 -1.364 0.746 1.00 0.00 C ATOM 82 CD GLN A 133 3.191 -1.988 0.252 1.00 0.00 C ATOM 83 OE1 GLN A 133 2.932 -3.176 0.441 1.00 0.00 O ATOM 84 NE2 GLN A 133 2.330 -1.206 -0.381 1.00 0.00 N ATOM 0 H GLN A 133 6.575 -1.042 2.243 1.00 0.00 H new ATOM 0 HA GLN A 133 7.831 -1.728 -0.385 1.00 0.00 H new ATOM 0 HB2 GLN A 133 5.549 -1.977 -1.039 1.00 0.00 H new ATOM 0 HB3 GLN A 133 5.913 -2.955 0.369 1.00 0.00 H new ATOM 0 HG2 GLN A 133 4.602 -1.535 1.818 1.00 0.00 H new ATOM 0 HG3 GLN A 133 4.467 -0.285 0.597 1.00 0.00 H new ATOM 0 HE21 GLN A 133 2.552 -0.222 -0.534 1.00 0.00 H new ATOM 0 HE22 GLN A 133 1.445 -1.587 -0.716 1.00 0.00 H new ATOM 93 N ASP A 134 6.259 0.735 -1.120 1.00 0.00 N ATOM 94 CA ASP A 134 6.250 2.052 -1.808 1.00 0.00 C ATOM 95 C ASP A 134 5.661 3.120 -0.844 1.00 0.00 C ATOM 96 O ASP A 134 4.452 3.163 -0.588 1.00 0.00 O ATOM 97 CB ASP A 134 5.431 1.964 -3.128 1.00 0.00 C ATOM 98 CG ASP A 134 6.130 1.194 -4.258 1.00 0.00 C ATOM 99 OD1 ASP A 134 6.895 1.723 -5.063 1.00 0.00 O ATOM 100 OD2 ASP A 134 5.802 -0.139 -4.262 1.00 0.00 O ATOM 0 H ASP A 134 5.397 0.207 -1.255 1.00 0.00 H new ATOM 0 HA ASP A 134 7.267 2.341 -2.073 1.00 0.00 H new ATOM 0 HB2 ASP A 134 4.474 1.486 -2.917 1.00 0.00 H new ATOM 0 HB3 ASP A 134 5.213 2.974 -3.474 1.00 0.00 H new ATOM 106 N GLU A 135 6.543 3.989 -0.319 1.00 0.00 N ATOM 107 CA GLU A 135 6.141 5.119 0.572 1.00 0.00 C ATOM 108 C GLU A 135 5.487 6.310 -0.199 1.00 0.00 C ATOM 109 O GLU A 135 4.510 6.875 0.302 1.00 0.00 O ATOM 110 CB GLU A 135 7.352 5.591 1.424 1.00 0.00 C ATOM 111 CG GLU A 135 7.802 4.554 2.480 1.00 0.00 C ATOM 112 CD GLU A 135 8.957 5.040 3.355 1.00 0.00 C ATOM 113 OE1 GLU A 135 10.142 4.868 3.070 1.00 0.00 O ATOM 114 OE2 GLU A 135 8.518 5.675 4.489 1.00 0.00 O ATOM 0 H GLU A 135 7.547 3.939 -0.491 1.00 0.00 H new ATOM 0 HA GLU A 135 5.367 4.738 1.238 1.00 0.00 H new ATOM 0 HB2 GLU A 135 8.189 5.811 0.761 1.00 0.00 H new ATOM 0 HB3 GLU A 135 7.092 6.522 1.928 1.00 0.00 H new ATOM 0 HG2 GLU A 135 6.954 4.304 3.117 1.00 0.00 H new ATOM 0 HG3 GLU A 135 8.101 3.637 1.973 1.00 0.00 H new ATOM 122 N GLN A 136 5.986 6.681 -1.398 1.00 0.00 N ATOM 123 CA GLN A 136 5.320 7.682 -2.285 1.00 0.00 C ATOM 124 C GLN A 136 4.002 7.219 -3.004 1.00 0.00 C ATOM 125 O GLN A 136 3.267 8.084 -3.488 1.00 0.00 O ATOM 126 CB GLN A 136 6.364 8.202 -3.316 1.00 0.00 C ATOM 127 CG GLN A 136 6.914 7.189 -4.355 1.00 0.00 C ATOM 128 CD GLN A 136 7.946 7.805 -5.312 1.00 0.00 C ATOM 129 OE1 GLN A 136 9.133 7.898 -4.998 1.00 0.00 O ATOM 130 NE2 GLN A 136 7.525 8.235 -6.493 1.00 0.00 N ATOM 0 H GLN A 136 6.852 6.304 -1.783 1.00 0.00 H new ATOM 0 HA GLN A 136 4.971 8.475 -1.623 1.00 0.00 H new ATOM 0 HB2 GLN A 136 5.913 9.031 -3.861 1.00 0.00 H new ATOM 0 HB3 GLN A 136 7.210 8.608 -2.762 1.00 0.00 H new ATOM 0 HG2 GLN A 136 7.371 6.351 -3.829 1.00 0.00 H new ATOM 0 HG3 GLN A 136 6.084 6.787 -4.936 1.00 0.00 H new ATOM 0 HE21 GLN A 136 6.540 8.154 -6.744 1.00 0.00 H new ATOM 0 HE22 GLN A 136 8.186 8.647 -7.151 1.00 0.00 H new ATOM 139 N PHE A 137 3.712 5.902 -3.089 1.00 0.00 N ATOM 140 CA PHE A 137 2.515 5.363 -3.784 1.00 0.00 C ATOM 141 C PHE A 137 1.920 4.207 -2.935 1.00 0.00 C ATOM 142 O PHE A 137 2.595 3.211 -2.665 1.00 0.00 O ATOM 143 CB PHE A 137 2.917 4.883 -5.216 1.00 0.00 C ATOM 144 CG PHE A 137 1.800 4.161 -6.004 1.00 0.00 C ATOM 145 CD1 PHE A 137 0.737 4.881 -6.561 1.00 0.00 C ATOM 146 CD2 PHE A 137 1.790 2.762 -6.075 1.00 0.00 C ATOM 147 CE1 PHE A 137 -0.317 4.211 -7.180 1.00 0.00 C ATOM 148 CE2 PHE A 137 0.736 2.095 -6.692 1.00 0.00 C ATOM 149 CZ PHE A 137 -0.317 2.820 -7.244 1.00 0.00 C ATOM 0 H PHE A 137 4.301 5.178 -2.677 1.00 0.00 H new ATOM 0 HA PHE A 137 1.753 6.135 -3.894 1.00 0.00 H new ATOM 0 HB2 PHE A 137 3.246 5.747 -5.793 1.00 0.00 H new ATOM 0 HB3 PHE A 137 3.772 4.212 -5.131 1.00 0.00 H new ATOM 0 HD1 PHE A 137 0.733 5.960 -6.511 1.00 0.00 H new ATOM 0 HD2 PHE A 137 2.606 2.197 -5.648 1.00 0.00 H new ATOM 0 HE1 PHE A 137 -1.134 4.771 -7.610 1.00 0.00 H new ATOM 0 HE2 PHE A 137 0.735 1.016 -6.743 1.00 0.00 H new ATOM 0 HZ PHE A 137 -1.135 2.302 -7.723 1.00 0.00 H new ATOM 159 N ILE A 138 0.620 4.312 -2.611 1.00 0.00 N ATOM 160 CA ILE A 138 -0.148 3.189 -1.997 1.00 0.00 C ATOM 161 C ILE A 138 -0.994 2.509 -3.134 1.00 0.00 C ATOM 162 O ILE A 138 -1.610 3.235 -3.928 1.00 0.00 O ATOM 163 CB ILE A 138 -1.023 3.610 -0.760 1.00 0.00 C ATOM 164 CG1 ILE A 138 -2.150 4.662 -1.017 1.00 0.00 C ATOM 165 CG2 ILE A 138 -0.106 4.107 0.383 1.00 0.00 C ATOM 166 CD1 ILE A 138 -3.523 4.068 -1.375 1.00 0.00 C ATOM 0 H ILE A 138 0.070 5.158 -2.760 1.00 0.00 H new ATOM 0 HA ILE A 138 0.558 2.474 -1.574 1.00 0.00 H new ATOM 0 HB ILE A 138 -1.559 2.699 -0.494 1.00 0.00 H new ATOM 0 HG12 ILE A 138 -2.259 5.280 -0.126 1.00 0.00 H new ATOM 0 HG13 ILE A 138 -1.834 5.321 -1.826 1.00 0.00 H new ATOM 0 HG21 ILE A 138 -0.716 4.398 1.238 1.00 0.00 H new ATOM 0 HG22 ILE A 138 0.574 3.308 0.677 1.00 0.00 H new ATOM 0 HG23 ILE A 138 0.470 4.966 0.040 1.00 0.00 H new ATOM 0 HD11 ILE A 138 -4.238 4.875 -1.535 1.00 0.00 H new ATOM 0 HD12 ILE A 138 -3.437 3.474 -2.285 1.00 0.00 H new ATOM 0 HD13 ILE A 138 -3.869 3.433 -0.559 1.00 0.00 H new ATOM 178 N PRO A 139 -1.090 1.152 -3.257 1.00 0.00 N ATOM 179 CA PRO A 139 -1.966 0.492 -4.263 1.00 0.00 C ATOM 180 C PRO A 139 -3.485 0.569 -3.898 1.00 0.00 C ATOM 181 O PRO A 139 -3.863 0.937 -2.779 1.00 0.00 O ATOM 182 CB PRO A 139 -1.384 -0.936 -4.298 1.00 0.00 C ATOM 183 CG PRO A 139 -0.807 -1.178 -2.903 1.00 0.00 C ATOM 184 CD PRO A 139 -0.312 0.194 -2.450 1.00 0.00 C ATOM 0 HA PRO A 139 -1.960 0.970 -5.242 1.00 0.00 H new ATOM 0 HB2 PRO A 139 -2.156 -1.668 -4.536 1.00 0.00 H new ATOM 0 HB3 PRO A 139 -0.612 -1.026 -5.063 1.00 0.00 H new ATOM 0 HG2 PRO A 139 -1.563 -1.571 -2.224 1.00 0.00 H new ATOM 0 HG3 PRO A 139 0.006 -1.904 -2.930 1.00 0.00 H new ATOM 0 HD2 PRO A 139 -0.480 0.345 -1.384 1.00 0.00 H new ATOM 0 HD3 PRO A 139 0.758 0.307 -2.623 1.00 0.00 H new ATOM 192 N LYS A 140 -4.348 0.215 -4.870 1.00 0.00 N ATOM 193 CA LYS A 140 -5.826 0.311 -4.739 1.00 0.00 C ATOM 194 C LYS A 140 -6.364 -0.744 -3.724 1.00 0.00 C ATOM 195 O LYS A 140 -6.430 -1.945 -4.009 1.00 0.00 O ATOM 196 CB LYS A 140 -6.443 0.152 -6.157 1.00 0.00 C ATOM 197 CG LYS A 140 -7.953 0.465 -6.244 1.00 0.00 C ATOM 198 CD LYS A 140 -8.513 0.323 -7.673 1.00 0.00 C ATOM 199 CE LYS A 140 -10.017 0.638 -7.756 1.00 0.00 C ATOM 200 NZ LYS A 140 -10.525 0.492 -9.131 1.00 0.00 N ATOM 0 H LYS A 140 -4.045 -0.148 -5.774 1.00 0.00 H new ATOM 0 HA LYS A 140 -6.116 1.282 -4.337 1.00 0.00 H new ATOM 0 HB2 LYS A 140 -5.910 0.808 -6.846 1.00 0.00 H new ATOM 0 HB3 LYS A 140 -6.278 -0.870 -6.498 1.00 0.00 H new ATOM 0 HG2 LYS A 140 -8.497 -0.205 -5.578 1.00 0.00 H new ATOM 0 HG3 LYS A 140 -8.130 1.480 -5.889 1.00 0.00 H new ATOM 0 HD2 LYS A 140 -7.969 0.991 -8.340 1.00 0.00 H new ATOM 0 HD3 LYS A 140 -8.339 -0.693 -8.028 1.00 0.00 H new ATOM 0 HE2 LYS A 140 -10.566 -0.029 -7.091 1.00 0.00 H new ATOM 0 HE3 LYS A 140 -10.196 1.655 -7.407 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 -11.541 0.712 -9.151 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 -10.017 1.146 -9.760 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 -10.376 -0.485 -9.454 1.00 0.00 H new ATOM 213 N GLY A 141 -6.723 -0.235 -2.539 1.00 0.00 N ATOM 214 CA GLY A 141 -7.196 -1.063 -1.401 1.00 0.00 C ATOM 215 C GLY A 141 -6.306 -1.151 -0.133 1.00 0.00 C ATOM 216 O GLY A 141 -6.747 -1.785 0.829 1.00 0.00 O ATOM 0 H GLY A 141 -6.697 0.764 -2.333 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -8.171 -0.683 -1.097 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -7.350 -2.077 -1.770 1.00 0.00 H new ATOM 220 N CYS A 142 -5.100 -0.542 -0.094 1.00 0.00 N ATOM 221 CA CYS A 142 -4.203 -0.583 1.095 1.00 0.00 C ATOM 222 C CYS A 142 -4.629 0.508 2.118 1.00 0.00 C ATOM 223 O CYS A 142 -5.280 0.177 3.114 1.00 0.00 O ATOM 224 CB CYS A 142 -2.726 -0.524 0.636 1.00 0.00 C ATOM 225 SG CYS A 142 -1.646 -1.077 1.972 1.00 0.00 S ATOM 0 H CYS A 142 -4.718 -0.011 -0.877 1.00 0.00 H new ATOM 0 HA CYS A 142 -4.299 -1.527 1.632 1.00 0.00 H new ATOM 0 HB2 CYS A 142 -2.584 -1.153 -0.243 1.00 0.00 H new ATOM 0 HB3 CYS A 142 -2.467 0.494 0.345 1.00 0.00 H new ATOM 230 N SER A 143 -4.297 1.785 1.854 1.00 0.00 N ATOM 231 CA SER A 143 -4.768 2.939 2.662 1.00 0.00 C ATOM 232 C SER A 143 -5.924 3.613 1.870 1.00 0.00 C ATOM 233 O SER A 143 -5.708 4.545 1.087 1.00 0.00 O ATOM 234 CB SER A 143 -3.568 3.872 2.943 1.00 0.00 C ATOM 235 OG SER A 143 -3.959 4.960 3.771 1.00 0.00 O ATOM 0 H SER A 143 -3.695 2.052 1.075 1.00 0.00 H new ATOM 0 HA SER A 143 -5.159 2.648 3.637 1.00 0.00 H new ATOM 0 HB2 SER A 143 -2.769 3.310 3.427 1.00 0.00 H new ATOM 0 HB3 SER A 143 -3.167 4.250 2.003 1.00 0.00 H new ATOM 0 HG SER A 143 -3.186 5.538 3.939 1.00 0.00 H new ATOM 241 N LYS A 144 -7.151 3.093 2.067 1.00 0.00 N ATOM 242 CA LYS A 144 -8.347 3.522 1.302 1.00 0.00 C ATOM 243 C LYS A 144 -9.548 3.469 2.271 1.00 0.00 C ATOM 244 O LYS A 144 -10.097 2.427 2.632 1.00 0.00 O ATOM 245 CB LYS A 144 -8.515 2.606 0.056 1.00 0.00 C ATOM 246 CG LYS A 144 -9.616 3.049 -0.932 1.00 0.00 C ATOM 247 CD LYS A 144 -9.722 2.121 -2.157 1.00 0.00 C ATOM 248 CE LYS A 144 -10.834 2.550 -3.131 1.00 0.00 C ATOM 249 NZ LYS A 144 -10.933 1.626 -4.274 1.00 0.00 N ATOM 250 OXT LYS A 144 -9.931 4.720 2.686 1.00 0.00 O ATOM 0 H LYS A 144 -7.345 2.367 2.757 1.00 0.00 H new ATOM 0 HA LYS A 144 -8.258 4.539 0.920 1.00 0.00 H new ATOM 0 HB2 LYS A 144 -7.565 2.563 -0.476 1.00 0.00 H new ATOM 0 HB3 LYS A 144 -8.736 1.594 0.394 1.00 0.00 H new ATOM 0 HG2 LYS A 144 -10.575 3.072 -0.415 1.00 0.00 H new ATOM 0 HG3 LYS A 144 -9.410 4.065 -1.268 1.00 0.00 H new ATOM 0 HD2 LYS A 144 -8.768 2.110 -2.683 1.00 0.00 H new ATOM 0 HD3 LYS A 144 -9.912 1.102 -1.821 1.00 0.00 H new ATOM 0 HE2 LYS A 144 -11.788 2.584 -2.605 1.00 0.00 H new ATOM 0 HE3 LYS A 144 -10.634 3.559 -3.493 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 -11.691 1.943 -4.912 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 -10.030 1.613 -4.789 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 -11.148 0.669 -3.929 1.00 0.00 H new TER 264 LYS A 144