USER MOD reduce.3.24.130724 H: found=0, std=0, add=61, rem=0, adj=0 USER MOD reduce.3.24.130724 removed 62 hydrogens (0 hets) ATOM 112 N ILE A 7 -3.351 1.076 -0.150 1.00 0.00 N ATOM 113 CA ILE A 7 -4.613 1.159 -0.842 1.00 0.00 C ATOM 114 C ILE A 7 -5.738 0.753 0.097 1.00 0.00 C ATOM 115 O ILE A 7 -5.815 -0.399 0.524 1.00 0.00 O ATOM 116 CB ILE A 7 -4.623 0.260 -2.093 1.00 0.00 C ATOM 117 CG1 ILE A 7 -3.949 -1.088 -1.803 1.00 0.00 C ATOM 118 CG2 ILE A 7 -3.942 0.966 -3.257 1.00 0.00 C ATOM 119 CD1 ILE A 7 -4.005 -2.063 -2.961 1.00 0.00 C ATOM 0 HA ILE A 7 -4.759 2.189 -1.166 1.00 0.00 H new ATOM 0 HB ILE A 7 -5.660 0.064 -2.367 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -2.906 -0.912 -1.539 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -4.426 -1.542 -0.935 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -3.957 0.319 -4.134 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -4.471 1.892 -3.481 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -2.910 1.193 -2.991 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -3.508 -2.991 -2.679 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -5.045 -2.270 -3.212 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -3.502 -1.630 -3.826 1.00 0.00 H new ATOM 131 N CYS A 8 -6.593 1.703 0.437 1.00 0.00 N ATOM 132 CA CYS A 8 -7.693 1.438 1.350 1.00 0.00 C ATOM 133 C CYS A 8 -8.926 2.242 0.962 1.00 0.00 C ATOM 134 O CYS A 8 -8.821 3.376 0.498 1.00 0.00 O ATOM 135 CB CYS A 8 -7.283 1.767 2.790 1.00 0.00 C ATOM 136 SG CYS A 8 -5.892 0.765 3.417 1.00 0.00 S ATOM 0 H CYS A 8 -6.547 2.663 0.095 1.00 0.00 H new ATOM 0 HA CYS A 8 -7.938 0.378 1.285 1.00 0.00 H new ATOM 0 HB2 CYS A 8 -7.012 2.821 2.847 1.00 0.00 H new ATOM 0 HB3 CYS A 8 -8.144 1.623 3.443 1.00 0.00 H new ATOM 141 N GLY A 9 -10.091 1.640 1.154 1.00 0.00 N ATOM 142 CA GLY A 9 -11.337 2.295 0.827 1.00 0.00 C ATOM 143 C GLY A 9 -12.491 1.743 1.636 1.00 0.00 C ATOM 144 O GLY A 9 -12.316 1.360 2.791 1.00 0.00 O ATOM 0 H GLY A 9 -10.193 0.699 1.535 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -11.244 3.365 1.010 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -11.545 2.170 -0.236 1.00 0.00 H new ATOM 148 N ARG A 10 -13.672 1.703 1.034 1.00 0.00 N ATOM 149 CA ARG A 10 -14.865 1.209 1.703 1.00 0.00 C ATOM 150 C ARG A 10 -14.937 -0.323 1.710 1.00 0.00 C ATOM 151 O ARG A 10 -15.967 -0.907 1.365 1.00 0.00 O ATOM 152 CB ARG A 10 -16.124 1.799 1.055 1.00 0.00 C ATOM 153 CG ARG A 10 -16.278 1.456 -0.420 1.00 0.00 C ATOM 154 CD ARG A 10 -17.648 1.862 -0.943 1.00 0.00 C ATOM 155 NE ARG A 10 -17.905 1.339 -2.289 1.00 0.00 N ATOM 156 CZ ARG A 10 -18.060 0.042 -2.577 1.00 0.00 C ATOM 157 NH1 ARG A 10 -18.008 -0.876 -1.611 1.00 0.00 N ATOM 158 NH2 ARG A 10 -18.275 -0.337 -3.833 1.00 0.00 N ATOM 0 H ARG A 10 -13.828 2.010 0.074 1.00 0.00 H new ATOM 0 HA ARG A 10 -14.809 1.534 2.742 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -17.000 1.440 1.595 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -16.103 2.883 1.165 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -15.502 1.961 -0.996 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -16.135 0.385 -0.563 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -18.417 1.499 -0.261 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -17.722 2.949 -0.957 1.00 0.00 H new ATOM 0 HE ARG A 10 -17.970 2.008 -3.056 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -17.849 -0.591 -0.645 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -18.127 -1.863 -1.839 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -18.322 0.361 -4.575 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -18.393 -1.326 -4.054 1.00 0.00 H new ATOM 172 N GLY A 11 -13.852 -0.966 2.112 1.00 0.00 N ATOM 173 CA GLY A 11 -13.835 -2.417 2.168 1.00 0.00 C ATOM 174 C GLY A 11 -12.437 -2.992 2.079 1.00 0.00 C ATOM 175 O GLY A 11 -12.009 -3.749 2.946 1.00 0.00 O ATOM 0 H GLY A 11 -12.984 -0.514 2.400 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -14.299 -2.745 3.098 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -14.439 -2.815 1.352 1.00 0.00 H new ATOM 179 N ILE A 12 -11.726 -2.629 1.026 1.00 0.00 N ATOM 180 CA ILE A 12 -10.368 -3.110 0.815 1.00 0.00 C ATOM 181 C ILE A 12 -9.366 -2.179 1.491 1.00 0.00 C ATOM 182 O ILE A 12 -9.544 -0.964 1.484 1.00 0.00 O ATOM 183 CB ILE A 12 -10.042 -3.212 -0.695 1.00 0.00 C ATOM 184 CG1 ILE A 12 -11.072 -4.097 -1.409 1.00 0.00 C ATOM 185 CG2 ILE A 12 -8.634 -3.752 -0.916 1.00 0.00 C ATOM 186 CD1 ILE A 12 -11.124 -5.521 -0.891 1.00 0.00 C ATOM 0 H ILE A 12 -12.067 -2.000 0.299 1.00 0.00 H new ATOM 0 HA ILE A 12 -10.294 -4.104 1.255 1.00 0.00 H new ATOM 0 HB ILE A 12 -10.091 -2.209 -1.118 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -12.059 -3.646 -1.303 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -10.843 -4.117 -2.474 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -8.432 -3.813 -1.985 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -7.911 -3.085 -0.447 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -8.551 -4.745 -0.474 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -11.876 -6.083 -1.446 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -10.150 -5.992 -1.022 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -11.384 -5.514 0.167 1.00 0.00 H new ATOM 198 N CYS A 13 -8.322 -2.757 2.069 1.00 0.00 N ATOM 199 CA CYS A 13 -7.291 -1.983 2.742 1.00 0.00 C ATOM 200 C CYS A 13 -6.026 -2.820 2.897 1.00 0.00 C ATOM 201 O CYS A 13 -6.029 -3.852 3.568 1.00 0.00 O ATOM 202 CB CYS A 13 -7.787 -1.515 4.115 1.00 0.00 C ATOM 203 SG CYS A 13 -6.702 -0.302 4.943 1.00 0.00 S ATOM 0 H CYS A 13 -8.167 -3.765 2.084 1.00 0.00 H new ATOM 0 HA CYS A 13 -7.062 -1.105 2.137 1.00 0.00 H new ATOM 0 HB2 CYS A 13 -8.778 -1.076 3.998 1.00 0.00 H new ATOM 0 HB3 CYS A 13 -7.898 -2.385 4.762 1.00 0.00 H new ATOM 208 N ARG A 14 -4.951 -2.380 2.255 1.00 0.00 N ATOM 209 CA ARG A 14 -3.682 -3.090 2.313 1.00 0.00 C ATOM 210 C ARG A 14 -2.510 -2.133 2.115 1.00 0.00 C ATOM 211 O ARG A 14 -2.445 -1.412 1.117 1.00 0.00 O ATOM 212 CB ARG A 14 -3.646 -4.191 1.249 1.00 0.00 C ATOM 213 CG ARG A 14 -2.375 -5.024 1.271 1.00 0.00 C ATOM 214 CD ARG A 14 -2.410 -6.119 0.217 1.00 0.00 C ATOM 215 NE ARG A 14 -3.508 -7.062 0.441 1.00 0.00 N ATOM 216 CZ ARG A 14 -3.783 -8.092 -0.360 1.00 0.00 C ATOM 217 NH1 ARG A 14 -3.040 -8.315 -1.441 1.00 0.00 N ATOM 218 NH2 ARG A 14 -4.799 -8.902 -0.078 1.00 0.00 N ATOM 0 H ARG A 14 -4.934 -1.533 1.687 1.00 0.00 H new ATOM 0 HA ARG A 14 -3.590 -3.543 3.300 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -4.503 -4.849 1.391 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -3.754 -3.736 0.265 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -1.513 -4.379 1.099 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -2.248 -5.470 2.257 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -2.515 -5.669 -0.770 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -1.463 -6.658 0.223 1.00 0.00 H new ATOM 0 HE ARG A 14 -4.099 -6.922 1.261 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -2.258 -7.697 -1.659 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -3.252 -9.104 -2.052 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -5.369 -8.736 0.752 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -5.009 -9.690 -0.691 1.00 0.00 H new