USER MOD reduce.3.24.130724 H: found=0, std=0, add=78, rem=0, adj=0 USER MOD reduce.3.24.130724 removed 79 hydrogens (0 hets) ATOM 29 N GLY A 3 -12.055 -0.405 -2.498 1.00 0.00 N ATOM 30 CA GLY A 3 -11.714 -1.773 -2.846 1.00 0.00 C ATOM 31 C GLY A 3 -10.213 -1.994 -2.779 1.00 0.00 C ATOM 32 O GLY A 3 -9.565 -1.830 -1.748 1.00 0.00 O ATOM 0 HA2 GLY A 3 -12.217 -2.461 -2.167 1.00 0.00 H new ATOM 0 HA3 GLY A 3 -12.074 -1.997 -3.850 1.00 0.00 H new ATOM 36 N ILE A 4 -9.652 -2.279 -3.955 1.00 0.00 N ATOM 37 CA ILE A 4 -8.240 -2.607 -4.138 1.00 0.00 C ATOM 38 C ILE A 4 -7.354 -1.468 -3.623 1.00 0.00 C ATOM 39 O ILE A 4 -6.301 -1.725 -3.048 1.00 0.00 O ATOM 40 CB ILE A 4 -7.955 -2.949 -5.621 1.00 0.00 C ATOM 41 CG1 ILE A 4 -8.882 -4.054 -6.187 1.00 0.00 C ATOM 42 CG2 ILE A 4 -6.483 -3.345 -5.836 1.00 0.00 C ATOM 43 CD1 ILE A 4 -8.878 -5.381 -5.413 1.00 0.00 C ATOM 0 H ILE A 4 -10.181 -2.288 -4.827 1.00 0.00 H new ATOM 0 HA ILE A 4 -7.998 -3.492 -3.550 1.00 0.00 H new ATOM 0 HB ILE A 4 -8.167 -2.034 -6.174 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -9.902 -3.671 -6.211 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -8.592 -4.254 -7.218 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -6.319 -3.578 -6.888 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -5.837 -2.517 -5.543 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -6.249 -4.220 -5.230 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -9.559 -6.084 -5.892 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -7.871 -5.797 -5.410 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -9.201 -5.205 -4.387 1.00 0.00 H new ATOM 55 N GLY A 5 -7.807 -0.215 -3.745 1.00 0.00 N ATOM 56 CA GLY A 5 -7.045 0.948 -3.306 1.00 0.00 C ATOM 57 C GLY A 5 -6.899 0.989 -1.786 1.00 0.00 C ATOM 58 O GLY A 5 -5.880 1.455 -1.276 1.00 0.00 O ATOM 0 H GLY A 5 -8.713 0.016 -4.152 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -6.057 0.930 -3.766 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -7.539 1.857 -3.648 1.00 0.00 H new ATOM 62 N ALA A 6 -7.905 0.486 -1.058 1.00 0.00 N ATOM 63 CA ALA A 6 -7.838 0.358 0.387 1.00 0.00 C ATOM 64 C ALA A 6 -6.811 -0.708 0.778 1.00 0.00 C ATOM 65 O ALA A 6 -6.114 -0.539 1.772 1.00 0.00 O ATOM 66 CB ALA A 6 -9.233 0.046 0.931 1.00 0.00 C ATOM 0 H ALA A 6 -8.783 0.160 -1.462 1.00 0.00 H new ATOM 0 HA ALA A 6 -7.506 1.297 0.831 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -9.187 -0.051 2.016 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -9.915 0.854 0.667 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -9.592 -0.888 0.498 1.00 0.00 H new ATOM 72 N LEU A 7 -6.661 -1.776 -0.016 1.00 0.00 N ATOM 73 CA LEU A 7 -5.586 -2.747 0.168 1.00 0.00 C ATOM 74 C LEU A 7 -4.247 -2.101 -0.152 1.00 0.00 C ATOM 75 O LEU A 7 -3.260 -2.335 0.528 1.00 0.00 O ATOM 76 CB LEU A 7 -5.754 -4.000 -0.718 1.00 0.00 C ATOM 77 CG LEU A 7 -7.195 -4.494 -0.885 1.00 0.00 C ATOM 78 CD1 LEU A 7 -7.235 -5.693 -1.840 1.00 0.00 C ATOM 79 CD2 LEU A 7 -7.841 -4.884 0.452 1.00 0.00 C ATOM 0 H LEU A 7 -7.280 -1.987 -0.799 1.00 0.00 H new ATOM 0 HA LEU A 7 -5.627 -3.065 1.210 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -5.344 -3.785 -1.705 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -5.157 -4.808 -0.294 1.00 0.00 H new ATOM 0 HG LEU A 7 -7.768 -3.665 -1.300 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -8.264 -6.036 -1.951 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -6.844 -5.396 -2.813 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -6.625 -6.501 -1.435 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -8.861 -5.227 0.277 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -7.264 -5.684 0.915 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -7.858 -4.018 1.114 1.00 0.00 H new ATOM 91 N PHE A 8 -4.212 -1.291 -1.198 1.00 0.00 N ATOM 92 CA PHE A 8 -2.977 -0.790 -1.788 1.00 0.00 C ATOM 93 C PHE A 8 -2.241 0.146 -0.842 1.00 0.00 C ATOM 94 O PHE A 8 -1.053 -0.019 -0.579 1.00 0.00 O ATOM 95 CB PHE A 8 -3.356 -0.003 -3.030 1.00 0.00 C ATOM 96 CG PHE A 8 -2.194 0.294 -3.956 1.00 0.00 C ATOM 97 CD1 PHE A 8 -1.805 -0.656 -4.920 1.00 0.00 C ATOM 98 CD2 PHE A 8 -1.488 1.507 -3.846 1.00 0.00 C ATOM 99 CE1 PHE A 8 -0.720 -0.392 -5.773 1.00 0.00 C ATOM 100 CE2 PHE A 8 -0.402 1.770 -4.699 1.00 0.00 C ATOM 101 CZ PHE A 8 -0.018 0.821 -5.662 1.00 0.00 C ATOM 0 H PHE A 8 -5.053 -0.957 -1.669 1.00 0.00 H new ATOM 0 HA PHE A 8 -2.323 -1.633 -2.011 1.00 0.00 H new ATOM 0 HB2 PHE A 8 -4.113 -0.560 -3.582 1.00 0.00 H new ATOM 0 HB3 PHE A 8 -3.812 0.939 -2.725 1.00 0.00 H new ATOM 0 HD1 PHE A 8 -2.342 -1.589 -5.004 1.00 0.00 H new ATOM 0 HD2 PHE A 8 -1.781 2.236 -3.105 1.00 0.00 H new ATOM 0 HE1 PHE A 8 -0.425 -1.121 -6.514 1.00 0.00 H new ATOM 0 HE2 PHE A 8 0.138 2.702 -4.614 1.00 0.00 H new ATOM 0 HZ PHE A 8 0.817 1.024 -6.317 1.00 0.00 H new ATOM 111 N LEU A 9 -2.980 1.115 -0.299 1.00 0.00 N ATOM 112 CA LEU A 9 -2.416 2.017 0.697 1.00 0.00 C ATOM 113 C LEU A 9 -2.413 1.337 2.063 1.00 0.00 C ATOM 114 O LEU A 9 -1.660 1.740 2.945 1.00 0.00 O ATOM 115 CB LEU A 9 -3.176 3.359 0.702 1.00 0.00 C ATOM 116 CG LEU A 9 -4.588 3.337 1.337 1.00 0.00 C ATOM 117 CD1 LEU A 9 -4.569 3.718 2.827 1.00 0.00 C ATOM 118 CD2 LEU A 9 -5.512 4.327 0.617 1.00 0.00 C ATOM 0 H LEU A 9 -3.958 1.291 -0.531 1.00 0.00 H new ATOM 0 HA LEU A 9 -1.381 2.246 0.444 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -2.572 4.094 1.234 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -3.268 3.706 -0.327 1.00 0.00 H new ATOM 0 HG LEU A 9 -4.951 2.314 1.236 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -5.584 3.687 3.223 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -3.944 3.013 3.375 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -4.166 4.724 2.940 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -6.501 4.300 1.074 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -5.101 5.333 0.699 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -5.591 4.052 -0.435 1.00 0.00 H new ATOM 130 N GLY A 10 -3.283 0.336 2.233 1.00 0.00 N ATOM 131 CA GLY A 10 -3.602 -0.200 3.555 1.00 0.00 C ATOM 132 C GLY A 10 -2.892 -1.512 3.838 1.00 0.00 C ATOM 133 O GLY A 10 -1.885 -1.548 4.534 1.00 0.00 O ATOM 0 H GLY A 10 -3.779 -0.119 1.467 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -3.326 0.530 4.316 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -4.679 -0.349 3.633 1.00 0.00 H new ATOM 137 N PHE A 11 -3.446 -2.596 3.302 1.00 0.00 N ATOM 138 CA PHE A 11 -2.976 -3.967 3.471 1.00 0.00 C ATOM 139 C PHE A 11 -1.516 -4.128 3.012 1.00 0.00 C ATOM 140 O PHE A 11 -0.682 -4.652 3.748 1.00 0.00 O ATOM 141 CB PHE A 11 -3.925 -4.877 2.671 1.00 0.00 C ATOM 142 CG PHE A 11 -3.649 -6.357 2.838 1.00 0.00 C ATOM 143 CD1 PHE A 11 -4.173 -7.052 3.945 1.00 0.00 C ATOM 144 CD2 PHE A 11 -2.860 -7.040 1.892 1.00 0.00 C ATOM 145 CE1 PHE A 11 -3.912 -8.424 4.103 1.00 0.00 C ATOM 146 CE2 PHE A 11 -2.600 -8.412 2.052 1.00 0.00 C ATOM 147 CZ PHE A 11 -3.128 -9.105 3.155 1.00 0.00 C ATOM 0 H PHE A 11 -4.274 -2.539 2.710 1.00 0.00 H new ATOM 0 HA PHE A 11 -2.987 -4.242 4.526 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -4.951 -4.673 2.977 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -3.851 -4.621 1.614 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -4.776 -6.530 4.673 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -2.455 -6.509 1.043 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -4.314 -8.955 4.953 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -1.994 -8.934 1.327 1.00 0.00 H new ATOM 0 HZ PHE A 11 -2.932 -10.160 3.274 1.00 0.00 H new ATOM 157 N LEU A 12 -1.204 -3.632 1.812 1.00 0.00 N ATOM 158 CA LEU A 12 0.131 -3.566 1.233 1.00 0.00 C ATOM 159 C LEU A 12 0.989 -2.572 2.020 1.00 0.00 C ATOM 160 O LEU A 12 2.111 -2.907 2.390 1.00 0.00 O ATOM 161 CB LEU A 12 0.001 -3.201 -0.260 1.00 0.00 C ATOM 162 CG LEU A 12 1.267 -2.627 -0.926 1.00 0.00 C ATOM 163 CD1 LEU A 12 2.413 -3.646 -0.944 1.00 0.00 C ATOM 164 CD2 LEU A 12 0.958 -2.203 -2.369 1.00 0.00 C ATOM 0 H LEU A 12 -1.915 -3.247 1.190 1.00 0.00 H new ATOM 0 HA LEU A 12 0.636 -4.530 1.298 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -0.301 -4.094 -0.807 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -0.804 -2.474 -0.368 1.00 0.00 H new ATOM 0 HG LEU A 12 1.579 -1.765 -0.337 1.00 0.00 H new ATOM 0 HD11 LEU A 12 3.287 -3.203 -1.422 1.00 0.00 H new ATOM 0 HD12 LEU A 12 2.663 -3.930 0.078 1.00 0.00 H new ATOM 0 HD13 LEU A 12 2.105 -4.531 -1.501 1.00 0.00 H new ATOM 0 HD21 LEU A 12 1.859 -1.799 -2.830 1.00 0.00 H new ATOM 0 HD22 LEU A 12 0.616 -3.068 -2.937 1.00 0.00 H new ATOM 0 HD23 LEU A 12 0.179 -1.441 -2.365 1.00 0.00 H new ATOM 176 N GLY A 13 0.465 -1.380 2.325 1.00 0.00 N ATOM 177 CA GLY A 13 1.257 -0.340 2.977 1.00 0.00 C ATOM 178 C GLY A 13 1.624 -0.702 4.421 1.00 0.00 C ATOM 179 O GLY A 13 2.694 -0.313 4.885 1.00 0.00 O ATOM 0 H GLY A 13 -0.501 -1.115 2.130 1.00 0.00 H new ATOM 0 HA2 GLY A 13 2.169 -0.170 2.405 1.00 0.00 H new ATOM 0 HA3 GLY A 13 0.698 0.596 2.971 1.00 0.00 H new