USER MOD reduce.3.24.130724 H: found=0, std=0, add=96, rem=0, adj=0 USER MOD reduce.3.24.130724 removed 97 hydrogens (0 hets) ATOM 59 N VAL A 123 10.635 3.188 -1.162 1.00 0.12 N ATOM 60 CA VAL A 123 9.861 2.257 -1.977 1.00 0.08 C ATOM 61 C VAL A 123 9.405 1.055 -1.144 1.00 0.05 C ATOM 62 O VAL A 123 8.331 0.508 -1.363 1.00 0.05 O ATOM 63 CB VAL A 123 10.658 1.770 -3.209 1.00 0.13 C ATOM 64 CG1 VAL A 123 11.955 1.094 -2.798 1.00 0.16 C ATOM 65 CG2 VAL A 123 9.814 0.830 -4.054 1.00 0.14 C ATOM 0 HA VAL A 123 8.985 2.798 -2.335 1.00 0.08 H new ATOM 0 HB VAL A 123 10.912 2.645 -3.807 1.00 0.13 H new ATOM 0 HG11 VAL A 123 12.491 0.764 -3.688 1.00 0.16 H new ATOM 0 HG12 VAL A 123 12.573 1.800 -2.243 1.00 0.16 H new ATOM 0 HG13 VAL A 123 11.733 0.233 -2.168 1.00 0.16 H new ATOM 0 HG21 VAL A 123 10.392 0.498 -4.916 1.00 0.14 H new ATOM 0 HG22 VAL A 123 9.524 -0.035 -3.457 1.00 0.14 H new ATOM 0 HG23 VAL A 123 8.920 1.352 -4.396 1.00 0.14 H new ATOM 75 N GLU A 124 10.223 0.678 -0.173 1.00 0.07 N ATOM 76 CA GLU A 124 9.917 -0.426 0.730 1.00 0.08 C ATOM 77 C GLU A 124 8.623 -0.167 1.510 1.00 0.05 C ATOM 78 O GLU A 124 7.871 -1.096 1.801 1.00 0.09 O ATOM 79 CB GLU A 124 11.087 -0.647 1.692 1.00 0.14 C ATOM 80 CG GLU A 124 10.896 -1.816 2.643 1.00 1.00 C ATOM 81 CD GLU A 124 12.141 -2.116 3.447 1.00 1.33 C ATOM 82 OE1 GLU A 124 12.304 -1.528 4.536 1.00 1.43 O ATOM 83 OE2 GLU A 124 12.966 -2.941 2.997 1.00 2.28 O ATOM 0 H GLU A 124 11.119 1.128 0.013 1.00 0.07 H new ATOM 0 HA GLU A 124 9.767 -1.326 0.133 1.00 0.08 H new ATOM 0 HB2 GLU A 124 11.995 -0.810 1.111 1.00 0.14 H new ATOM 0 HB3 GLU A 124 11.240 0.261 2.275 1.00 0.14 H new ATOM 0 HG2 GLU A 124 10.072 -1.597 3.322 1.00 1.00 H new ATOM 0 HG3 GLU A 124 10.613 -2.701 2.074 1.00 1.00 H new ATOM 90 N LEU A 125 8.364 1.087 1.855 1.00 0.03 N ATOM 91 CA LEU A 125 7.131 1.426 2.556 1.00 0.05 C ATOM 92 C LEU A 125 6.027 1.789 1.563 1.00 0.05 C ATOM 93 O LEU A 125 4.848 1.691 1.877 1.00 0.09 O ATOM 94 CB LEU A 125 7.367 2.560 3.567 1.00 0.07 C ATOM 95 CG LEU A 125 7.550 3.964 2.986 1.00 0.06 C ATOM 96 CD1 LEU A 125 6.206 4.662 2.829 1.00 0.13 C ATOM 97 CD2 LEU A 125 8.477 4.783 3.868 1.00 0.09 C ATOM 0 H LEU A 125 8.981 1.877 1.665 1.00 0.03 H new ATOM 0 HA LEU A 125 6.804 0.549 3.114 1.00 0.05 H new ATOM 0 HB2 LEU A 125 6.523 2.583 4.257 1.00 0.07 H new ATOM 0 HB3 LEU A 125 8.252 2.315 4.154 1.00 0.07 H new ATOM 0 HG LEU A 125 8.002 3.872 1.998 1.00 0.06 H new ATOM 0 HD11 LEU A 125 6.360 5.658 2.415 1.00 0.13 H new ATOM 0 HD12 LEU A 125 5.572 4.083 2.157 1.00 0.13 H new ATOM 0 HD13 LEU A 125 5.723 4.745 3.803 1.00 0.13 H new ATOM 0 HD21 LEU A 125 8.598 5.779 3.443 1.00 0.09 H new ATOM 0 HD22 LEU A 125 8.050 4.865 4.868 1.00 0.09 H new ATOM 0 HD23 LEU A 125 9.449 4.293 3.928 1.00 0.09 H new ATOM 109 N GLU A 126 6.409 2.209 0.368 1.00 0.04 N ATOM 110 CA GLU A 126 5.437 2.556 -0.664 1.00 0.05 C ATOM 111 C GLU A 126 4.833 1.301 -1.265 1.00 0.04 C ATOM 112 O GLU A 126 3.639 1.250 -1.566 1.00 0.05 O ATOM 113 CB GLU A 126 6.105 3.374 -1.758 1.00 0.06 C ATOM 114 CG GLU A 126 6.687 4.677 -1.259 1.00 0.13 C ATOM 115 CD GLU A 126 5.745 5.848 -1.421 1.00 0.47 C ATOM 116 OE1 GLU A 126 5.695 6.439 -2.516 1.00 0.81 O ATOM 117 OE2 GLU A 126 5.035 6.178 -0.446 1.00 0.74 O ATOM 0 H GLU A 126 7.383 2.319 0.086 1.00 0.04 H new ATOM 0 HA GLU A 126 4.644 3.147 -0.206 1.00 0.05 H new ATOM 0 HB2 GLU A 126 6.898 2.780 -2.213 1.00 0.06 H new ATOM 0 HB3 GLU A 126 5.376 3.586 -2.540 1.00 0.06 H new ATOM 0 HG2 GLU A 126 6.948 4.572 -0.206 1.00 0.13 H new ATOM 0 HG3 GLU A 126 7.612 4.885 -1.798 1.00 0.13 H new ATOM 124 N ARG A 127 5.679 0.299 -1.441 1.00 0.03 N ATOM 125 CA ARG A 127 5.264 -0.984 -1.989 1.00 0.04 C ATOM 126 C ARG A 127 4.179 -1.621 -1.121 1.00 0.03 C ATOM 127 O ARG A 127 3.229 -2.207 -1.637 1.00 0.05 O ATOM 128 CB ARG A 127 6.467 -1.927 -2.117 1.00 0.04 C ATOM 129 CG ARG A 127 7.024 -2.411 -0.789 1.00 0.06 C ATOM 130 CD ARG A 127 8.136 -3.427 -0.987 1.00 0.12 C ATOM 131 NE ARG A 127 8.667 -3.907 0.286 1.00 1.21 N ATOM 132 CZ ARG A 127 9.867 -4.463 0.432 1.00 1.61 C ATOM 133 NH1 ARG A 127 10.680 -4.585 -0.612 1.00 1.38 N ATOM 134 NH2 ARG A 127 10.259 -4.884 1.627 1.00 2.65 N ATOM 0 H ARG A 127 6.671 0.351 -1.209 1.00 0.03 H new ATOM 0 HA ARG A 127 4.849 -0.811 -2.982 1.00 0.04 H new ATOM 0 HB2 ARG A 127 6.174 -2.792 -2.712 1.00 0.04 H new ATOM 0 HB3 ARG A 127 7.258 -1.416 -2.665 1.00 0.04 H new ATOM 0 HG2 ARG A 127 7.403 -1.561 -0.221 1.00 0.06 H new ATOM 0 HG3 ARG A 127 6.224 -2.857 -0.199 1.00 0.06 H new ATOM 0 HD2 ARG A 127 7.758 -4.271 -1.564 1.00 0.12 H new ATOM 0 HD3 ARG A 127 8.940 -2.977 -1.569 1.00 0.12 H new ATOM 0 HE ARG A 127 8.081 -3.810 1.115 1.00 1.21 H new ATOM 0 HH11 ARG A 127 10.385 -4.252 -1.530 1.00 1.38 H new ATOM 0 HH12 ARG A 127 11.599 -5.012 -0.496 1.00 1.38 H new ATOM 0 HH21 ARG A 127 9.641 -4.781 2.432 1.00 2.65 H new ATOM 0 HH22 ARG A 127 11.178 -5.311 1.741 1.00 2.65 H new ATOM 148 N GLU A 128 4.317 -1.495 0.195 1.00 0.03 N ATOM 149 CA GLU A 128 3.323 -2.028 1.106 1.00 0.03 C ATOM 150 C GLU A 128 2.063 -1.180 1.071 1.00 0.04 C ATOM 151 O GLU A 128 0.960 -1.719 1.067 1.00 0.07 O ATOM 152 CB GLU A 128 3.876 -2.138 2.527 1.00 0.07 C ATOM 153 CG GLU A 128 4.521 -0.877 3.050 1.00 0.09 C ATOM 154 CD GLU A 128 4.939 -0.991 4.501 1.00 0.24 C ATOM 155 OE1 GLU A 128 5.967 -1.644 4.778 1.00 0.39 O ATOM 156 OE2 GLU A 128 4.241 -0.431 5.371 1.00 0.42 O ATOM 0 H GLU A 128 5.104 -1.031 0.648 1.00 0.03 H new ATOM 0 HA GLU A 128 3.066 -3.035 0.778 1.00 0.03 H new ATOM 0 HB2 GLU A 128 3.065 -2.420 3.198 1.00 0.07 H new ATOM 0 HB3 GLU A 128 4.609 -2.944 2.556 1.00 0.07 H new ATOM 0 HG2 GLU A 128 5.395 -0.642 2.442 1.00 0.09 H new ATOM 0 HG3 GLU A 128 3.824 -0.046 2.941 1.00 0.09 H new ATOM 163 N LEU A 129 2.229 0.144 1.025 1.00 0.03 N ATOM 164 CA LEU A 129 1.094 1.051 0.867 1.00 0.05 C ATOM 165 C LEU A 129 0.249 0.630 -0.327 1.00 0.06 C ATOM 166 O LEU A 129 -0.950 0.386 -0.199 1.00 0.09 O ATOM 167 CB LEU A 129 1.574 2.491 0.661 1.00 0.06 C ATOM 168 CG LEU A 129 2.325 3.112 1.837 1.00 0.09 C ATOM 169 CD1 LEU A 129 2.875 4.474 1.449 1.00 0.11 C ATOM 170 CD2 LEU A 129 1.416 3.227 3.049 1.00 0.14 C ATOM 0 H LEU A 129 3.134 0.608 1.095 1.00 0.03 H new ATOM 0 HA LEU A 129 0.494 1.003 1.776 1.00 0.05 H new ATOM 0 HB2 LEU A 129 2.222 2.517 -0.215 1.00 0.06 H new ATOM 0 HB3 LEU A 129 0.709 3.115 0.436 1.00 0.06 H new ATOM 0 HG LEU A 129 3.161 2.463 2.098 1.00 0.09 H new ATOM 0 HD11 LEU A 129 3.408 4.906 2.296 1.00 0.11 H new ATOM 0 HD12 LEU A 129 3.559 4.364 0.608 1.00 0.11 H new ATOM 0 HD13 LEU A 129 2.053 5.131 1.165 1.00 0.11 H new ATOM 0 HD21 LEU A 129 1.968 3.672 3.877 1.00 0.14 H new ATOM 0 HD22 LEU A 129 0.561 3.856 2.804 1.00 0.14 H new ATOM 0 HD23 LEU A 129 1.066 2.236 3.337 1.00 0.14 H new ATOM 182 N ALA A 130 0.902 0.506 -1.476 1.00 0.07 N ATOM 183 CA ALA A 130 0.236 0.138 -2.718 1.00 0.11 C ATOM 184 C ALA A 130 -0.411 -1.242 -2.615 1.00 0.14 C ATOM 185 O ALA A 130 -1.393 -1.526 -3.298 1.00 0.19 O ATOM 186 CB ALA A 130 1.231 0.168 -3.866 1.00 0.13 C ATOM 0 H ALA A 130 1.906 0.657 -1.572 1.00 0.07 H new ATOM 0 HA ALA A 130 -0.555 0.863 -2.907 1.00 0.11 H new ATOM 0 HB1 ALA A 130 0.727 -0.108 -4.792 1.00 0.13 H new ATOM 0 HB2 ALA A 130 1.644 1.172 -3.963 1.00 0.13 H new ATOM 0 HB3 ALA A 130 2.037 -0.538 -3.667 1.00 0.13 H new ATOM 192 N GLU A 131 0.132 -2.078 -1.741 1.00 0.14 N ATOM 193 CA GLU A 131 -0.352 -3.432 -1.557 1.00 0.18 C ATOM 194 C GLU A 131 -1.693 -3.416 -0.817 1.00 0.22 C ATOM 195 O GLU A 131 -2.638 -4.092 -1.218 1.00 0.26 O ATOM 196 CB GLU A 131 0.727 -4.237 -0.811 1.00 0.17 C ATOM 197 CG GLU A 131 0.241 -4.989 0.414 1.00 0.23 C ATOM 198 CD GLU A 131 -0.373 -6.335 0.081 1.00 0.35 C ATOM 199 OE1 GLU A 131 0.369 -7.241 -0.347 1.00 0.55 O ATOM 200 OE2 GLU A 131 -1.596 -6.500 0.257 1.00 0.56 O ATOM 0 H GLU A 131 0.920 -1.833 -1.141 1.00 0.14 H new ATOM 0 HA GLU A 131 -0.534 -3.914 -2.518 1.00 0.18 H new ATOM 0 HB2 GLU A 131 1.169 -4.952 -1.505 1.00 0.17 H new ATOM 0 HB3 GLU A 131 1.521 -3.555 -0.507 1.00 0.17 H new ATOM 0 HG2 GLU A 131 1.077 -5.137 1.098 1.00 0.23 H new ATOM 0 HG3 GLU A 131 -0.496 -4.380 0.938 1.00 0.23 H new ATOM 207 N LEU A 132 -1.786 -2.609 0.239 1.00 0.21 N ATOM 208 CA LEU A 132 -3.030 -2.486 0.996 1.00 0.25 C ATOM 209 C LEU A 132 -4.086 -1.810 0.146 1.00 0.29 C ATOM 210 O LEU A 132 -5.264 -2.160 0.187 1.00 0.35 O ATOM 211 CB LEU A 132 -2.824 -1.662 2.256 1.00 0.25 C ATOM 212 CG LEU A 132 -1.634 -2.063 3.104 1.00 0.23 C ATOM 213 CD1 LEU A 132 -0.745 -0.859 3.285 1.00 0.19 C ATOM 214 CD2 LEU A 132 -2.088 -2.614 4.443 1.00 0.32 C ATOM 0 H LEU A 132 -1.019 -2.034 0.588 1.00 0.21 H new ATOM 0 HA LEU A 132 -3.352 -3.490 1.273 1.00 0.25 H new ATOM 0 HB2 LEU A 132 -2.711 -0.616 1.972 1.00 0.25 H new ATOM 0 HB3 LEU A 132 -3.724 -1.731 2.867 1.00 0.25 H new ATOM 0 HG LEU A 132 -1.075 -2.854 2.604 1.00 0.23 H new ATOM 0 HD11 LEU A 132 0.117 -1.131 3.894 1.00 0.19 H new ATOM 0 HD12 LEU A 132 -0.405 -0.508 2.311 1.00 0.19 H new ATOM 0 HD13 LEU A 132 -1.304 -0.066 3.781 1.00 0.19 H new ATOM 0 HD21 LEU A 132 -1.217 -2.895 5.035 1.00 0.32 H new ATOM 0 HD22 LEU A 132 -2.658 -1.853 4.975 1.00 0.32 H new ATOM 0 HD23 LEU A 132 -2.716 -3.490 4.282 1.00 0.32 H new ATOM 226 N ARG A 133 -3.640 -0.820 -0.606 1.00 0.28 N ATOM 227 CA ARG A 133 -4.487 -0.080 -1.520 1.00 0.34 C ATOM 228 C ARG A 133 -5.050 -0.990 -2.609 1.00 0.40 C ATOM 229 O ARG A 133 -6.149 -0.767 -3.121 1.00 0.47 O ATOM 230 CB ARG A 133 -3.663 1.040 -2.139 1.00 0.31 C ATOM 231 CG ARG A 133 -3.199 2.073 -1.133 1.00 0.29 C ATOM 232 CD ARG A 133 -2.408 3.188 -1.799 1.00 1.03 C ATOM 233 NE ARG A 133 -1.736 4.044 -0.820 1.00 1.74 N ATOM 234 CZ ARG A 133 -0.849 4.990 -1.136 1.00 2.61 C ATOM 235 NH1 ARG A 133 -0.518 5.203 -2.405 1.00 3.04 N ATOM 236 NH2 ARG A 133 -0.289 5.719 -0.177 1.00 3.48 N ATOM 0 H ARG A 133 -2.670 -0.505 -0.598 1.00 0.28 H new ATOM 0 HA ARG A 133 -5.334 0.335 -0.973 1.00 0.34 H new ATOM 0 HB2 ARG A 133 -2.793 0.609 -2.634 1.00 0.31 H new ATOM 0 HB3 ARG A 133 -4.256 1.534 -2.909 1.00 0.31 H new ATOM 0 HG2 ARG A 133 -4.063 2.496 -0.620 1.00 0.29 H new ATOM 0 HG3 ARG A 133 -2.582 1.591 -0.375 1.00 0.29 H new ATOM 0 HD2 ARG A 133 -1.667 2.755 -2.471 1.00 1.03 H new ATOM 0 HD3 ARG A 133 -3.078 3.793 -2.410 1.00 1.03 H new ATOM 0 HE ARG A 133 -1.960 3.909 0.166 1.00 1.74 H new ATOM 0 HH11 ARG A 133 -0.942 4.642 -3.144 1.00 3.04 H new ATOM 0 HH12 ARG A 133 0.160 5.927 -2.640 1.00 3.04 H new ATOM 0 HH21 ARG A 133 -0.537 5.555 0.799 1.00 3.48 H new ATOM 0 HH22 ARG A 133 0.389 6.442 -0.416 1.00 3.48 H new