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 10.591 3.176 -1.326 1.00 0.12 N ATOM 60 CA VAL A 123 9.773 2.227 -2.074 1.00 0.08 C ATOM 61 C VAL A 123 9.379 1.043 -1.190 1.00 0.05 C ATOM 62 O VAL A 123 8.327 0.447 -1.367 1.00 0.05 O ATOM 63 CB VAL A 123 10.502 1.719 -3.344 1.00 0.13 C ATOM 64 CG1 VAL A 123 11.853 1.112 -2.998 1.00 0.16 C ATOM 65 CG2 VAL A 123 9.643 0.709 -4.090 1.00 0.14 C ATOM 0 HA VAL A 123 8.872 2.753 -2.390 1.00 0.08 H new ATOM 0 HB VAL A 123 10.673 2.577 -3.994 1.00 0.13 H new ATOM 0 HG11 VAL A 123 12.340 0.765 -3.909 1.00 0.16 H new ATOM 0 HG12 VAL A 123 12.478 1.865 -2.517 1.00 0.16 H new ATOM 0 HG13 VAL A 123 11.711 0.271 -2.319 1.00 0.16 H new ATOM 0 HG21 VAL A 123 10.174 0.365 -4.978 1.00 0.14 H new ATOM 0 HG22 VAL A 123 9.434 -0.141 -3.441 1.00 0.14 H new ATOM 0 HG23 VAL A 123 8.705 1.178 -4.387 1.00 0.14 H new ATOM 75 N GLU A 124 10.224 0.732 -0.220 1.00 0.07 N ATOM 76 CA GLU A 124 9.969 -0.351 0.719 1.00 0.08 C ATOM 77 C GLU A 124 8.665 -0.126 1.496 1.00 0.05 C ATOM 78 O GLU A 124 7.932 -1.075 1.774 1.00 0.09 O ATOM 79 CB GLU A 124 11.143 -0.479 1.687 1.00 0.14 C ATOM 80 CG GLU A 124 11.022 -1.650 2.644 1.00 1.00 C ATOM 81 CD GLU A 124 12.140 -1.687 3.659 1.00 1.33 C ATOM 82 OE1 GLU A 124 13.239 -2.163 3.316 1.00 2.28 O ATOM 83 OE2 GLU A 124 11.927 -1.237 4.801 1.00 1.43 O ATOM 0 H GLU A 124 11.105 1.222 -0.061 1.00 0.07 H new ATOM 0 HA GLU A 124 9.861 -1.275 0.151 1.00 0.08 H new ATOM 0 HB2 GLU A 124 12.064 -0.584 1.114 1.00 0.14 H new ATOM 0 HB3 GLU A 124 11.229 0.442 2.263 1.00 0.14 H new ATOM 0 HG2 GLU A 124 10.066 -1.593 3.164 1.00 1.00 H new ATOM 0 HG3 GLU A 124 11.021 -2.580 2.076 1.00 1.00 H new ATOM 90 N LEU A 125 8.384 1.119 1.853 1.00 0.03 N ATOM 91 CA LEU A 125 7.151 1.442 2.570 1.00 0.05 C ATOM 92 C LEU A 125 6.029 1.797 1.594 1.00 0.05 C ATOM 93 O LEU A 125 4.854 1.737 1.941 1.00 0.09 O ATOM 94 CB LEU A 125 7.389 2.584 3.569 1.00 0.07 C ATOM 95 CG LEU A 125 7.508 3.988 2.967 1.00 0.06 C ATOM 96 CD1 LEU A 125 6.152 4.682 2.958 1.00 0.13 C ATOM 97 CD2 LEU A 125 8.529 4.812 3.735 1.00 0.09 C ATOM 0 H LEU A 125 8.986 1.920 1.661 1.00 0.03 H new ATOM 0 HA LEU A 125 6.842 0.559 3.129 1.00 0.05 H new ATOM 0 HB2 LEU A 125 6.571 2.587 4.289 1.00 0.07 H new ATOM 0 HB3 LEU A 125 8.302 2.370 4.125 1.00 0.07 H new ATOM 0 HG LEU A 125 7.850 3.894 1.936 1.00 0.06 H new ATOM 0 HD11 LEU A 125 6.256 5.678 2.527 1.00 0.13 H new ATOM 0 HD12 LEU A 125 5.449 4.100 2.362 1.00 0.13 H new ATOM 0 HD13 LEU A 125 5.779 4.765 3.979 1.00 0.13 H new ATOM 0 HD21 LEU A 125 8.600 5.806 3.294 1.00 0.09 H new ATOM 0 HD22 LEU A 125 8.218 4.899 4.776 1.00 0.09 H new ATOM 0 HD23 LEU A 125 9.502 4.323 3.687 1.00 0.09 H new ATOM 109 N GLU A 126 6.388 2.186 0.385 1.00 0.04 N ATOM 110 CA GLU A 126 5.394 2.516 -0.631 1.00 0.05 C ATOM 111 C GLU A 126 4.829 1.253 -1.247 1.00 0.04 C ATOM 112 O GLU A 126 3.637 1.167 -1.537 1.00 0.05 O ATOM 113 CB GLU A 126 6.017 3.380 -1.711 1.00 0.06 C ATOM 114 CG GLU A 126 6.516 4.703 -1.186 1.00 0.13 C ATOM 115 CD GLU A 126 5.524 5.826 -1.390 1.00 0.47 C ATOM 116 OE1 GLU A 126 4.501 5.869 -0.679 1.00 0.74 O ATOM 117 OE2 GLU A 126 5.769 6.682 -2.267 1.00 0.81 O ATOM 0 H GLU A 126 7.356 2.282 0.079 1.00 0.04 H new ATOM 0 HA GLU A 126 4.584 3.069 -0.155 1.00 0.05 H new ATOM 0 HB2 GLU A 126 6.846 2.840 -2.169 1.00 0.06 H new ATOM 0 HB3 GLU A 126 5.282 3.560 -2.495 1.00 0.06 H new ATOM 0 HG2 GLU A 126 6.736 4.607 -0.123 1.00 0.13 H new ATOM 0 HG3 GLU A 126 7.452 4.956 -1.683 1.00 0.13 H new ATOM 124 N ARG A 127 5.701 0.275 -1.435 1.00 0.03 N ATOM 125 CA ARG A 127 5.309 -1.016 -1.986 1.00 0.04 C ATOM 126 C ARG A 127 4.211 -1.644 -1.136 1.00 0.03 C ATOM 127 O ARG A 127 3.275 -2.239 -1.665 1.00 0.05 O ATOM 128 CB ARG A 127 6.512 -1.968 -2.079 1.00 0.04 C ATOM 129 CG ARG A 127 7.034 -2.439 -0.731 1.00 0.06 C ATOM 130 CD ARG A 127 8.079 -3.532 -0.876 1.00 0.12 C ATOM 131 NE ARG A 127 8.584 -3.976 0.425 1.00 1.21 N ATOM 132 CZ ARG A 127 8.244 -5.128 1.012 1.00 1.61 C ATOM 133 NH1 ARG A 127 7.378 -5.950 0.430 1.00 1.38 N ATOM 134 NH2 ARG A 127 8.760 -5.451 2.193 1.00 2.65 N ATOM 0 H ARG A 127 6.694 0.351 -1.212 1.00 0.03 H new ATOM 0 HA ARG A 127 4.928 -0.848 -2.993 1.00 0.04 H new ATOM 0 HB2 ARG A 127 6.229 -2.838 -2.671 1.00 0.04 H new ATOM 0 HB3 ARG A 127 7.318 -1.467 -2.614 1.00 0.04 H new ATOM 0 HG2 ARG A 127 7.465 -1.594 -0.194 1.00 0.06 H new ATOM 0 HG3 ARG A 127 6.204 -2.809 -0.130 1.00 0.06 H new ATOM 0 HD2 ARG A 127 7.647 -4.380 -1.407 1.00 0.12 H new ATOM 0 HD3 ARG A 127 8.908 -3.165 -1.482 1.00 0.12 H new ATOM 0 HE ARG A 127 9.238 -3.366 0.916 1.00 1.21 H new ATOM 0 HH11 ARG A 127 6.968 -5.704 -0.471 1.00 1.38 H new ATOM 0 HH12 ARG A 127 7.123 -6.827 0.884 1.00 1.38 H new ATOM 0 HH21 ARG A 127 9.416 -4.820 2.653 1.00 2.65 H new ATOM 0 HH22 ARG A 127 8.500 -6.330 2.640 1.00 2.65 H new ATOM 148 N GLU A 128 4.318 -1.491 0.184 1.00 0.03 N ATOM 149 CA GLU A 128 3.312 -2.019 1.086 1.00 0.03 C ATOM 150 C GLU A 128 2.045 -1.180 1.019 1.00 0.04 C ATOM 151 O GLU A 128 0.953 -1.731 0.920 1.00 0.07 O ATOM 152 CB GLU A 128 3.841 -2.109 2.520 1.00 0.07 C ATOM 153 CG GLU A 128 4.431 -0.827 3.056 1.00 0.09 C ATOM 154 CD GLU A 128 4.728 -0.896 4.535 1.00 0.24 C ATOM 155 OE1 GLU A 128 5.712 -1.555 4.920 1.00 0.39 O ATOM 156 OE2 GLU A 128 3.974 -0.287 5.320 1.00 0.42 O ATOM 0 H GLU A 128 5.089 -1.007 0.644 1.00 0.03 H new ATOM 0 HA GLU A 128 3.068 -3.032 0.766 1.00 0.03 H new ATOM 0 HB2 GLU A 128 3.027 -2.420 3.174 1.00 0.07 H new ATOM 0 HB3 GLU A 128 4.601 -2.889 2.564 1.00 0.07 H new ATOM 0 HG2 GLU A 128 5.350 -0.601 2.515 1.00 0.09 H new ATOM 0 HG3 GLU A 128 3.739 -0.006 2.866 1.00 0.09 H new ATOM 163 N LEU A 129 2.194 0.147 1.041 1.00 0.03 N ATOM 164 CA LEU A 129 1.057 1.054 0.888 1.00 0.05 C ATOM 165 C LEU A 129 0.238 0.671 -0.338 1.00 0.06 C ATOM 166 O LEU A 129 -0.971 0.453 -0.256 1.00 0.09 O ATOM 167 CB LEU A 129 1.546 2.498 0.743 1.00 0.06 C ATOM 168 CG LEU A 129 2.234 3.096 1.970 1.00 0.09 C ATOM 169 CD1 LEU A 129 2.806 4.459 1.631 1.00 0.11 C ATOM 170 CD2 LEU A 129 1.261 3.197 3.137 1.00 0.14 C ATOM 0 H LEU A 129 3.092 0.616 1.163 1.00 0.03 H new ATOM 0 HA LEU A 129 0.432 0.974 1.777 1.00 0.05 H new ATOM 0 HB2 LEU A 129 2.239 2.544 -0.097 1.00 0.06 H new ATOM 0 HB3 LEU A 129 0.693 3.126 0.487 1.00 0.06 H new ATOM 0 HG LEU A 129 3.050 2.438 2.268 1.00 0.09 H new ATOM 0 HD11 LEU A 129 3.294 4.878 2.511 1.00 0.11 H new ATOM 0 HD12 LEU A 129 3.534 4.358 0.826 1.00 0.11 H new ATOM 0 HD13 LEU A 129 2.002 5.122 1.312 1.00 0.11 H new ATOM 0 HD21 LEU A 129 1.771 3.625 4.000 1.00 0.14 H new ATOM 0 HD22 LEU A 129 0.423 3.835 2.858 1.00 0.14 H new ATOM 0 HD23 LEU A 129 0.892 2.203 3.390 1.00 0.14 H new ATOM 182 N ALA A 130 0.924 0.553 -1.463 1.00 0.07 N ATOM 183 CA ALA A 130 0.295 0.204 -2.726 1.00 0.11 C ATOM 184 C ALA A 130 -0.255 -1.219 -2.706 1.00 0.14 C ATOM 185 O ALA A 130 -1.186 -1.542 -3.436 1.00 0.19 O ATOM 186 CB ALA A 130 1.299 0.356 -3.850 1.00 0.13 C ATOM 0 H ALA A 130 1.932 0.696 -1.526 1.00 0.07 H new ATOM 0 HA ALA A 130 -0.545 0.880 -2.886 1.00 0.11 H new ATOM 0 HB1 ALA A 130 0.827 0.094 -4.797 1.00 0.13 H new ATOM 0 HB2 ALA A 130 1.646 1.388 -3.891 1.00 0.13 H new ATOM 0 HB3 ALA A 130 2.147 -0.305 -3.672 1.00 0.13 H new ATOM 192 N GLU A 131 0.316 -2.059 -1.856 1.00 0.14 N ATOM 193 CA GLU A 131 -0.090 -3.443 -1.754 1.00 0.18 C ATOM 194 C GLU A 131 -1.462 -3.527 -1.090 1.00 0.22 C ATOM 195 O GLU A 131 -2.333 -4.272 -1.537 1.00 0.26 O ATOM 196 CB GLU A 131 0.982 -4.217 -0.975 1.00 0.17 C ATOM 197 CG GLU A 131 0.459 -5.047 0.181 1.00 0.23 C ATOM 198 CD GLU A 131 0.029 -6.435 -0.243 1.00 0.35 C ATOM 199 OE1 GLU A 131 0.898 -7.225 -0.665 1.00 0.55 O ATOM 200 OE2 GLU A 131 -1.174 -6.753 -0.151 1.00 0.56 O ATOM 0 H GLU A 131 1.071 -1.797 -1.222 1.00 0.14 H new ATOM 0 HA GLU A 131 -0.181 -3.894 -2.742 1.00 0.18 H new ATOM 0 HB2 GLU A 131 1.508 -4.875 -1.666 1.00 0.17 H new ATOM 0 HB3 GLU A 131 1.714 -3.507 -0.591 1.00 0.17 H new ATOM 0 HG2 GLU A 131 1.233 -5.128 0.944 1.00 0.23 H new ATOM 0 HG3 GLU A 131 -0.386 -4.533 0.638 1.00 0.23 H new ATOM 207 N LEU A 132 -1.660 -2.730 -0.045 1.00 0.21 N ATOM 208 CA LEU A 132 -2.952 -2.661 0.629 1.00 0.25 C ATOM 209 C LEU A 132 -3.987 -2.073 -0.312 1.00 0.29 C ATOM 210 O LEU A 132 -5.139 -2.501 -0.348 1.00 0.35 O ATOM 211 CB LEU A 132 -2.860 -1.799 1.880 1.00 0.25 C ATOM 212 CG LEU A 132 -1.735 -2.171 2.828 1.00 0.23 C ATOM 213 CD1 LEU A 132 -0.876 -0.953 3.058 1.00 0.19 C ATOM 214 CD2 LEU A 132 -2.284 -2.711 4.140 1.00 0.32 C ATOM 0 H LEU A 132 -0.943 -2.123 0.353 1.00 0.21 H new ATOM 0 HA LEU A 132 -3.246 -3.670 0.919 1.00 0.25 H new ATOM 0 HB2 LEU A 132 -2.734 -0.759 1.579 1.00 0.25 H new ATOM 0 HB3 LEU A 132 -3.806 -1.862 2.418 1.00 0.25 H new ATOM 0 HG LEU A 132 -1.131 -2.963 2.385 1.00 0.23 H new ATOM 0 HD11 LEU A 132 -0.062 -1.205 3.738 1.00 0.19 H new ATOM 0 HD12 LEU A 132 -0.463 -0.614 2.108 1.00 0.19 H new ATOM 0 HD13 LEU A 132 -1.481 -0.158 3.495 1.00 0.19 H new ATOM 0 HD21 LEU A 132 -1.457 -2.970 4.801 1.00 0.32 H new ATOM 0 HD22 LEU A 132 -2.904 -1.951 4.615 1.00 0.32 H new ATOM 0 HD23 LEU A 132 -2.885 -3.599 3.945 1.00 0.32 H new ATOM 226 N ARG A 133 -3.548 -1.084 -1.069 1.00 0.28 N ATOM 227 CA ARG A 133 -4.364 -0.447 -2.078 1.00 0.34 C ATOM 228 C ARG A 133 -4.734 -1.424 -3.188 1.00 0.40 C ATOM 229 O ARG A 133 -5.774 -1.291 -3.831 1.00 0.47 O ATOM 230 CB ARG A 133 -3.575 0.723 -2.637 1.00 0.31 C ATOM 231 CG ARG A 133 -3.335 1.813 -1.618 1.00 0.29 C ATOM 232 CD ARG A 133 -4.597 2.601 -1.317 1.00 1.03 C ATOM 233 NE ARG A 133 -4.381 3.558 -0.236 1.00 1.74 N ATOM 234 CZ ARG A 133 -5.232 4.525 0.098 1.00 2.61 C ATOM 235 NH1 ARG A 133 -6.361 4.695 -0.584 1.00 3.04 N ATOM 236 NH2 ARG A 133 -4.944 5.334 1.111 1.00 3.48 N ATOM 0 H ARG A 133 -2.606 -0.699 -0.998 1.00 0.28 H new ATOM 0 HA ARG A 133 -5.298 -0.102 -1.636 1.00 0.34 H new ATOM 0 HB2 ARG A 133 -2.616 0.363 -3.009 1.00 0.31 H new ATOM 0 HB3 ARG A 133 -4.110 1.141 -3.489 1.00 0.31 H new ATOM 0 HG2 ARG A 133 -2.956 1.370 -0.697 1.00 0.29 H new ATOM 0 HG3 ARG A 133 -2.565 2.490 -1.987 1.00 0.29 H new ATOM 0 HD2 ARG A 133 -4.921 3.129 -2.214 1.00 1.03 H new ATOM 0 HD3 ARG A 133 -5.399 1.916 -1.044 1.00 1.03 H new ATOM 0 HE ARG A 133 -3.517 3.480 0.301 1.00 1.74 H new ATOM 0 HH11 ARG A 133 -6.580 4.082 -1.369 1.00 3.04 H new ATOM 0 HH12 ARG A 133 -7.008 5.438 -0.322 1.00 3.04 H new ATOM 0 HH21 ARG A 133 -4.074 5.213 1.629 1.00 3.48 H new ATOM 0 HH22 ARG A 133 -5.593 6.077 1.371 1.00 3.48 H new