USER MOD reduce.3.24.130724 H: found=0, std=0, add=15, rem=0, adj=0 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) ATOM 49 N ASN A 13 4.058 1.597 2.626 1.00 0.00 N ATOM 50 CA ASN A 13 3.865 2.683 3.583 1.00 0.00 C ATOM 51 C ASN A 13 3.169 3.855 2.934 1.00 0.00 C ATOM 52 O ASN A 13 2.816 3.828 1.747 1.00 0.00 O ATOM 53 N LEU A 14 2.975 4.917 3.700 1.00 0.00 N ATOM 54 CA LEU A 14 2.215 6.072 3.224 1.00 0.00 C ATOM 55 C LEU A 14 2.890 7.362 3.629 1.00 0.00 C ATOM 56 O LEU A 14 3.165 8.241 2.804 1.00 0.00 O ATOM 0 H LEU A 14 3.330 5.007 4.652 1.00 0.00 H new ATOM 69 N CYS A 18 4.160 9.843 0.465 1.00 0.00 N ATOM 70 CA CYS A 18 2.918 10.524 0.095 1.00 0.00 C ATOM 71 C CYS A 18 2.700 11.780 0.900 1.00 0.00 C ATOM 72 O CYS A 18 2.313 12.834 0.373 1.00 0.00 O ATOM 73 N MET A 19 2.959 11.700 2.187 1.00 0.00 N ATOM 74 CA MET A 19 2.658 12.806 3.104 1.00 0.00 C ATOM 75 C MET A 19 3.779 13.820 3.016 1.00 0.00 C ATOM 76 O MET A 19 4.536 13.878 2.020 1.00 0.00 O ATOM 0 H MET A 19 3.378 10.884 2.634 1.00 0.00 H new ATOM 85 N LYS A 22 2.321 16.007 -1.061 1.00 0.00 N ATOM 86 CA LYS A 22 1.039 15.764 -1.721 1.00 0.00 C ATOM 87 C LYS A 22 1.197 14.848 -2.914 1.00 0.00 C ATOM 88 O LYS A 22 2.151 14.969 -3.698 1.00 0.00 O ATOM 89 N CYS A 23 0.263 13.925 -3.084 1.00 0.00 N ATOM 90 CA CYS A 23 0.356 12.935 -4.157 1.00 0.00 C ATOM 91 C CYS A 23 -0.955 12.790 -4.898 1.00 0.00 C ATOM 92 O CYS A 23 -1.300 13.609 -5.764 1.00 0.00 O ATOM 0 H CYS A 23 -0.567 13.837 -2.498 1.00 0.00 H new ATOM 93 N SER A 24 -1.720 11.767 -4.571 1.00 0.00 N ATOM 94 CA SER A 24 -2.939 11.434 -5.304 1.00 0.00 C ATOM 95 C SER A 24 -3.637 10.249 -4.679 1.00 0.00 C ATOM 96 O SER A 24 -2.998 9.353 -4.104 1.00 0.00 O ATOM 0 H SER A 24 -1.520 11.140 -3.792 1.00 0.00 H new ATOM 97 N PHE A 25 -4.955 10.224 -4.765 1.00 0.00 N ATOM 98 CA PHE A 25 -5.729 9.074 -4.299 1.00 0.00 C ATOM 99 C PHE A 25 -5.361 7.832 -5.074 1.00 0.00 C ATOM 100 O PHE A 25 -5.372 6.711 -4.537 1.00 0.00 O ATOM 0 H PHE A 25 -5.516 10.983 -5.152 1.00 0.00 H new ATOM 109 N ALA A 28 -2.595 5.005 -3.936 1.00 0.00 N ATOM 110 CA ALA A 28 -2.995 4.554 -2.596 1.00 0.00 C ATOM 111 C ALA A 28 -3.914 3.364 -2.731 1.00 0.00 C ATOM 112 O ALA A 28 -3.810 2.374 -2.002 1.00 0.00 O ATOM 113 N ARG A 29 -4.855 3.463 -3.647 1.00 0.00 N ATOM 114 CA ARG A 29 -5.699 2.326 -4.006 1.00 0.00 C ATOM 115 C ARG A 29 -4.909 1.067 -4.273 1.00 0.00 C ATOM 116 O ARG A 29 -5.415 -0.055 -4.048 1.00 0.00 O ATOM 0 H ARG A 29 -5.060 4.319 -4.162 1.00 0.00 H new ATOM 121 N VAL A 31 -1.863 0.111 -2.943 1.00 0.00 N ATOM 122 CA VAL A 31 -1.170 -0.430 -1.771 1.00 0.00 C ATOM 123 C VAL A 31 -2.153 -1.083 -0.829 1.00 0.00 C ATOM 124 O VAL A 31 -1.903 -2.167 -0.280 1.00 0.00 O ATOM 125 N PHE A 32 -3.284 -0.439 -0.607 1.00 0.00 N ATOM 126 CA PHE A 32 -4.374 -1.033 0.162 1.00 0.00 C ATOM 127 C PHE A 32 -5.040 -2.183 -0.567 1.00 0.00 C ATOM 128 O PHE A 32 -5.785 -2.974 0.042 1.00 0.00 O ATOM 0 H PHE A 32 -3.477 0.502 -0.949 1.00 0.00 H new ATOM 133 N ASN A 34 -7.592 -2.546 -2.192 1.00 0.00 N ATOM 134 CA ASN A 34 -9.053 -2.594 -2.116 1.00 0.00 C ATOM 135 C ASN A 34 -9.631 -1.203 -1.997 1.00 0.00 C ATOM 136 O ASN A 34 -9.223 -0.405 -1.140 1.00 0.00 O ATOM 137 N THR A 35 -10.574 -0.876 -2.860 1.00 0.00 N ATOM 138 CA THR A 35 -11.116 0.479 -2.937 1.00 0.00 C ATOM 139 C THR A 35 -11.592 0.976 -1.591 1.00 0.00 C ATOM 140 O THR A 35 -11.308 2.114 -1.188 1.00 0.00 O ATOM 0 H THR A 35 -10.987 -1.531 -3.524 1.00 0.00 H new ATOM 145 N ARG A 37 -10.780 0.381 1.467 1.00 0.00 N ATOM 146 CA ARG A 37 -9.629 0.868 2.226 1.00 0.00 C ATOM 147 C ARG A 37 -8.747 1.723 1.345 1.00 0.00 C ATOM 148 O ARG A 37 -7.935 1.213 0.568 1.00 0.00 O ATOM 149 N THR A 38 -8.852 3.028 1.495 1.00 0.00 N ATOM 150 CA THR A 38 -8.209 4.027 0.639 1.00 0.00 C ATOM 151 C THR A 38 -9.059 5.268 0.501 1.00 0.00 C ATOM 152 O THR A 38 -8.521 6.405 0.585 1.00 0.00 O ATOM 0 H THR A 38 -9.406 3.446 2.242 1.00 0.00 H new ATOM 153 N THR A 39 -10.347 5.172 0.248 1.00 0.00 N ATOM 154 CA THR A 39 -11.251 6.323 0.274 1.00 0.00 C ATOM 155 C THR A 39 -11.723 6.620 1.677 1.00 0.00 C ATOM 156 O THR A 39 -12.027 7.762 2.039 1.00 0.00 O ATOM 0 H THR A 39 -10.808 4.292 0.016 1.00 0.00 H new ATOM 161 N PHE A 41 -9.960 6.668 4.263 1.00 0.00 N ATOM 162 CA PHE A 41 -8.799 7.141 5.017 1.00 0.00 C ATOM 163 C PHE A 41 -8.263 8.401 4.362 1.00 0.00 C ATOM 164 O PHE A 41 -7.923 9.404 4.998 1.00 0.00 O ATOM 165 N TRP A 42 -8.170 8.347 3.043 1.00 0.00 N ATOM 166 CA TRP A 42 -7.836 9.507 2.225 1.00 0.00 C ATOM 167 C TRP A 42 -8.843 10.618 2.416 1.00 0.00 C ATOM 168 O TRP A 42 -8.585 11.789 2.095 1.00 0.00 O ATOM 0 H TRP A 42 -8.324 7.494 2.505 1.00 0.00 H new ATOM 169 N LYS A 43 -10.014 10.282 2.922 1.00 0.00 N ATOM 170 CA LYS A 43 -11.029 11.277 3.265 1.00 0.00 C ATOM 171 C LYS A 43 -10.489 12.273 4.263 1.00 0.00 C ATOM 172 O LYS A 43 -10.639 13.492 4.120 1.00 0.00 O ATOM 0 H LYS A 43 -10.294 9.319 3.109 1.00 0.00 H new ATOM 173 N GLN A 44 -9.832 11.765 5.290 1.00 0.00 N ATOM 174 CA GLN A 44 -9.248 12.607 6.328 1.00 0.00 C ATOM 175 C GLN A 44 -8.086 13.407 5.786 1.00 0.00 C ATOM 176 O GLN A 44 -7.906 14.592 6.095 1.00 0.00 O ATOM 0 H GLN A 44 -9.687 10.765 5.431 1.00 0.00 H new ATOM 177 N TYR A 45 -7.280 12.772 4.955 1.00 0.00 N ATOM 178 CA TYR A 45 -6.078 13.399 4.414 1.00 0.00 C ATOM 179 C TYR A 45 -6.412 14.644 3.628 1.00 0.00 C ATOM 180 O TYR A 45 -5.625 15.595 3.540 1.00 0.00 O ATOM 0 H TYR A 45 -7.434 11.816 4.636 1.00 0.00 H new ATOM 181 N VAL A 46 -7.584 14.652 3.025 1.00 0.00 N ATOM 182 CA VAL A 46 -8.072 15.807 2.272 1.00 0.00 C ATOM 183 C VAL A 46 -9.113 16.549 3.084 1.00 0.00 C ATOM 184 O VAL A 46 -9.038 16.614 4.321 1.00 0.00 O ATOM 0 H VAL A 46 -8.230 13.863 3.039 1.00 0.00 H new