USER MOD reduce.3.24.130724 H: found=0, std=0, add=57, rem=0, adj=0 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) ATOM 1 CA GLY A 1 -11.318 8.443 27.815 1.00 0.00 C ATOM 2 C GLY A 1 -10.388 8.853 26.685 1.00 0.00 C ATOM 3 N VAL A 2 -10.098 10.150 26.620 1.00 0.00 N ATOM 4 CA VAL A 2 -9.219 10.702 25.594 1.00 0.00 C ATOM 5 C VAL A 2 -7.784 10.257 25.825 1.00 0.00 C ATOM 0 H VAL A 2 -10.463 10.844 27.273 1.00 0.00 H new ATOM 6 N ILE A 3 -7.360 10.316 27.084 1.00 0.00 N ATOM 7 CA ILE A 3 -6.009 9.923 27.471 1.00 0.00 C ATOM 8 C ILE A 3 -5.808 8.431 27.263 1.00 0.00 C ATOM 0 H ILE A 3 -7.939 10.636 27.860 1.00 0.00 H new ATOM 9 N ASP A 4 -6.841 7.661 27.591 1.00 0.00 N ATOM 10 CA ASP A 4 -6.807 6.209 27.451 1.00 0.00 C ATOM 11 C ASP A 4 -6.375 5.819 26.046 1.00 0.00 C ATOM 0 H ASP A 4 -7.721 8.023 27.959 1.00 0.00 H new ATOM 12 N THR A 5 -6.886 6.557 25.063 1.00 0.00 N ATOM 13 CA THR A 5 -6.570 6.311 23.659 1.00 0.00 C ATOM 14 C THR A 5 -5.423 7.201 23.208 1.00 0.00 C ATOM 0 H THR A 5 -7.526 7.336 25.216 1.00 0.00 H new ATOM 15 N SER A 6 -4.945 8.033 24.129 1.00 0.00 N ATOM 16 CA SER A 6 -3.845 8.952 23.853 1.00 0.00 C ATOM 17 C SER A 6 -2.694 8.220 23.181 1.00 0.00 C ATOM 0 H SER A 6 -5.306 8.089 25.081 1.00 0.00 H new ATOM 18 N ALA A 7 -2.163 7.221 23.880 1.00 0.00 N ATOM 19 CA ALA A 7 -1.052 6.420 23.374 1.00 0.00 C ATOM 20 C ALA A 7 -1.441 5.728 22.077 1.00 0.00 C ATOM 0 H ALA A 7 -2.488 6.945 24.807 1.00 0.00 H new ATOM 21 N VAL A 8 -2.667 5.213 22.046 1.00 0.00 N ATOM 22 CA VAL A 8 -3.191 4.518 20.874 1.00 0.00 C ATOM 23 C VAL A 8 -3.276 5.464 19.688 1.00 0.00 C ATOM 0 H VAL A 8 -3.321 5.265 22.827 1.00 0.00 H new ATOM 24 N GLU A 9 -3.725 6.687 19.958 1.00 0.00 N ATOM 25 CA GLU A 9 -3.864 7.713 18.928 1.00 0.00 C ATOM 26 C GLU A 9 -2.535 7.951 18.231 1.00 0.00 C ATOM 0 H GLU A 9 -4.001 6.994 20.891 1.00 0.00 H new ATOM 27 N SER A 10 -1.463 7.933 19.017 1.00 0.00 N ATOM 28 CA SER A 10 -0.113 8.145 18.501 1.00 0.00 C ATOM 29 C SER A 10 0.435 6.862 17.900 1.00 0.00 C ATOM 0 H SER A 10 -1.504 7.772 20.023 1.00 0.00 H new ATOM 30 N ALA A 11 0.299 5.771 18.651 1.00 0.00 N ATOM 31 CA ALA A 11 0.773 4.461 18.216 1.00 0.00 C ATOM 32 C ALA A 11 -0.028 3.974 17.020 1.00 0.00 C ATOM 0 H ALA A 11 -0.140 5.770 19.572 1.00 0.00 H new ATOM 33 N ILE A 12 -1.332 4.236 17.056 1.00 0.00 N ATOM 34 CA ILE A 12 -2.238 3.836 15.985 1.00 0.00 C ATOM 35 C ILE A 12 -1.932 4.607 14.712 1.00 0.00 C ATOM 0 H ILE A 12 -1.788 4.729 17.824 1.00 0.00 H new ATOM 36 N THR A 13 -1.751 5.917 14.863 1.00 0.00 N ATOM 37 CA THR A 13 -1.450 6.798 13.738 1.00 0.00 C ATOM 38 C THR A 13 -0.101 6.445 13.132 1.00 0.00 C ATOM 0 H THR A 13 -1.808 6.395 15.762 1.00 0.00 H new ATOM 39 N ASP A 14 0.870 6.181 14.003 1.00 0.00 N ATOM 40 CA ASP A 14 2.221 5.826 13.581 1.00 0.00 C ATOM 41 C ASP A 14 2.230 4.458 12.920 1.00 0.00 C ATOM 0 H ASP A 14 0.743 6.207 15.015 1.00 0.00 H new ATOM 42 N GLY A 15 1.624 3.488 13.598 1.00 0.00 N ATOM 43 CA GLY A 15 1.546 2.118 13.098 1.00 0.00 C ATOM 44 C GLY A 15 0.389 1.972 12.123 1.00 0.00 C ATOM 0 H GLY A 15 1.176 3.627 14.504 1.00 0.00 H new ATOM 0 HA2 GLY A 15 2.481 1.851 12.605 1.00 0.00 H new ATOM 0 HA3 GLY A 15 1.416 1.427 13.931 1.00 0.00 H new ATOM 45 N GLN A 16 -0.826 2.083 12.652 1.00 0.00 N ATOM 46 CA GLN A 16 -2.040 1.968 11.850 1.00 0.00 C ATOM 47 C GLN A 16 -1.944 2.843 10.610 1.00 0.00 C ATOM 0 H GLN A 16 -0.997 2.254 13.643 1.00 0.00 H new ATOM 48 N GLY A 17 -1.669 4.125 10.832 1.00 0.00 N ATOM 49 CA GLY A 17 -1.544 5.094 9.747 1.00 0.00 C ATOM 50 C GLY A 17 -0.584 4.584 8.685 1.00 0.00 C ATOM 0 H GLY A 17 -1.527 4.520 11.762 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -2.522 5.279 9.303 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -1.187 6.046 10.141 1.00 0.00 H new ATOM 51 N ASP A 18 0.568 4.096 9.138 1.00 0.00 N ATOM 52 CA ASP A 18 1.596 3.567 8.246 1.00 0.00 C ATOM 53 C ASP A 18 1.022 2.467 7.367 1.00 0.00 C ATOM 0 H ASP A 18 0.814 4.056 10.127 1.00 0.00 H new ATOM 54 N MET A 19 -0.157 1.984 7.746 1.00 0.00 N ATOM 55 CA MET A 19 -0.841 0.926 7.009 1.00 0.00 C ATOM 56 C MET A 19 -1.223 1.407 5.619 1.00 0.00 C ATOM 0 H MET A 19 -0.663 2.313 8.568 1.00 0.00 H new ATOM 57 N LYS A 20 -1.723 2.637 5.554 1.00 0.00 N ATOM 58 CA LYS A 20 -2.138 3.245 4.293 1.00 0.00 C ATOM 59 C LYS A 20 -0.979 3.276 3.310 1.00 0.00 C ATOM 0 H LYS A 20 -1.852 3.238 6.368 1.00 0.00 H new ATOM 60 N ALA A 21 0.201 3.617 3.823 1.00 0.00 N ATOM 61 CA ALA A 21 1.412 3.693 3.011 1.00 0.00 C ATOM 62 C ALA A 21 1.834 2.307 2.553 1.00 0.00 C ATOM 0 H ALA A 21 0.344 3.847 4.806 1.00 0.00 H new ATOM 63 N ILE A 22 1.739 1.345 3.468 1.00 0.00 N ATOM 64 CA ILE A 22 2.106 -0.039 3.185 1.00 0.00 C ATOM 65 C ILE A 22 1.191 -0.626 2.123 1.00 0.00 C ATOM 0 H ILE A 22 1.408 1.502 4.420 1.00 0.00 H new ATOM 66 N GLY A 23 -0.111 -0.453 2.327 1.00 0.00 N ATOM 67 CA GLY A 23 -1.121 -0.956 1.399 1.00 0.00 C ATOM 68 C GLY A 23 -1.031 -0.227 0.068 1.00 0.00 C ATOM 0 H GLY A 23 -0.495 0.037 3.135 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -0.981 -2.026 1.245 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -2.115 -0.823 1.827 1.00 0.00 H new ATOM 69 N GLY A 24 -0.886 1.093 0.145 1.00 0.00 N ATOM 70 CA GLY A 24 -0.785 1.936 -1.042 1.00 0.00 C ATOM 71 C GLY A 24 0.515 1.663 -1.781 1.00 0.00 C ATOM 0 H GLY A 24 -0.835 1.605 1.026 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -1.632 1.747 -1.702 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -0.833 2.986 -0.754 1.00 0.00 H new ATOM 72 N TYR A 25 1.623 1.769 -1.053 1.00 0.00 N ATOM 73 CA TYR A 25 2.950 1.538 -1.615 1.00 0.00 C ATOM 74 C TYR A 25 3.029 0.157 -2.244 1.00 0.00 C ATOM 0 H TYR A 25 1.627 2.016 -0.063 1.00 0.00 H new ATOM 75 N ILE A 26 2.415 -0.815 -1.576 1.00 0.00 N ATOM 76 CA ILE A 26 2.399 -2.197 -2.048 1.00 0.00 C ATOM 77 C ILE A 26 1.440 -2.348 -3.218 1.00 0.00 C ATOM 0 H ILE A 26 1.917 -0.669 -0.698 1.00 0.00 H new ATOM 78 N VAL A 27 0.258 -1.757 -3.072 1.00 0.00 N ATOM 79 CA VAL A 27 -0.774 -1.810 -4.105 1.00 0.00 C ATOM 80 C VAL A 27 -0.421 -0.881 -5.256 1.00 0.00 C ATOM 0 H VAL A 27 -0.011 -1.231 -2.241 1.00 0.00 H new ATOM 81 N GLY A 28 0.276 0.202 -4.928 1.00 0.00 N ATOM 82 CA GLY A 28 0.692 1.192 -5.917 1.00 0.00 C ATOM 83 C GLY A 28 1.852 0.662 -6.745 1.00 0.00 C ATOM 0 H GLY A 28 0.567 0.418 -3.975 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -0.146 1.437 -6.569 1.00 0.00 H new ATOM 0 HA3 GLY A 28 0.987 2.114 -5.416 1.00 0.00 H new ATOM 84 N ALA A 29 2.581 -0.289 -6.169 1.00 0.00 N ATOM 85 CA ALA A 29 3.729 -0.900 -6.831 1.00 0.00 C ATOM 86 C ALA A 29 3.279 -2.037 -7.736 1.00 0.00 C ATOM 0 H ALA A 29 2.394 -0.656 -5.236 1.00 0.00 H new ATOM 87 N LEU A 30 2.218 -2.719 -7.315 1.00 0.00 N ATOM 88 CA LEU A 30 1.662 -3.839 -8.070 1.00 0.00 C ATOM 89 C LEU A 30 1.324 -3.409 -9.488 1.00 0.00 C ATOM 0 H LEU A 30 1.722 -2.514 -6.448 1.00 0.00 H new ATOM 90 N VAL A 31 0.963 -2.137 -9.633 1.00 0.00 N ATOM 91 CA VAL A 31 0.608 -1.569 -10.931 1.00 0.00 C ATOM 92 C VAL A 31 1.728 -1.791 -11.933 1.00 0.00 C ATOM 0 H VAL A 31 0.908 -1.474 -8.860 1.00 0.00 H new ATOM 93 N ILE A 32 2.962 -1.731 -11.439 1.00 0.00 N ATOM 94 CA ILE A 32 4.146 -1.922 -12.272 1.00 0.00 C ATOM 95 C ILE A 32 4.195 -3.343 -12.810 1.00 0.00 C ATOM 0 H ILE A 32 3.169 -1.550 -10.457 1.00 0.00 H new ATOM 96 N LEU A 33 3.878 -4.298 -11.940 1.00 0.00 N ATOM 97 CA LEU A 33 3.878 -5.713 -12.301 1.00 0.00 C ATOM 98 C LEU A 33 2.855 -5.983 -13.392 1.00 0.00 C ATOM 0 H LEU A 33 3.616 -4.115 -10.971 1.00 0.00 H new ATOM 99 N ALA A 34 1.646 -5.469 -13.186 1.00 0.00 N ATOM 100 CA ALA A 34 0.553 -5.640 -14.140 1.00 0.00 C ATOM 101 C ALA A 34 0.934 -5.067 -15.495 1.00 0.00 C ATOM 0 H ALA A 34 1.397 -4.926 -12.359 1.00 0.00 H new ATOM 102 N VAL A 35 1.589 -3.910 -15.466 1.00 0.00 N ATOM 103 CA VAL A 35 2.026 -3.230 -16.682 1.00 0.00 C ATOM 104 C VAL A 35 2.896 -4.149 -17.523 1.00 0.00 C ATOM 0 H VAL A 35 1.831 -3.420 -14.605 1.00 0.00 H new ATOM 105 N ALA A 36 3.805 -4.850 -16.853 1.00 0.00 N ATOM 106 CA ALA A 36 4.718 -5.778 -17.515 1.00 0.00 C ATOM 107 C ALA A 36 3.948 -6.935 -18.129 1.00 0.00 C ATOM 0 H ALA A 36 3.930 -4.792 -15.842 1.00 0.00 H new ATOM 108 N GLY A 37 3.029 -7.494 -17.347 1.00 0.00 N ATOM 109 CA GLY A 37 2.205 -8.615 -17.788 1.00 0.00 C ATOM 110 C GLY A 37 1.590 -8.321 -19.147 1.00 0.00 C ATOM 0 H GLY A 37 2.835 -7.185 -16.395 1.00 0.00 H new ATOM 0 HA2 GLY A 37 2.811 -9.519 -17.844 1.00 0.00 H new ATOM 0 HA3 GLY A 37 1.417 -8.804 -17.059 1.00 0.00 H new ATOM 111 N LEU A 38 0.802 -7.251 -19.201 1.00 0.00 N ATOM 112 CA LEU A 38 0.135 -6.834 -20.432 1.00 0.00 C ATOM 113 C LEU A 38 1.159 -6.523 -21.511 1.00 0.00 C ATOM 0 H LEU A 38 0.608 -6.652 -18.399 1.00 0.00 H new ATOM 114 N ILE A 39 2.254 -5.891 -21.100 1.00 0.00 N ATOM 115 CA ILE A 39 3.332 -5.522 -22.013 1.00 0.00 C ATOM 116 C ILE A 39 3.887 -6.753 -22.708 1.00 0.00 C ATOM 0 H ILE A 39 2.419 -5.621 -20.130 1.00 0.00 H new ATOM 117 N TYR A 40 4.096 -7.808 -21.926 1.00 0.00 N ATOM 118 CA TYR A 40 4.626 -9.068 -22.441 1.00 0.00 C ATOM 119 C TYR A 40 3.608 -9.746 -23.342 1.00 0.00 C ATOM 0 H TYR A 40 3.905 -7.815 -20.924 1.00 0.00 H new ATOM 120 N SER A 41 2.348 -9.712 -22.914 1.00 0.00 N ATOM 121 CA SER A 41 1.253 -10.317 -23.665 1.00 0.00 C ATOM 122 C SER A 41 1.139 -9.686 -25.043 1.00 0.00 C ATOM 0 H SER A 41 2.060 -9.267 -22.043 1.00 0.00 H new ATOM 123 N MET A 42 1.113 -8.356 -25.065 1.00 0.00 N ATOM 124 CA MET A 42 1.008 -7.599 -26.309 1.00 0.00 C ATOM 125 C MET A 42 2.229 -7.834 -27.182 1.00 0.00 C ATOM 0 H MET A 42 1.164 -7.776 -24.227 1.00 0.00 H new ATOM 126 N LEU A 43 3.395 -7.861 -26.543 1.00 0.00 N ATOM 127 CA LEU A 43 4.661 -8.077 -27.237 1.00 0.00 C ATOM 128 C LEU A 43 4.811 -9.538 -27.628 1.00 0.00 C ATOM 0 H LEU A 43 3.489 -7.735 -25.535 1.00 0.00 H new ATOM 129 N ARG A 44 4.401 -10.421 -26.722 1.00 0.00 N ATOM 130 CA ARG A 44 4.478 -11.861 -26.945 1.00 0.00 C ATOM 131 C ARG A 44 3.291 -12.337 -27.766 1.00 0.00 C ATOM 0 H ARG A 44 4.008 -10.160 -25.817 1.00 0.00 H new ATOM 132 N LYS A 45 2.151 -11.683 -27.560 1.00 0.00 N ATOM 133 CA LYS A 45 0.920 -12.018 -28.270 1.00 0.00 C ATOM 134 C LYS A 45 0.994 -11.551 -29.714 1.00 0.00 C ATOM 0 H LYS A 45 2.054 -10.911 -26.901 1.00 0.00 H new ATOM 135 N ALA A 46 1.441 -10.311 -29.895 1.00 0.00 N ATOM 136 CA ALA A 46 1.571 -9.714 -31.221 1.00 0.00 C ATOM 0 H ALA A 46 1.722 -9.695 -29.132 1.00 0.00 H new TER 137 ALA A 46