USER MOD reduce.3.24.130724 H: found=0, std=0, add=57, rem=0, adj=0 USER MOD reduce.3.24.130724 removed 45 hydrogens (0 hets) ATOM 1 CA GLY A 1 19.601 -35.197 36.479 1.00 0.00 C ATOM 2 C GLY A 1 20.966 -35.855 36.366 1.00 0.00 C ATOM 3 N VAL A 2 21.912 -35.355 37.156 1.00 0.00 N ATOM 4 CA VAL A 2 23.276 -35.876 37.167 1.00 0.00 C ATOM 5 C VAL A 2 23.278 -37.351 37.536 1.00 0.00 C ATOM 6 O VAL A 2 23.886 -38.176 36.855 1.00 0.00 O ATOM 0 H VAL A 2 21.757 -34.582 37.803 1.00 0.00 H new ATOM 8 N ILE A 3 22.588 -37.672 38.627 1.00 0.00 N ATOM 9 CA ILE A 3 22.493 -39.045 39.114 1.00 0.00 C ATOM 10 C ILE A 3 21.707 -39.903 38.136 1.00 0.00 C ATOM 11 O ILE A 3 21.936 -41.106 38.018 1.00 0.00 O ATOM 0 H ILE A 3 22.082 -36.993 39.195 1.00 0.00 H new ATOM 13 N ASP A 4 20.773 -39.266 37.435 1.00 0.00 N ATOM 14 CA ASP A 4 19.933 -39.948 36.455 1.00 0.00 C ATOM 15 C ASP A 4 20.790 -40.670 35.428 1.00 0.00 C ATOM 16 O ASP A 4 20.588 -41.850 35.147 1.00 0.00 O ATOM 0 H ASP A 4 20.578 -38.269 37.529 1.00 0.00 H new ATOM 18 N THR A 5 21.754 -39.942 34.871 1.00 0.00 N ATOM 19 CA THR A 5 22.663 -40.488 33.868 1.00 0.00 C ATOM 20 C THR A 5 22.336 -41.946 33.590 1.00 0.00 C ATOM 21 O THR A 5 22.246 -42.370 32.439 1.00 0.00 O ATOM 0 H THR A 5 21.926 -38.963 35.100 1.00 0.00 H new ATOM 23 N SER A 6 22.158 -42.710 34.664 1.00 0.00 N ATOM 24 CA SER A 6 21.838 -44.131 34.567 1.00 0.00 C ATOM 25 C SER A 6 20.538 -44.333 33.807 1.00 0.00 C ATOM 26 O SER A 6 20.530 -44.830 32.681 1.00 0.00 O ATOM 0 H SER A 6 22.231 -42.364 35.621 1.00 0.00 H new ATOM 28 N ALA A 7 19.436 -43.940 34.439 1.00 0.00 N ATOM 29 CA ALA A 7 18.108 -44.066 33.843 1.00 0.00 C ATOM 30 C ALA A 7 17.974 -43.145 32.642 1.00 0.00 C ATOM 31 O ALA A 7 17.243 -43.436 31.696 1.00 0.00 O ATOM 0 H ALA A 7 19.437 -43.528 35.372 1.00 0.00 H new ATOM 33 N VAL A 8 18.692 -42.027 32.692 1.00 0.00 N ATOM 34 CA VAL A 8 18.673 -41.039 31.617 1.00 0.00 C ATOM 35 C VAL A 8 19.116 -41.669 30.307 1.00 0.00 C ATOM 36 O VAL A 8 18.526 -41.431 29.254 1.00 0.00 O ATOM 0 H VAL A 8 19.300 -41.781 33.473 1.00 0.00 H new ATOM 38 N GLU A 9 20.167 -42.481 30.386 1.00 0.00 N ATOM 39 CA GLU A 9 20.715 -43.163 29.217 1.00 0.00 C ATOM 40 C GLU A 9 19.603 -43.815 28.411 1.00 0.00 C ATOM 41 O GLU A 9 19.553 -43.700 27.188 1.00 0.00 O ATOM 0 H GLU A 9 20.660 -42.684 31.256 1.00 0.00 H new ATOM 43 N SER A 10 18.711 -44.504 29.116 1.00 0.00 N ATOM 44 CA SER A 10 17.583 -45.189 28.491 1.00 0.00 C ATOM 45 C SER A 10 16.737 -44.206 27.698 1.00 0.00 C ATOM 46 O SER A 10 16.362 -44.467 26.556 1.00 0.00 O ATOM 0 H SER A 10 18.748 -44.603 30.130 1.00 0.00 H new ATOM 48 N ALA A 11 16.441 -43.069 28.321 1.00 0.00 N ATOM 49 CA ALA A 11 15.637 -42.023 27.695 1.00 0.00 C ATOM 50 C ALA A 11 16.367 -41.436 26.497 1.00 0.00 C ATOM 51 O ALA A 11 15.753 -41.066 25.498 1.00 0.00 O ATOM 0 H ALA A 11 16.749 -42.847 29.268 1.00 0.00 H new ATOM 53 N ILE A 12 17.689 -41.357 26.612 1.00 0.00 N ATOM 54 CA ILE A 12 18.534 -40.818 25.550 1.00 0.00 C ATOM 55 C ILE A 12 18.421 -41.669 24.296 1.00 0.00 C ATOM 56 O ILE A 12 18.358 -41.154 23.181 1.00 0.00 O ATOM 0 H ILE A 12 18.203 -41.663 27.438 1.00 0.00 H new ATOM 58 N THR A 13 18.396 -42.984 24.495 1.00 0.00 N ATOM 59 CA THR A 13 18.291 -43.937 23.394 1.00 0.00 C ATOM 60 C THR A 13 16.955 -43.786 22.684 1.00 0.00 C ATOM 61 O THR A 13 16.862 -43.930 21.466 1.00 0.00 O ATOM 0 H THR A 13 18.448 -43.417 25.417 1.00 0.00 H new ATOM 63 N ASP A 14 15.920 -43.492 23.465 1.00 0.00 N ATOM 64 CA ASP A 14 14.570 -43.313 22.937 1.00 0.00 C ATOM 65 C ASP A 14 14.409 -41.921 22.348 1.00 0.00 C ATOM 66 O ASP A 14 14.197 -41.759 21.147 1.00 0.00 O ATOM 0 H ASP A 14 15.991 -43.372 24.475 1.00 0.00 H new ATOM 68 N GLY A 15 14.512 -40.916 23.213 1.00 0.00 N ATOM 69 CA GLY A 15 14.381 -39.520 22.805 1.00 0.00 C ATOM 70 C GLY A 15 15.440 -39.165 21.774 1.00 0.00 C ATOM 71 O GLY A 15 15.135 -38.923 20.607 1.00 0.00 O ATOM 0 H GLY A 15 14.687 -41.044 24.210 1.00 0.00 H new ATOM 0 HA2 GLY A 15 13.388 -39.348 22.389 1.00 0.00 H new ATOM 0 HA3 GLY A 15 14.479 -38.870 23.675 1.00 0.00 H new ATOM 73 N GLN A 16 16.692 -39.138 22.221 1.00 0.00 N ATOM 74 CA GLN A 16 17.822 -38.814 21.356 1.00 0.00 C ATOM 75 C GLN A 16 17.989 -39.874 20.278 1.00 0.00 C ATOM 76 O GLN A 16 18.239 -39.564 19.115 1.00 0.00 O ATOM 0 H GLN A 16 16.951 -39.339 23.187 1.00 0.00 H new ATOM 78 N GLY A 17 17.845 -41.133 20.684 1.00 0.00 N ATOM 79 CA GLY A 17 17.975 -42.265 19.771 1.00 0.00 C ATOM 80 C GLY A 17 16.868 -42.239 18.730 1.00 0.00 C ATOM 81 O GLY A 17 17.118 -42.372 17.533 1.00 0.00 O ATOM 0 H GLY A 17 17.637 -41.396 21.647 1.00 0.00 H new ATOM 0 HA2 GLY A 17 18.947 -42.232 19.278 1.00 0.00 H new ATOM 0 HA3 GLY A 17 17.933 -43.199 20.332 1.00 0.00 H new ATOM 83 N ASP A 18 15.637 -42.064 19.203 1.00 0.00 N ATOM 84 CA ASP A 18 14.466 -42.015 18.332 1.00 0.00 C ATOM 85 C ASP A 18 14.496 -40.764 17.470 1.00 0.00 C ATOM 86 O ASP A 18 13.836 -40.689 16.435 1.00 0.00 O ATOM 0 H ASP A 18 15.424 -41.953 20.194 1.00 0.00 H new ATOM 88 N MET A 19 15.274 -39.780 17.912 1.00 0.00 N ATOM 89 CA MET A 19 15.411 -38.514 17.198 1.00 0.00 C ATOM 90 C MET A 19 16.067 -38.734 15.845 1.00 0.00 C ATOM 91 O MET A 19 15.616 -38.212 14.826 1.00 0.00 O ATOM 0 H MET A 19 15.824 -39.836 18.769 1.00 0.00 H new ATOM 93 N LYS A 20 17.143 -39.516 15.848 1.00 0.00 N ATOM 94 CA LYS A 20 17.886 -39.826 14.630 1.00 0.00 C ATOM 95 C LYS A 20 16.993 -40.540 13.628 1.00 0.00 C ATOM 96 O LYS A 20 17.059 -40.290 12.426 1.00 0.00 O ATOM 0 H LYS A 20 17.523 -39.950 16.689 1.00 0.00 H new ATOM 98 N ALA A 21 16.156 -41.436 14.142 1.00 0.00 N ATOM 99 CA ALA A 21 15.233 -42.207 13.313 1.00 0.00 C ATOM 100 C ALA A 21 14.237 -41.285 12.628 1.00 0.00 C ATOM 101 O ALA A 21 13.887 -41.480 11.465 1.00 0.00 O ATOM 0 H ALA A 21 16.098 -41.648 15.138 1.00 0.00 H new ATOM 103 N ILE A 22 13.785 -40.276 13.367 1.00 0.00 N ATOM 104 CA ILE A 22 12.824 -39.304 12.854 1.00 0.00 C ATOM 105 C ILE A 22 13.446 -38.476 11.741 1.00 0.00 C ATOM 106 O ILE A 22 12.810 -38.193 10.728 1.00 0.00 O ATOM 0 H ILE A 22 14.072 -40.109 14.332 1.00 0.00 H new ATOM 108 N GLY A 23 14.703 -38.092 11.945 1.00 0.00 N ATOM 109 CA GLY A 23 15.442 -37.293 10.971 1.00 0.00 C ATOM 110 C GLY A 23 15.620 -38.065 9.674 1.00 0.00 C ATOM 111 O GLY A 23 15.520 -37.507 8.583 1.00 0.00 O ATOM 0 H GLY A 23 15.235 -38.324 12.784 1.00 0.00 H new ATOM 0 HA2 GLY A 23 14.909 -36.362 10.777 1.00 0.00 H new ATOM 0 HA3 GLY A 23 16.417 -37.024 11.377 1.00 0.00 H new ATOM 113 N GLY A 24 15.888 -39.360 9.809 1.00 0.00 N ATOM 114 CA GLY A 24 16.087 -40.240 8.660 1.00 0.00 C ATOM 115 C GLY A 24 14.769 -40.486 7.944 1.00 0.00 C ATOM 116 O GLY A 24 14.670 -40.342 6.726 1.00 0.00 O ATOM 0 H GLY A 24 15.973 -39.828 10.711 1.00 0.00 H new ATOM 0 HA2 GLY A 24 16.804 -39.793 7.971 1.00 0.00 H new ATOM 0 HA3 GLY A 24 16.511 -41.188 8.990 1.00 0.00 H new ATOM 118 N TYR A 25 13.755 -40.860 8.719 1.00 0.00 N ATOM 119 CA TYR A 25 12.424 -41.135 8.184 1.00 0.00 C ATOM 120 C TYR A 25 11.877 -39.913 7.464 1.00 0.00 C ATOM 121 O TYR A 25 11.307 -40.017 6.379 1.00 0.00 O ATOM 0 H TYR A 25 13.831 -40.981 9.729 1.00 0.00 H new ATOM 123 N ILE A 26 12.059 -38.751 8.084 1.00 0.00 N ATOM 124 CA ILE A 26 11.593 -37.486 7.524 1.00 0.00 C ATOM 125 C ILE A 26 12.290 -37.199 6.204 1.00 0.00 C ATOM 126 O ILE A 26 11.665 -36.776 5.233 1.00 0.00 O ATOM 0 H ILE A 26 12.531 -38.659 8.984 1.00 0.00 H new ATOM 128 N VAL A 27 13.599 -37.436 6.182 1.00 0.00 N ATOM 129 CA VAL A 27 14.412 -37.211 4.991 1.00 0.00 C ATOM 130 C VAL A 27 13.973 -38.133 3.865 1.00 0.00 C ATOM 131 O VAL A 27 13.960 -37.748 2.696 1.00 0.00 O ATOM 0 H VAL A 27 14.123 -37.787 6.984 1.00 0.00 H new ATOM 133 N GLY A 28 13.613 -39.359 4.233 1.00 0.00 N ATOM 134 CA GLY A 28 13.166 -40.362 3.271 1.00 0.00 C ATOM 135 C GLY A 28 11.992 -39.838 2.461 1.00 0.00 C ATOM 136 O GLY A 28 11.943 -39.989 1.241 1.00 0.00 O ATOM 0 H GLY A 28 13.622 -39.684 5.200 1.00 0.00 H new ATOM 0 HA2 GLY A 28 13.987 -40.625 2.604 1.00 0.00 H new ATOM 0 HA3 GLY A 28 12.876 -41.273 3.795 1.00 0.00 H new ATOM 138 N ALA A 29 11.044 -39.218 3.158 1.00 0.00 N ATOM 139 CA ALA A 29 9.852 -38.657 2.527 1.00 0.00 C ATOM 140 C ALA A 29 10.223 -37.478 1.642 1.00 0.00 C ATOM 141 O ALA A 29 9.679 -37.305 0.553 1.00 0.00 O ATOM 0 H ALA A 29 11.079 -39.090 4.169 1.00 0.00 H new ATOM 143 N LEU A 30 11.159 -36.667 2.128 1.00 0.00 N ATOM 144 CA LEU A 30 11.626 -35.491 1.400 1.00 0.00 C ATOM 145 C LEU A 30 12.227 -35.895 0.064 1.00 0.00 C ATOM 146 O LEU A 30 12.025 -35.230 -0.951 1.00 0.00 O ATOM 0 H LEU A 30 11.612 -36.805 3.031 1.00 0.00 H new ATOM 148 N VAL A 31 12.971 -36.997 0.079 1.00 0.00 N ATOM 149 CA VAL A 31 13.618 -37.517 -1.122 1.00 0.00 C ATOM 150 C VAL A 31 12.578 -37.943 -2.146 1.00 0.00 C ATOM 151 O VAL A 31 12.733 -37.712 -3.344 1.00 0.00 O ATOM 0 H VAL A 31 13.142 -37.552 0.918 1.00 0.00 H new ATOM 153 N ILE A 32 11.513 -38.570 -1.655 1.00 0.00 N ATOM 154 CA ILE A 32 10.425 -39.042 -2.507 1.00 0.00 C ATOM 155 C ILE A 32 9.742 -37.872 -3.197 1.00 0.00 C ATOM 156 O ILE A 32 9.430 -37.928 -4.385 1.00 0.00 O ATOM 0 H ILE A 32 11.380 -38.764 -0.663 1.00 0.00 H new ATOM 158 N LEU A 33 9.514 -36.808 -2.432 1.00 0.00 N ATOM 159 CA LEU A 33 8.868 -35.603 -2.944 1.00 0.00 C ATOM 160 C LEU A 33 9.721 -34.959 -4.024 1.00 0.00 C ATOM 161 O LEU A 33 9.224 -34.563 -5.077 1.00 0.00 O ATOM 0 H LEU A 33 9.770 -36.756 -1.446 1.00 0.00 H new ATOM 163 N ALA A 34 11.018 -34.859 -3.747 1.00 0.00 N ATOM 164 CA ALA A 34 11.971 -34.264 -4.680 1.00 0.00 C ATOM 165 C ALA A 34 11.896 -34.957 -6.031 1.00 0.00 C ATOM 166 O ALA A 34 12.150 -34.351 -7.071 1.00 0.00 O ATOM 0 H ALA A 34 11.436 -35.185 -2.876 1.00 0.00 H new ATOM 168 N VAL A 35 11.543 -36.238 -6.001 1.00 0.00 N ATOM 169 CA VAL A 35 11.426 -37.044 -7.213 1.00 0.00 C ATOM 170 C VAL A 35 10.414 -36.428 -8.166 1.00 0.00 C ATOM 171 O VAL A 35 10.555 -36.513 -9.385 1.00 0.00 O ATOM 0 H VAL A 35 11.331 -36.745 -5.142 1.00 0.00 H new ATOM 173 N ALA A 36 9.390 -35.803 -7.592 1.00 0.00 N ATOM 174 CA ALA A 36 8.334 -35.160 -8.368 1.00 0.00 C ATOM 175 C ALA A 36 8.877 -33.942 -9.097 1.00 0.00 C ATOM 176 O ALA A 36 8.531 -33.683 -10.249 1.00 0.00 O ATOM 0 H ALA A 36 9.269 -35.728 -6.582 1.00 0.00 H new ATOM 178 N GLY A 37 9.734 -33.194 -8.408 1.00 0.00 N ATOM 179 CA GLY A 37 10.344 -31.991 -8.966 1.00 0.00 C ATOM 180 C GLY A 37 11.021 -32.303 -10.291 1.00 0.00 C ATOM 181 O GLY A 37 10.807 -31.620 -11.291 1.00 0.00 O ATOM 0 H GLY A 37 10.024 -33.403 -7.453 1.00 0.00 H new ATOM 0 HA2 GLY A 37 9.583 -31.224 -9.111 1.00 0.00 H new ATOM 0 HA3 GLY A 37 11.074 -31.587 -8.264 1.00 0.00 H new ATOM 183 N LEU A 38 11.843 -33.349 -10.285 1.00 0.00 N ATOM 184 CA LEU A 38 12.568 -33.779 -11.476 1.00 0.00 C ATOM 185 C LEU A 38 11.600 -34.252 -12.548 1.00 0.00 C ATOM 186 O LEU A 38 11.720 -33.891 -13.718 1.00 0.00 O ATOM 0 H LEU A 38 12.024 -33.919 -9.459 1.00 0.00 H new ATOM 188 N ILE A 39 10.635 -35.066 -12.131 1.00 0.00 N ATOM 189 CA ILE A 39 9.625 -35.608 -13.036 1.00 0.00 C ATOM 190 C ILE A 39 8.909 -34.485 -13.768 1.00 0.00 C ATOM 191 O ILE A 39 8.733 -34.528 -14.985 1.00 0.00 O ATOM 0 H ILE A 39 10.531 -35.368 -11.162 1.00 0.00 H new ATOM 193 N TYR A 40 8.497 -33.474 -13.008 1.00 0.00 N ATOM 194 CA TYR A 40 7.794 -32.320 -13.559 1.00 0.00 C ATOM 195 C TYR A 40 8.699 -31.545 -14.502 1.00 0.00 C ATOM 196 O TYR A 40 8.288 -31.139 -15.588 1.00 0.00 O ATOM 0 H TYR A 40 8.640 -33.432 -11.999 1.00 0.00 H new ATOM 198 N SER A 41 9.942 -31.345 -14.072 1.00 0.00 N ATOM 199 CA SER A 41 10.934 -30.620 -14.860 1.00 0.00 C ATOM 200 C SER A 41 11.168 -31.315 -16.191 1.00 0.00 C ATOM 201 O SER A 41 11.317 -30.671 -17.228 1.00 0.00 O ATOM 0 H SER A 41 10.288 -31.679 -13.173 1.00 0.00 H new ATOM 203 N MET A 42 11.199 -32.644 -16.147 1.00 0.00 N ATOM 204 CA MET A 42 11.415 -33.459 -17.340 1.00 0.00 C ATOM 205 C MET A 42 10.227 -33.349 -18.282 1.00 0.00 C ATOM 206 O MET A 42 10.386 -33.249 -19.497 1.00 0.00 O ATOM 0 H MET A 42 11.076 -33.184 -15.290 1.00 0.00 H new ATOM 208 N LEU A 43 9.030 -33.368 -17.702 1.00 0.00 N ATOM 209 CA LEU A 43 7.791 -33.272 -18.468 1.00 0.00 C ATOM 210 C LEU A 43 7.573 -31.847 -18.950 1.00 0.00 C ATOM 211 O LEU A 43 7.036 -31.617 -20.032 1.00 0.00 O ATOM 0 H LEU A 43 8.892 -33.450 -16.695 1.00 0.00 H new ATOM 213 N ARG A 44 7.998 -30.891 -18.129 1.00 0.00 N ATOM 214 CA ARG A 44 7.862 -29.472 -18.447 1.00 0.00 C ATOM 215 C ARG A 44 8.945 -29.039 -19.421 1.00 0.00 C ATOM 216 O ARG A 44 8.800 -28.047 -20.134 1.00 0.00 O ATOM 0 H ARG A 44 8.444 -31.076 -17.230 1.00 0.00 H new ATOM 218 N LYS A 45 10.037 -29.798 -19.442 1.00 0.00 N ATOM 219 CA LYS A 45 11.167 -29.516 -20.322 1.00 0.00 C ATOM 220 C LYS A 45 11.188 -30.488 -21.490 1.00 0.00 C ATOM 221 O LYS A 45 11.603 -30.145 -22.596 1.00 0.00 O ATOM 0 H LYS A 45 10.163 -30.621 -18.853 1.00 0.00 H new ATOM 223 N ALA A 46 10.734 -31.710 -21.229 1.00 0.00 N ATOM 224 CA ALA A 46 10.688 -32.759 -22.243 1.00 0.00 C ATOM 0 H ALA A 46 10.389 -32.000 -20.314 1.00 0.00 H new