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 23.449 -10.532 73.079 1.00 0.00 C ATOM 2 C GLY A 1 24.516 -9.456 72.966 1.00 0.00 C ATOM 3 N VAL A 2 24.351 -8.398 73.756 1.00 0.00 N ATOM 4 CA VAL A 2 25.289 -7.279 73.767 1.00 0.00 C ATOM 5 C VAL A 2 26.684 -7.757 74.136 1.00 0.00 C ATOM 6 O VAL A 2 27.662 -7.452 73.455 1.00 0.00 O ATOM 0 H VAL A 2 23.569 -8.292 74.402 1.00 0.00 H new ATOM 8 N ILE A 3 26.762 -8.514 75.227 1.00 0.00 N ATOM 9 CA ILE A 3 28.029 -9.052 75.714 1.00 0.00 C ATOM 10 C ILE A 3 28.584 -10.075 74.736 1.00 0.00 C ATOM 11 O ILE A 3 29.796 -10.250 74.618 1.00 0.00 O ATOM 0 H ILE A 3 25.955 -8.771 75.795 1.00 0.00 H new ATOM 13 N ASP A 4 27.678 -10.750 74.035 1.00 0.00 N ATOM 14 CA ASP A 4 28.049 -11.767 73.055 1.00 0.00 C ATOM 15 C ASP A 4 29.011 -11.191 72.028 1.00 0.00 C ATOM 16 O ASP A 4 30.061 -11.767 71.747 1.00 0.00 O ATOM 0 H ASP A 4 26.672 -10.609 74.129 1.00 0.00 H new ATOM 18 N THR A 5 28.637 -10.043 71.471 1.00 0.00 N ATOM 19 CA THR A 5 29.449 -9.361 70.468 1.00 0.00 C ATOM 20 C THR A 5 30.721 -10.146 70.190 1.00 0.00 C ATOM 21 O THR A 5 31.093 -10.369 69.039 1.00 0.00 O ATOM 0 H THR A 5 27.768 -9.561 71.700 1.00 0.00 H new ATOM 23 N SER A 6 31.385 -10.563 71.264 1.00 0.00 N ATOM 24 CA SER A 6 32.625 -11.328 71.167 1.00 0.00 C ATOM 25 C SER A 6 32.392 -12.623 70.407 1.00 0.00 C ATOM 26 O SER A 6 32.859 -12.793 69.281 1.00 0.00 O ATOM 0 H SER A 6 31.081 -10.382 72.221 1.00 0.00 H new ATOM 28 N ALA A 7 31.661 -13.538 71.039 1.00 0.00 N ATOM 29 CA ALA A 7 31.348 -14.833 70.443 1.00 0.00 C ATOM 30 C ALA A 7 30.433 -14.660 69.242 1.00 0.00 C ATOM 31 O ALA A 7 30.470 -15.446 68.296 1.00 0.00 O ATOM 0 H ALA A 7 31.272 -13.404 71.972 1.00 0.00 H new ATOM 33 N VAL A 8 29.610 -13.617 69.292 1.00 0.00 N ATOM 34 CA VAL A 8 28.670 -13.313 68.217 1.00 0.00 C ATOM 35 C VAL A 8 29.410 -13.100 66.907 1.00 0.00 C ATOM 36 O VAL A 8 28.992 -13.580 65.854 1.00 0.00 O ATOM 0 H VAL A 8 29.575 -12.962 70.073 1.00 0.00 H new ATOM 38 N GLU A 9 30.520 -12.370 66.986 1.00 0.00 N ATOM 39 CA GLU A 9 31.344 -12.075 65.817 1.00 0.00 C ATOM 40 C GLU A 9 31.598 -13.338 65.011 1.00 0.00 C ATOM 41 O GLU A 9 31.472 -13.349 63.788 1.00 0.00 O ATOM 0 H GLU A 9 30.872 -11.969 67.855 1.00 0.00 H new ATOM 43 N SER A 10 31.958 -14.407 65.716 1.00 0.00 N ATOM 44 CA SER A 10 32.238 -15.696 65.091 1.00 0.00 C ATOM 45 C SER A 10 31.033 -16.176 64.298 1.00 0.00 C ATOM 46 O SER A 10 31.157 -16.615 63.156 1.00 0.00 O ATOM 0 H SER A 10 32.063 -14.405 66.731 1.00 0.00 H new ATOM 48 N ALA A 11 29.862 -16.085 64.921 1.00 0.00 N ATOM 49 CA ALA A 11 28.611 -16.504 64.295 1.00 0.00 C ATOM 50 C ALA A 11 28.294 -15.623 63.097 1.00 0.00 C ATOM 51 O ALA A 11 27.744 -16.082 62.098 1.00 0.00 O ATOM 0 H ALA A 11 29.753 -15.721 65.868 1.00 0.00 H new ATOM 53 N ILE A 12 28.650 -14.347 63.212 1.00 0.00 N ATOM 54 CA ILE A 12 28.415 -13.373 62.150 1.00 0.00 C ATOM 55 C ILE A 12 29.183 -13.757 60.896 1.00 0.00 C ATOM 56 O ILE A 12 28.676 -13.648 59.781 1.00 0.00 O ATOM 0 H ILE A 12 29.107 -13.960 64.038 1.00 0.00 H new ATOM 58 N THR A 13 30.418 -14.209 61.095 1.00 0.00 N ATOM 59 CA THR A 13 31.285 -14.619 59.994 1.00 0.00 C ATOM 60 C THR A 13 30.707 -15.832 59.284 1.00 0.00 C ATOM 61 O THR A 13 30.812 -15.967 58.066 1.00 0.00 O ATOM 0 H THR A 13 30.844 -14.301 62.017 1.00 0.00 H new ATOM 63 N ASP A 14 30.091 -16.715 60.065 1.00 0.00 N ATOM 64 CA ASP A 14 29.483 -17.933 59.537 1.00 0.00 C ATOM 65 C ASP A 14 28.114 -17.632 58.948 1.00 0.00 C ATOM 66 O ASP A 14 27.892 -17.779 57.747 1.00 0.00 O ATOM 0 H ASP A 14 29.999 -16.608 61.075 1.00 0.00 H new ATOM 68 N GLY A 15 27.197 -17.207 59.813 1.00 0.00 N ATOM 69 CA GLY A 15 25.835 -16.875 59.405 1.00 0.00 C ATOM 70 C GLY A 15 25.844 -15.759 58.374 1.00 0.00 C ATOM 71 O GLY A 15 25.516 -15.969 57.207 1.00 0.00 O ATOM 0 H GLY A 15 27.375 -17.084 60.810 1.00 0.00 H new ATOM 0 HA2 GLY A 15 25.348 -17.758 58.990 1.00 0.00 H new ATOM 0 HA3 GLY A 15 25.253 -16.570 60.275 1.00 0.00 H new ATOM 73 N GLN A 16 26.227 -14.566 58.821 1.00 0.00 N ATOM 74 CA GLN A 16 26.289 -13.392 57.956 1.00 0.00 C ATOM 75 C GLN A 16 27.345 -13.580 56.878 1.00 0.00 C ATOM 76 O GLN A 16 27.134 -13.243 55.715 1.00 0.00 O ATOM 0 H GLN A 16 26.501 -14.387 59.787 1.00 0.00 H new ATOM 78 N GLY A 17 28.489 -14.126 57.284 1.00 0.00 N ATOM 79 CA GLY A 17 29.601 -14.373 56.371 1.00 0.00 C ATOM 80 C GLY A 17 29.216 -15.410 55.330 1.00 0.00 C ATOM 81 O GLY A 17 29.423 -15.218 54.133 1.00 0.00 O ATOM 0 H GLY A 17 28.670 -14.408 58.247 1.00 0.00 H new ATOM 0 HA2 GLY A 17 29.888 -13.444 55.878 1.00 0.00 H new ATOM 0 HA3 GLY A 17 30.470 -14.718 56.932 1.00 0.00 H new ATOM 83 N ASP A 18 28.650 -16.517 55.803 1.00 0.00 N ATOM 84 CA ASP A 18 28.222 -17.608 54.932 1.00 0.00 C ATOM 85 C ASP A 18 27.049 -17.172 54.070 1.00 0.00 C ATOM 86 O ASP A 18 26.762 -17.772 53.035 1.00 0.00 O ATOM 0 H ASP A 18 28.476 -16.683 56.794 1.00 0.00 H new ATOM 88 N MET A 19 26.372 -16.116 54.512 1.00 0.00 N ATOM 89 CA MET A 19 25.219 -15.574 53.798 1.00 0.00 C ATOM 90 C MET A 19 25.641 -15.025 52.445 1.00 0.00 C ATOM 91 O MET A 19 25.001 -15.282 51.426 1.00 0.00 O ATOM 0 H MET A 19 26.605 -15.614 55.369 1.00 0.00 H new ATOM 93 N LYS A 20 26.731 -14.264 52.448 1.00 0.00 N ATOM 94 CA LYS A 20 27.266 -13.662 51.230 1.00 0.00 C ATOM 95 C LYS A 20 27.651 -14.738 50.228 1.00 0.00 C ATOM 96 O LYS A 20 27.435 -14.595 49.026 1.00 0.00 O ATOM 0 H LYS A 20 27.266 -14.048 53.289 1.00 0.00 H new ATOM 98 N ALA A 21 28.225 -15.822 50.742 1.00 0.00 N ATOM 99 CA ALA A 21 28.653 -16.946 49.913 1.00 0.00 C ATOM 100 C ALA A 21 27.457 -17.587 49.228 1.00 0.00 C ATOM 101 O ALA A 21 27.527 -17.982 48.065 1.00 0.00 O ATOM 0 H ALA A 21 28.406 -15.947 51.738 1.00 0.00 H new ATOM 103 N ILE A 22 26.356 -17.686 49.967 1.00 0.00 N ATOM 104 CA ILE A 22 25.123 -18.277 49.454 1.00 0.00 C ATOM 105 C ILE A 22 24.544 -17.419 48.341 1.00 0.00 C ATOM 106 O ILE A 22 24.068 -17.928 47.328 1.00 0.00 O ATOM 0 H ILE A 22 26.292 -17.361 50.932 1.00 0.00 H new ATOM 108 N GLY A 23 24.590 -16.106 48.545 1.00 0.00 N ATOM 109 CA GLY A 23 24.075 -15.147 47.571 1.00 0.00 C ATOM 110 C GLY A 23 24.863 -15.230 46.274 1.00 0.00 C ATOM 111 O GLY A 23 24.302 -15.143 45.183 1.00 0.00 O ATOM 0 H GLY A 23 24.982 -15.678 49.384 1.00 0.00 H new ATOM 0 HA2 GLY A 23 23.021 -15.347 47.377 1.00 0.00 H new ATOM 0 HA3 GLY A 23 24.138 -14.138 47.978 1.00 0.00 H new ATOM 113 N GLY A 24 26.175 -15.399 46.409 1.00 0.00 N ATOM 114 CA GLY A 24 27.071 -15.498 45.260 1.00 0.00 C ATOM 115 C GLY A 24 26.874 -16.824 44.544 1.00 0.00 C ATOM 116 O GLY A 24 26.706 -16.871 43.326 1.00 0.00 O ATOM 0 H GLY A 24 26.645 -15.471 47.311 1.00 0.00 H new ATOM 0 HA2 GLY A 24 26.881 -14.675 44.571 1.00 0.00 H new ATOM 0 HA3 GLY A 24 28.106 -15.406 45.589 1.00 0.00 H new ATOM 118 N TYR A 25 26.898 -17.905 45.319 1.00 0.00 N ATOM 119 CA TYR A 25 26.724 -19.252 44.784 1.00 0.00 C ATOM 120 C TYR A 25 25.391 -19.371 44.064 1.00 0.00 C ATOM 121 O TYR A 25 25.303 -19.944 42.979 1.00 0.00 O ATOM 0 H TYR A 25 27.038 -17.873 46.329 1.00 0.00 H new ATOM 123 N ILE A 26 24.351 -18.820 44.684 1.00 0.00 N ATOM 124 CA ILE A 26 23.003 -18.849 44.124 1.00 0.00 C ATOM 125 C ILE A 26 22.959 -18.096 42.804 1.00 0.00 C ATOM 126 O ILE A 26 22.355 -18.549 41.833 1.00 0.00 O ATOM 0 H ILE A 26 24.418 -18.344 45.583 1.00 0.00 H new ATOM 128 N VAL A 27 23.610 -16.936 42.782 1.00 0.00 N ATOM 129 CA VAL A 27 23.662 -16.094 41.591 1.00 0.00 C ATOM 130 C VAL A 27 24.390 -16.809 40.465 1.00 0.00 C ATOM 131 O VAL A 27 24.022 -16.696 39.296 1.00 0.00 O ATOM 0 H VAL A 27 24.113 -16.555 43.584 1.00 0.00 H new ATOM 133 N GLY A 28 25.432 -17.550 40.833 1.00 0.00 N ATOM 134 CA GLY A 28 26.235 -18.299 39.871 1.00 0.00 C ATOM 135 C GLY A 28 25.357 -19.238 39.061 1.00 0.00 C ATOM 136 O GLY A 28 25.483 -19.333 37.841 1.00 0.00 O ATOM 0 H GLY A 28 25.742 -17.648 41.800 1.00 0.00 H new ATOM 0 HA2 GLY A 28 26.751 -17.609 39.204 1.00 0.00 H new ATOM 0 HA3 GLY A 28 27.002 -18.870 40.395 1.00 0.00 H new ATOM 138 N ALA A 29 24.462 -19.932 39.758 1.00 0.00 N ATOM 139 CA ALA A 29 23.543 -20.876 39.127 1.00 0.00 C ATOM 140 C ALA A 29 22.549 -20.141 38.242 1.00 0.00 C ATOM 141 O ALA A 29 22.208 -20.599 37.153 1.00 0.00 O ATOM 0 H ALA A 29 24.353 -19.857 40.769 1.00 0.00 H new ATOM 143 N LEU A 30 22.088 -18.992 38.728 1.00 0.00 N ATOM 144 CA LEU A 30 21.128 -18.168 38.000 1.00 0.00 C ATOM 145 C LEU A 30 21.706 -17.731 36.664 1.00 0.00 C ATOM 146 O LEU A 30 21.012 -17.705 35.649 1.00 0.00 O ATOM 0 H LEU A 30 22.367 -18.608 39.631 1.00 0.00 H new ATOM 148 N VAL A 31 22.990 -17.386 36.679 1.00 0.00 N ATOM 149 CA VAL A 31 23.693 -16.944 35.478 1.00 0.00 C ATOM 150 C VAL A 31 23.756 -18.066 34.454 1.00 0.00 C ATOM 151 O VAL A 31 23.588 -17.845 33.256 1.00 0.00 O ATOM 0 H VAL A 31 23.570 -17.404 37.518 1.00 0.00 H new ATOM 153 N ILE A 32 24.002 -19.278 34.945 1.00 0.00 N ATOM 154 CA ILE A 32 24.094 -20.460 34.093 1.00 0.00 C ATOM 155 C ILE A 32 22.765 -20.724 33.403 1.00 0.00 C ATOM 156 O ILE A 32 22.716 -21.037 32.215 1.00 0.00 O ATOM 0 H ILE A 32 24.142 -19.468 35.937 1.00 0.00 H new ATOM 158 N LEU A 33 21.685 -20.593 34.168 1.00 0.00 N ATOM 159 CA LEU A 33 20.335 -20.812 33.656 1.00 0.00 C ATOM 160 C LEU A 33 20.004 -19.794 32.576 1.00 0.00 C ATOM 161 O LEU A 33 19.467 -20.136 31.523 1.00 0.00 O ATOM 0 H LEU A 33 21.720 -20.334 35.154 1.00 0.00 H new ATOM 163 N ALA A 34 20.332 -18.536 32.853 1.00 0.00 N ATOM 164 CA ALA A 34 20.081 -17.441 31.920 1.00 0.00 C ATOM 165 C ALA A 34 20.711 -17.737 30.569 1.00 0.00 C ATOM 166 O ALA A 34 20.221 -17.300 29.529 1.00 0.00 O ATOM 0 H ALA A 34 20.776 -18.247 33.724 1.00 0.00 H new ATOM 168 N VAL A 35 21.808 -18.489 30.599 1.00 0.00 N ATOM 169 CA VAL A 35 22.531 -18.863 29.387 1.00 0.00 C ATOM 170 C VAL A 35 21.619 -19.618 28.434 1.00 0.00 C ATOM 171 O VAL A 35 21.745 -19.513 27.215 1.00 0.00 O ATOM 0 H VAL A 35 22.219 -18.854 31.458 1.00 0.00 H new ATOM 173 N ALA A 36 20.695 -20.383 29.008 1.00 0.00 N ATOM 174 CA ALA A 36 19.742 -21.171 28.232 1.00 0.00 C ATOM 175 C ALA A 36 18.767 -20.262 27.503 1.00 0.00 C ATOM 176 O ALA A 36 18.410 -20.504 26.351 1.00 0.00 O ATOM 0 H ALA A 36 20.586 -20.474 30.018 1.00 0.00 H new ATOM 178 N GLY A 37 18.340 -19.207 28.192 1.00 0.00 N ATOM 179 CA GLY A 37 17.401 -18.238 27.634 1.00 0.00 C ATOM 180 C GLY A 37 17.917 -17.701 26.309 1.00 0.00 C ATOM 181 O GLY A 37 17.201 -17.680 25.309 1.00 0.00 O ATOM 0 H GLY A 37 18.633 -19.000 29.147 1.00 0.00 H new ATOM 0 HA2 GLY A 37 16.428 -18.707 27.489 1.00 0.00 H new ATOM 0 HA3 GLY A 37 17.257 -17.416 28.335 1.00 0.00 H new ATOM 183 N LEU A 38 19.173 -17.264 26.315 1.00 0.00 N ATOM 184 CA LEU A 38 19.816 -16.718 25.124 1.00 0.00 C ATOM 185 C LEU A 38 19.948 -17.788 24.052 1.00 0.00 C ATOM 186 O LEU A 38 19.646 -17.557 22.882 1.00 0.00 O ATOM 0 H LEU A 38 19.771 -17.278 27.141 1.00 0.00 H new ATOM 188 N ILE A 39 20.403 -18.966 24.469 1.00 0.00 N ATOM 189 CA ILE A 39 20.587 -20.097 23.564 1.00 0.00 C ATOM 190 C ILE A 39 19.291 -20.408 22.832 1.00 0.00 C ATOM 191 O ILE A 39 19.275 -20.588 21.615 1.00 0.00 O ATOM 0 H ILE A 39 20.653 -19.163 25.438 1.00 0.00 H new ATOM 193 N TYR A 40 18.202 -20.468 23.592 1.00 0.00 N ATOM 194 CA TYR A 40 16.881 -20.757 23.041 1.00 0.00 C ATOM 195 C TYR A 40 16.444 -19.648 22.098 1.00 0.00 C ATOM 196 O TYR A 40 15.926 -19.904 21.012 1.00 0.00 O ATOM 0 H TYR A 40 18.209 -20.319 24.601 1.00 0.00 H new ATOM 198 N SER A 41 16.660 -18.408 22.528 1.00 0.00 N ATOM 199 CA SER A 41 16.297 -17.234 21.740 1.00 0.00 C ATOM 200 C SER A 41 17.031 -17.239 20.409 1.00 0.00 C ATOM 201 O SER A 41 16.470 -16.889 19.372 1.00 0.00 O ATOM 0 H SER A 41 17.089 -18.189 23.427 1.00 0.00 H new ATOM 203 N MET A 42 18.297 -17.643 20.453 1.00 0.00 N ATOM 204 CA MET A 42 19.138 -17.705 19.260 1.00 0.00 C ATOM 205 C MET A 42 18.647 -18.792 18.318 1.00 0.00 C ATOM 206 O MET A 42 18.604 -18.609 17.103 1.00 0.00 O ATOM 0 H MET A 42 18.767 -17.935 21.310 1.00 0.00 H new ATOM 208 N LEU A 43 18.275 -19.930 18.898 1.00 0.00 N ATOM 209 CA LEU A 43 17.780 -21.070 18.132 1.00 0.00 C ATOM 210 C LEU A 43 16.362 -20.812 17.650 1.00 0.00 C ATOM 211 O LEU A 43 15.970 -21.244 16.568 1.00 0.00 O ATOM 0 H LEU A 43 18.308 -20.088 19.905 1.00 0.00 H new ATOM 213 N ARG A 44 15.597 -20.098 18.471 1.00 0.00 N ATOM 214 CA ARG A 44 14.211 -19.764 18.153 1.00 0.00 C ATOM 215 C ARG A 44 14.154 -18.599 17.179 1.00 0.00 C ATOM 216 O ARG A 44 13.169 -18.413 16.466 1.00 0.00 O ATOM 0 H ARG A 44 15.917 -19.737 19.370 1.00 0.00 H new ATOM 218 N LYS A 45 15.228 -17.814 17.158 1.00 0.00 N ATOM 219 CA LYS A 45 15.329 -16.654 16.278 1.00 0.00 C ATOM 220 C LYS A 45 16.255 -16.951 15.110 1.00 0.00 C ATOM 221 O LYS A 45 16.066 -16.447 14.004 1.00 0.00 O ATOM 0 H LYS A 45 16.048 -17.963 17.747 1.00 0.00 H new ATOM 223 N ALA A 46 17.263 -17.779 15.371 1.00 0.00 N ATOM 224 CA ALA A 46 18.239 -18.164 14.357 1.00 0.00 C ATOM 0 H ALA A 46 17.425 -18.200 16.286 1.00 0.00 H new