USER MOD reduce.3.24.130724 H: found=0, std=0, add=364, rem=0, adj=1 USER MOD reduce.3.24.130724 removed 268 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 ALA N :NH3+ -119:sc= 0.176 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 36.122 -18.063 24.909 1.00 0.00 N ATOM 2 CA ALA A 1 37.075 -16.986 25.086 1.00 0.00 C ATOM 3 C ALA A 1 36.485 -15.943 26.024 1.00 0.00 C ATOM 4 O ALA A 1 35.366 -16.101 26.507 1.00 0.00 O ATOM 5 CB ALA A 1 38.375 -17.552 25.651 1.00 0.00 C ATOM 0 H1 ALA A 1 36.538 -18.954 25.248 1.00 0.00 H new ATOM 0 H2 ALA A 1 35.259 -17.856 25.451 1.00 0.00 H new ATOM 0 H3 ALA A 1 35.884 -18.154 23.901 1.00 0.00 H new ATOM 0 HA ALA A 1 37.290 -16.511 24.129 1.00 0.00 H new ATOM 0 HB1 ALA A 1 39.095 -16.745 25.786 1.00 0.00 H new ATOM 0 HB2 ALA A 1 38.178 -18.027 26.612 1.00 0.00 H new ATOM 0 HB3 ALA A 1 38.782 -18.289 24.959 1.00 0.00 H new ATOM 7 N ASP A 2 37.242 -14.873 26.281 1.00 0.00 N ATOM 8 CA ASP A 2 36.792 -13.811 27.158 1.00 0.00 C ATOM 9 C ASP A 2 37.893 -12.772 27.314 1.00 0.00 C ATOM 10 O ASP A 2 37.705 -11.608 26.966 1.00 0.00 O ATOM 11 CB ASP A 2 36.407 -14.399 28.512 1.00 0.00 C ATOM 0 H ASP A 2 38.172 -14.727 25.888 1.00 0.00 H new ATOM 0 HA ASP A 2 35.917 -13.323 26.727 1.00 0.00 H new ATOM 14 N THR A 3 39.046 -13.195 27.838 1.00 0.00 N ATOM 15 CA THR A 3 40.169 -12.302 28.037 1.00 0.00 C ATOM 16 C THR A 3 40.584 -11.690 26.707 1.00 0.00 C ATOM 17 O THR A 3 40.687 -10.471 26.588 1.00 0.00 O ATOM 18 CB THR A 3 41.327 -13.076 28.661 1.00 0.00 C ATOM 0 H THR A 3 39.218 -14.157 28.131 1.00 0.00 H new ATOM 0 HA THR A 3 39.882 -11.495 28.711 1.00 0.00 H new ATOM 21 N LYS A 4 40.818 -12.540 25.705 1.00 0.00 N ATOM 22 CA LYS A 4 41.219 -12.082 24.390 1.00 0.00 C ATOM 23 C LYS A 4 40.180 -11.113 23.843 1.00 0.00 C ATOM 24 O LYS A 4 40.527 -10.054 23.327 1.00 0.00 O ATOM 25 CB LYS A 4 41.376 -13.284 23.462 1.00 0.00 C ATOM 0 H LYS A 4 40.734 -13.553 25.789 1.00 0.00 H new ATOM 0 HA LYS A 4 42.174 -11.561 24.457 1.00 0.00 H new ATOM 28 N GLU A 5 38.901 -11.479 23.964 1.00 0.00 N ATOM 29 CA GLU A 5 37.816 -10.648 23.482 1.00 0.00 C ATOM 30 C GLU A 5 37.690 -9.401 24.346 1.00 0.00 C ATOM 31 O GLU A 5 37.645 -8.287 23.828 1.00 0.00 O ATOM 32 CB GLU A 5 36.518 -11.451 23.503 1.00 0.00 C ATOM 0 H GLU A 5 38.600 -12.353 24.396 1.00 0.00 H new ATOM 0 HA GLU A 5 38.022 -10.334 22.459 1.00 0.00 H new ATOM 35 N VAL A 6 37.637 -9.590 25.666 1.00 0.00 N ATOM 36 CA VAL A 6 37.511 -8.485 26.596 1.00 0.00 C ATOM 37 C VAL A 6 38.706 -7.553 26.471 1.00 0.00 C ATOM 38 O VAL A 6 38.563 -6.341 26.617 1.00 0.00 O ATOM 39 CB VAL A 6 37.395 -9.028 28.018 1.00 0.00 C ATOM 0 H VAL A 6 37.680 -10.508 26.109 1.00 0.00 H new ATOM 0 HA VAL A 6 36.612 -7.915 26.361 1.00 0.00 H new ATOM 42 N LEU A 7 39.885 -8.112 26.190 1.00 0.00 N ATOM 43 CA LEU A 7 41.086 -7.317 26.042 1.00 0.00 C ATOM 44 C LEU A 7 41.033 -6.572 24.718 1.00 0.00 C ATOM 45 O LEU A 7 41.214 -5.358 24.689 1.00 0.00 O ATOM 46 CB LEU A 7 42.311 -8.225 26.106 1.00 0.00 C ATOM 0 H LEU A 7 40.024 -9.114 26.062 1.00 0.00 H new ATOM 0 HA LEU A 7 41.155 -6.589 26.851 1.00 0.00 H new ATOM 49 N GLU A 8 40.786 -7.306 23.630 1.00 0.00 N ATOM 50 CA GLU A 8 40.697 -6.725 22.304 1.00 0.00 C ATOM 51 C GLU A 8 39.717 -5.561 22.301 1.00 0.00 C ATOM 52 O GLU A 8 39.991 -4.519 21.709 1.00 0.00 O ATOM 53 CB GLU A 8 40.265 -7.798 21.308 1.00 0.00 C ATOM 0 H GLU A 8 40.644 -8.316 23.652 1.00 0.00 H new ATOM 0 HA GLU A 8 41.675 -6.343 22.011 1.00 0.00 H new ATOM 56 N ALA A 9 38.576 -5.727 22.975 1.00 0.00 N ATOM 57 CA ALA A 9 37.583 -4.679 23.057 1.00 0.00 C ATOM 58 C ALA A 9 38.224 -3.504 23.766 1.00 0.00 C ATOM 59 O ALA A 9 38.101 -2.365 23.322 1.00 0.00 O ATOM 60 CB ALA A 9 36.359 -5.184 23.816 1.00 0.00 C ATOM 0 H ALA A 9 38.326 -6.583 23.470 1.00 0.00 H new ATOM 0 HA ALA A 9 37.247 -4.374 22.066 1.00 0.00 H new ATOM 0 HB1 ALA A 9 35.614 -4.390 23.875 1.00 0.00 H new ATOM 0 HB2 ALA A 9 35.935 -6.041 23.293 1.00 0.00 H new ATOM 0 HB3 ALA A 9 36.652 -5.481 24.823 1.00 0.00 H new ATOM 63 N ARG A 10 38.925 -3.783 24.867 1.00 0.00 N ATOM 64 CA ARG A 10 39.620 -2.753 25.605 1.00 0.00 C ATOM 65 C ARG A 10 40.639 -2.105 24.680 1.00 0.00 C ATOM 66 O ARG A 10 40.973 -0.933 24.848 1.00 0.00 O ATOM 67 CB ARG A 10 40.303 -3.371 26.821 1.00 0.00 C ATOM 0 H ARG A 10 39.020 -4.720 25.260 1.00 0.00 H new ATOM 0 HA ARG A 10 38.922 -1.994 25.958 1.00 0.00 H new ATOM 70 N GLU A 11 41.123 -2.859 23.687 1.00 0.00 N ATOM 71 CA GLU A 11 42.087 -2.328 22.747 1.00 0.00 C ATOM 72 C GLU A 11 41.385 -1.235 21.959 1.00 0.00 C ATOM 73 O GLU A 11 41.973 -0.202 21.649 1.00 0.00 O ATOM 74 CB GLU A 11 42.576 -3.442 21.826 1.00 0.00 C ATOM 0 H GLU A 11 40.859 -3.830 23.523 1.00 0.00 H new ATOM 0 HA GLU A 11 42.959 -1.920 23.258 1.00 0.00 H new ATOM 77 N ALA A 12 40.108 -1.475 21.658 1.00 0.00 N ATOM 78 CA ALA A 12 39.289 -0.530 20.925 1.00 0.00 C ATOM 79 C ALA A 12 39.004 0.658 21.831 1.00 0.00 C ATOM 80 O ALA A 12 39.109 1.806 21.407 1.00 0.00 O ATOM 81 CB ALA A 12 37.988 -1.210 20.507 1.00 0.00 C ATOM 0 H ALA A 12 39.620 -2.332 21.919 1.00 0.00 H new ATOM 0 HA ALA A 12 39.804 -0.187 20.028 1.00 0.00 H new ATOM 0 HB1 ALA A 12 37.369 -0.503 19.955 1.00 0.00 H new ATOM 0 HB2 ALA A 12 38.213 -2.067 19.872 1.00 0.00 H new ATOM 0 HB3 ALA A 12 37.452 -1.546 21.394 1.00 0.00 H new ATOM 84 N TYR A 13 38.648 0.373 23.086 1.00 0.00 N ATOM 85 CA TYR A 13 38.367 1.408 24.059 1.00 0.00 C ATOM 86 C TYR A 13 39.592 2.300 24.206 1.00 0.00 C ATOM 87 O TYR A 13 39.472 3.463 24.587 1.00 0.00 O ATOM 88 CB TYR A 13 38.002 0.765 25.394 1.00 0.00 C ATOM 0 H TYR A 13 38.550 -0.577 23.445 1.00 0.00 H new ATOM 0 HA TYR A 13 37.526 2.017 23.727 1.00 0.00 H new ATOM 91 N PHE A 14 40.768 1.756 23.879 1.00 0.00 N ATOM 92 CA PHE A 14 42.011 2.496 23.957 1.00 0.00 C ATOM 93 C PHE A 14 42.108 3.369 22.716 1.00 0.00 C ATOM 94 O PHE A 14 42.556 4.511 22.786 1.00 0.00 O ATOM 95 CB PHE A 14 43.181 1.520 24.028 1.00 0.00 C ATOM 0 H PHE A 14 40.875 0.795 23.555 1.00 0.00 H new ATOM 0 HA PHE A 14 42.040 3.121 24.850 1.00 0.00 H new ATOM 98 N LYS A 15 41.671 2.823 21.578 1.00 0.00 N ATOM 99 CA LYS A 15 41.677 3.546 20.324 1.00 0.00 C ATOM 100 C LYS A 15 40.618 4.639 20.379 1.00 0.00 C ATOM 101 O LYS A 15 40.710 5.631 19.662 1.00 0.00 O ATOM 102 CB LYS A 15 41.397 2.577 19.178 1.00 0.00 C ATOM 0 H LYS A 15 41.307 1.873 21.510 1.00 0.00 H new ATOM 0 HA LYS A 15 42.651 4.005 20.157 1.00 0.00 H new ATOM 105 N SER A 16 39.610 4.451 21.235 1.00 0.00 N ATOM 106 CA SER A 16 38.551 5.426 21.398 1.00 0.00 C ATOM 107 C SER A 16 39.100 6.631 22.147 1.00 0.00 C ATOM 108 O SER A 16 39.223 7.713 21.578 1.00 0.00 O ATOM 109 CB SER A 16 37.388 4.795 22.158 1.00 0.00 C ATOM 0 H SER A 16 39.513 3.624 21.825 1.00 0.00 H new ATOM 0 HA SER A 16 38.185 5.753 20.424 1.00 0.00 H new ATOM 112 N LEU A 17 39.433 6.442 23.426 1.00 0.00 N ATOM 113 CA LEU A 17 39.982 7.512 24.234 1.00 0.00 C ATOM 114 C LEU A 17 41.245 8.034 23.563 1.00 0.00 C ATOM 115 O LEU A 17 41.566 9.217 23.657 1.00 0.00 O ATOM 116 CB LEU A 17 40.289 6.987 25.633 1.00 0.00 C ATOM 0 H LEU A 17 39.329 5.554 23.917 1.00 0.00 H new ATOM 0 HA LEU A 17 39.264 8.327 24.324 1.00 0.00 H new ATOM 119 N GLY A 18 41.951 7.140 22.866 1.00 0.00 N ATOM 120 CA GLY A 18 43.169 7.489 22.170 1.00 0.00 C ATOM 121 C GLY A 18 42.841 8.352 20.961 1.00 0.00 C ATOM 122 O GLY A 18 43.576 9.287 20.650 1.00 0.00 O ATOM 0 H GLY A 18 41.686 6.159 22.775 1.00 0.00 H new ATOM 0 HA2 GLY A 18 43.841 8.025 22.840 1.00 0.00 H new ATOM 0 HA3 GLY A 18 43.690 6.585 21.853 1.00 0.00 H new ATOM 126 N GLY A 19 41.730 8.050 20.282 1.00 0.00 N ATOM 127 CA GLY A 19 41.314 8.803 19.116 1.00 0.00 C ATOM 128 C GLY A 19 40.983 10.228 19.531 1.00 0.00 C ATOM 129 O GLY A 19 41.324 11.177 18.828 1.00 0.00 O ATOM 0 H GLY A 19 41.105 7.283 20.530 1.00 0.00 H new ATOM 0 HA2 GLY A 19 42.107 8.805 18.368 1.00 0.00 H new ATOM 0 HA3 GLY A 19 40.444 8.334 18.657 1.00 0.00 H new ATOM 133 N SER A 20 40.326 10.374 20.684 1.00 0.00 N ATOM 134 CA SER A 20 39.982 11.683 21.198 1.00 0.00 C ATOM 135 C SER A 20 41.276 12.472 21.359 1.00 0.00 C ATOM 136 O SER A 20 41.386 13.575 20.836 1.00 0.00 O ATOM 137 CB SER A 20 39.267 11.533 22.538 1.00 0.00 C ATOM 0 H SER A 20 40.026 9.597 21.272 1.00 0.00 H new ATOM 0 HA SER A 20 39.312 12.208 20.517 1.00 0.00 H new ATOM 140 N MET A 21 42.259 11.897 22.063 1.00 0.00 N ATOM 141 CA MET A 21 43.546 12.524 22.289 1.00 0.00 C ATOM 142 C MET A 21 44.168 13.064 21.002 1.00 0.00 C ATOM 143 O MET A 21 44.591 14.216 20.950 1.00 0.00 O ATOM 144 CB MET A 21 44.483 11.502 22.927 1.00 0.00 C ATOM 0 H MET A 21 42.172 10.975 22.491 1.00 0.00 H new ATOM 0 HA MET A 21 43.394 13.377 22.950 1.00 0.00 H new ATOM 147 N LYS A 22 44.229 12.220 19.969 1.00 0.00 N ATOM 148 CA LYS A 22 44.835 12.583 18.701 1.00 0.00 C ATOM 149 C LYS A 22 44.047 13.682 18.001 1.00 0.00 C ATOM 150 O LYS A 22 44.575 14.765 17.763 1.00 0.00 O ATOM 151 CB LYS A 22 44.929 11.344 17.815 1.00 0.00 C ATOM 0 H LYS A 22 43.859 11.270 19.995 1.00 0.00 H new ATOM 0 HA LYS A 22 45.835 12.973 18.892 1.00 0.00 H new ATOM 154 N ALA A 23 42.793 13.380 17.658 1.00 0.00 N ATOM 155 CA ALA A 23 41.932 14.336 16.978 1.00 0.00 C ATOM 156 C ALA A 23 41.906 15.649 17.755 1.00 0.00 C ATOM 157 O ALA A 23 41.834 16.729 17.176 1.00 0.00 O ATOM 158 CB ALA A 23 40.527 13.754 16.854 1.00 0.00 C ATOM 0 H ALA A 23 42.355 12.478 17.843 1.00 0.00 H new ATOM 0 HA ALA A 23 42.319 14.535 15.978 1.00 0.00 H new ATOM 0 HB1 ALA A 23 39.881 14.469 16.345 1.00 0.00 H new ATOM 0 HB2 ALA A 23 40.566 12.828 16.281 1.00 0.00 H new ATOM 0 HB3 ALA A 23 40.129 13.549 17.848 1.00 0.00 H new ATOM 161 N MET A 24 41.994 15.525 19.077 1.00 0.00 N ATOM 162 CA MET A 24 41.984 16.679 19.956 1.00 0.00 C ATOM 163 C MET A 24 43.308 17.427 19.881 1.00 0.00 C ATOM 164 O MET A 24 43.323 18.654 19.838 1.00 0.00 O ATOM 165 CB MET A 24 41.696 16.257 21.393 1.00 0.00 C ATOM 0 H MET A 24 42.073 14.630 19.560 1.00 0.00 H new ATOM 0 HA MET A 24 41.191 17.349 19.625 1.00 0.00 H new ATOM 168 N THR A 25 44.421 16.692 19.861 1.00 0.00 N ATOM 169 CA THR A 25 45.739 17.298 19.829 1.00 0.00 C ATOM 170 C THR A 25 46.054 17.953 18.488 1.00 0.00 C ATOM 171 O THR A 25 46.551 19.077 18.450 1.00 0.00 O ATOM 172 CB THR A 25 46.784 16.235 20.157 1.00 0.00 C ATOM 0 H THR A 25 44.428 15.672 19.867 1.00 0.00 H new ATOM 0 HA THR A 25 45.759 18.093 20.575 1.00 0.00 H new ATOM 175 N GLY A 26 45.757 17.269 17.381 1.00 0.00 N ATOM 176 CA GLY A 26 46.063 17.779 16.059 1.00 0.00 C ATOM 177 C GLY A 26 45.086 18.873 15.659 1.00 0.00 C ATOM 178 O GLY A 26 45.503 19.948 15.238 1.00 0.00 O ATOM 0 H GLY A 26 45.302 16.356 17.383 1.00 0.00 H new ATOM 0 HA2 GLY A 26 47.080 18.171 16.043 1.00 0.00 H new ATOM 0 HA3 GLY A 26 46.022 16.967 15.333 1.00 0.00 H new ATOM 182 N VAL A 27 43.787 18.594 15.783 1.00 0.00 N ATOM 183 CA VAL A 27 42.776 19.571 15.428 1.00 0.00 C ATOM 184 C VAL A 27 43.001 20.848 16.227 1.00 0.00 C ATOM 185 O VAL A 27 43.029 21.938 15.659 1.00 0.00 O ATOM 186 CB VAL A 27 41.382 19.004 15.668 1.00 0.00 C ATOM 0 H VAL A 27 43.420 17.705 16.124 1.00 0.00 H new ATOM 0 HA VAL A 27 42.856 19.808 14.367 1.00 0.00 H new ATOM 189 N ALA A 28 43.172 20.715 17.545 1.00 0.00 N ATOM 190 CA ALA A 28 43.404 21.861 18.402 1.00 0.00 C ATOM 191 C ALA A 28 44.729 22.520 18.048 1.00 0.00 C ATOM 192 O ALA A 28 44.877 23.730 18.205 1.00 0.00 O ATOM 193 CB ALA A 28 43.390 21.432 19.866 1.00 0.00 C ATOM 0 H ALA A 28 43.153 19.820 18.034 1.00 0.00 H new ATOM 0 HA ALA A 28 42.606 22.587 18.248 1.00 0.00 H new ATOM 0 HB1 ALA A 28 43.565 22.300 20.501 1.00 0.00 H new ATOM 0 HB2 ALA A 28 42.421 20.995 20.108 1.00 0.00 H new ATOM 0 HB3 ALA A 28 44.174 20.694 20.036 1.00 0.00 H new ATOM 196 N LYS A 29 45.694 21.734 17.562 1.00 0.00 N ATOM 197 CA LYS A 29 46.986 22.268 17.183 1.00 0.00 C ATOM 198 C LYS A 29 46.842 23.031 15.873 1.00 0.00 C ATOM 199 O LYS A 29 47.579 23.981 15.621 1.00 0.00 O ATOM 200 CB LYS A 29 47.986 21.124 17.038 1.00 0.00 C ATOM 0 H LYS A 29 45.596 20.728 17.425 1.00 0.00 H new ATOM 0 HA LYS A 29 47.352 22.950 17.950 1.00 0.00 H new ATOM 203 N ALA A 30 45.875 22.611 15.052 1.00 0.00 N ATOM 204 CA ALA A 30 45.613 23.234 13.769 1.00 0.00 C ATOM 205 C ALA A 30 44.765 24.481 13.985 1.00 0.00 C ATOM 206 O ALA A 30 45.218 25.419 14.637 1.00 0.00 O ATOM 207 CB ALA A 30 44.920 22.230 12.853 1.00 0.00 C ATOM 0 H ALA A 30 45.256 21.829 15.266 1.00 0.00 H new ATOM 0 HA ALA A 30 46.545 23.536 13.291 1.00 0.00 H new ATOM 0 HB1 ALA A 30 44.721 22.695 11.887 1.00 0.00 H new ATOM 0 HB2 ALA A 30 45.564 21.362 12.712 1.00 0.00 H new ATOM 0 HB3 ALA A 30 43.979 21.915 13.304 1.00 0.00 H new ATOM 210 N PHE A 31 43.538 24.491 13.448 1.00 0.00 N ATOM 211 CA PHE A 31 42.633 25.616 13.582 1.00 0.00 C ATOM 212 C PHE A 31 41.850 25.501 14.881 1.00 0.00 C ATOM 213 O PHE A 31 42.167 24.652 15.713 1.00 0.00 O ATOM 214 CB PHE A 31 41.681 25.632 12.389 1.00 0.00 C ATOM 0 H PHE A 31 43.154 23.714 12.910 1.00 0.00 H new ATOM 0 HA PHE A 31 43.202 26.546 13.604 1.00 0.00 H new ATOM 217 N ASP A 32 40.832 26.360 15.021 1.00 0.00 N ATOM 218 CA ASP A 32 39.969 26.407 16.193 1.00 0.00 C ATOM 219 C ASP A 32 38.524 26.143 15.797 1.00 0.00 C ATOM 220 O ASP A 32 38.204 26.122 14.610 1.00 0.00 O ATOM 221 CB ASP A 32 40.094 27.781 16.845 1.00 0.00 C ATOM 0 H ASP A 32 40.587 27.049 14.310 1.00 0.00 H new ATOM 0 HA ASP A 32 40.274 25.636 16.901 1.00 0.00 H new ATOM 224 N ALA A 33 37.673 25.925 16.806 1.00 0.00 N ATOM 225 CA ALA A 33 36.255 25.669 16.620 1.00 0.00 C ATOM 226 C ALA A 33 36.020 24.205 16.274 1.00 0.00 C ATOM 227 O ALA A 33 35.407 23.475 17.050 1.00 0.00 O ATOM 228 CB ALA A 33 35.665 26.598 15.561 1.00 0.00 C ATOM 0 H ALA A 33 37.961 25.923 17.784 1.00 0.00 H new ATOM 0 HA ALA A 33 35.740 25.878 17.558 1.00 0.00 H new ATOM 0 HB1 ALA A 33 34.603 26.385 15.441 1.00 0.00 H new ATOM 0 HB2 ALA A 33 35.795 27.634 15.873 1.00 0.00 H new ATOM 0 HB3 ALA A 33 36.176 26.438 14.612 1.00 0.00 H new ATOM 231 N GLU A 34 36.506 23.773 15.109 1.00 0.00 N ATOM 232 CA GLU A 34 36.340 22.401 14.671 1.00 0.00 C ATOM 233 C GLU A 34 36.945 21.446 15.691 1.00 0.00 C ATOM 234 O GLU A 34 36.358 20.412 16.001 1.00 0.00 O ATOM 235 CB GLU A 34 37.002 22.223 13.308 1.00 0.00 C ATOM 0 H GLU A 34 37.019 24.363 14.454 1.00 0.00 H new ATOM 0 HA GLU A 34 35.278 22.174 14.583 1.00 0.00 H new ATOM 238 N ALA A 35 38.122 21.796 16.215 1.00 0.00 N ATOM 239 CA ALA A 35 38.810 20.966 17.183 1.00 0.00 C ATOM 240 C ALA A 35 37.920 20.670 18.381 1.00 0.00 C ATOM 241 O ALA A 35 37.696 19.506 18.706 1.00 0.00 O ATOM 242 CB ALA A 35 40.094 21.661 17.625 1.00 0.00 C ATOM 0 H ALA A 35 38.614 22.657 15.977 1.00 0.00 H new ATOM 0 HA ALA A 35 39.059 20.013 16.716 1.00 0.00 H new ATOM 0 HB1 ALA A 35 40.613 21.038 18.353 1.00 0.00 H new ATOM 0 HB2 ALA A 35 40.738 21.821 16.760 1.00 0.00 H new ATOM 0 HB3 ALA A 35 39.850 22.622 18.078 1.00 0.00 H new ATOM 245 N ALA A 36 37.430 21.725 19.039 1.00 0.00 N ATOM 246 CA ALA A 36 36.573 21.588 20.202 1.00 0.00 C ATOM 247 C ALA A 36 35.424 20.634 19.907 1.00 0.00 C ATOM 248 O ALA A 36 35.209 19.676 20.646 1.00 0.00 O ATOM 249 CB ALA A 36 36.043 22.961 20.605 1.00 0.00 C ATOM 0 H ALA A 36 37.620 22.692 18.775 1.00 0.00 H new ATOM 0 HA ALA A 36 37.151 21.173 21.028 1.00 0.00 H new ATOM 0 HB1 ALA A 36 35.399 22.860 21.479 1.00 0.00 H new ATOM 0 HB2 ALA A 36 36.879 23.618 20.844 1.00 0.00 H new ATOM 0 HB3 ALA A 36 35.472 23.387 19.780 1.00 0.00 H new ATOM 252 N LYS A 37 34.691 20.896 18.823 1.00 0.00 N ATOM 253 CA LYS A 37 33.575 20.061 18.428 1.00 0.00 C ATOM 254 C LYS A 37 34.007 18.605 18.314 1.00 0.00 C ATOM 255 O LYS A 37 33.460 17.740 18.995 1.00 0.00 O ATOM 256 CB LYS A 37 33.016 20.560 17.099 1.00 0.00 C ATOM 0 H LYS A 37 34.859 21.689 18.204 1.00 0.00 H new ATOM 0 HA LYS A 37 32.797 20.120 19.189 1.00 0.00 H new ATOM 259 N VAL A 38 34.990 18.330 17.453 1.00 0.00 N ATOM 260 CA VAL A 38 35.482 16.984 17.235 1.00 0.00 C ATOM 261 C VAL A 38 35.890 16.306 18.536 1.00 0.00 C ATOM 262 O VAL A 38 35.554 15.143 18.756 1.00 0.00 O ATOM 263 CB VAL A 38 36.662 17.033 16.269 1.00 0.00 C ATOM 0 H VAL A 38 35.461 19.040 16.892 1.00 0.00 H new ATOM 0 HA VAL A 38 34.674 16.391 16.807 1.00 0.00 H new ATOM 266 N GLU A 39 36.612 17.017 19.408 1.00 0.00 N ATOM 267 CA GLU A 39 37.064 16.452 20.661 1.00 0.00 C ATOM 268 C GLU A 39 35.856 16.151 21.530 1.00 0.00 C ATOM 269 O GLU A 39 35.815 15.123 22.196 1.00 0.00 O ATOM 270 CB GLU A 39 38.000 17.438 21.355 1.00 0.00 C ATOM 0 H GLU A 39 36.891 17.987 19.259 1.00 0.00 H new ATOM 0 HA GLU A 39 37.611 15.526 20.483 1.00 0.00 H new ATOM 273 N ALA A 40 34.885 17.065 21.534 1.00 0.00 N ATOM 274 CA ALA A 40 33.666 16.889 22.299 1.00 0.00 C ATOM 275 C ALA A 40 33.051 15.522 22.027 1.00 0.00 C ATOM 276 O ALA A 40 32.709 14.798 22.959 1.00 0.00 O ATOM 277 CB ALA A 40 32.683 17.993 21.931 1.00 0.00 C ATOM 0 H ALA A 40 34.927 17.939 21.009 1.00 0.00 H new ATOM 0 HA ALA A 40 33.900 16.946 23.362 1.00 0.00 H new ATOM 0 HB1 ALA A 40 31.764 17.867 22.503 1.00 0.00 H new ATOM 0 HB2 ALA A 40 33.123 18.963 22.161 1.00 0.00 H new ATOM 0 HB3 ALA A 40 32.458 17.940 20.866 1.00 0.00 H new ATOM 280 N ALA A 41 32.920 15.168 20.747 1.00 0.00 N ATOM 281 CA ALA A 41 32.337 13.900 20.354 1.00 0.00 C ATOM 282 C ALA A 41 33.160 12.704 20.824 1.00 0.00 C ATOM 283 O ALA A 41 32.629 11.800 21.468 1.00 0.00 O ATOM 284 CB ALA A 41 32.181 13.871 18.836 1.00 0.00 C ATOM 0 H ALA A 41 33.215 15.753 19.965 1.00 0.00 H new ATOM 0 HA ALA A 41 31.363 13.817 20.836 1.00 0.00 H new ATOM 0 HB1 ALA A 41 31.743 12.920 18.533 1.00 0.00 H new ATOM 0 HB2 ALA A 41 31.530 14.687 18.521 1.00 0.00 H new ATOM 0 HB3 ALA A 41 33.158 13.986 18.368 1.00 0.00 H new ATOM 287 N LYS A 42 34.459 12.689 20.510 1.00 0.00 N ATOM 288 CA LYS A 42 35.318 11.573 20.864 1.00 0.00 C ATOM 289 C LYS A 42 35.505 11.462 22.372 1.00 0.00 C ATOM 290 O LYS A 42 35.267 10.401 22.946 1.00 0.00 O ATOM 291 CB LYS A 42 36.658 11.728 20.156 1.00 0.00 C ATOM 0 H LYS A 42 34.932 13.442 20.010 1.00 0.00 H new ATOM 0 HA LYS A 42 34.842 10.648 20.538 1.00 0.00 H new ATOM 294 N LEU A 43 35.945 12.552 23.006 1.00 0.00 N ATOM 295 CA LEU A 43 36.153 12.592 24.442 1.00 0.00 C ATOM 296 C LEU A 43 34.893 12.116 25.147 1.00 0.00 C ATOM 297 O LEU A 43 34.967 11.248 26.017 1.00 0.00 O ATOM 298 CB LEU A 43 36.524 14.007 24.868 1.00 0.00 C ATOM 0 H LEU A 43 36.165 13.428 22.532 1.00 0.00 H new ATOM 0 HA LEU A 43 36.973 11.930 24.719 1.00 0.00 H new ATOM 301 N GLU A 44 33.745 12.708 24.800 1.00 0.00 N ATOM 302 CA GLU A 44 32.468 12.291 25.337 1.00 0.00 C ATOM 303 C GLU A 44 32.351 10.779 25.241 1.00 0.00 C ATOM 304 O GLU A 44 31.927 10.150 26.204 1.00 0.00 O ATOM 305 CB GLU A 44 31.339 12.969 24.567 1.00 0.00 C ATOM 0 H GLU A 44 33.687 13.485 24.142 1.00 0.00 H new ATOM 0 HA GLU A 44 32.395 12.584 26.384 1.00 0.00 H new ATOM 308 N LYS A 45 32.763 10.199 24.107 1.00 0.00 N ATOM 309 CA LYS A 45 32.723 8.759 23.917 1.00 0.00 C ATOM 310 C LYS A 45 33.474 8.075 25.058 1.00 0.00 C ATOM 311 O LYS A 45 33.031 7.066 25.603 1.00 0.00 O ATOM 312 CB LYS A 45 33.353 8.405 22.573 1.00 0.00 C ATOM 0 H LYS A 45 33.129 10.716 23.307 1.00 0.00 H new ATOM 0 HA LYS A 45 31.689 8.414 23.920 1.00 0.00 H new ATOM 315 N ILE A 46 34.617 8.667 25.405 1.00 0.00 N ATOM 316 CA ILE A 46 35.454 8.166 26.487 1.00 0.00 C ATOM 317 C ILE A 46 34.624 8.102 27.769 1.00 0.00 C ATOM 318 O ILE A 46 34.735 7.154 28.542 1.00 0.00 O ATOM 319 CB ILE A 46 36.665 9.079 26.663 1.00 0.00 C ATOM 0 H ILE A 46 34.984 9.501 24.946 1.00 0.00 H new ATOM 0 HA ILE A 46 35.815 7.165 26.252 1.00 0.00 H new ATOM 322 N LEU A 47 33.790 9.127 27.967 1.00 0.00 N ATOM 323 CA LEU A 47 32.874 9.154 29.106 1.00 0.00 C ATOM 324 C LEU A 47 31.712 8.266 28.675 1.00 0.00 C ATOM 325 O LEU A 47 31.649 7.946 27.491 1.00 0.00 O ATOM 326 CB LEU A 47 32.413 10.584 29.371 1.00 0.00 C ATOM 0 H LEU A 47 33.732 9.942 27.357 1.00 0.00 H new ATOM 0 HA LEU A 47 33.330 8.803 30.032 1.00 0.00 H new ATOM 329 N ALA A 48 30.786 7.837 29.549 1.00 0.00 N ATOM 330 CA ALA A 48 29.665 6.987 29.189 1.00 0.00 C ATOM 331 C ALA A 48 28.981 7.233 27.856 1.00 0.00 C ATOM 332 O ALA A 48 27.983 6.577 27.564 1.00 0.00 O ATOM 333 CB ALA A 48 28.623 7.089 30.299 1.00 0.00 C ATOM 0 H ALA A 48 30.806 8.081 30.539 1.00 0.00 H new ATOM 0 HA ALA A 48 30.105 5.997 29.071 1.00 0.00 H new ATOM 0 HB1 ALA A 48 27.768 6.459 30.054 1.00 0.00 H new ATOM 0 HB2 ALA A 48 29.061 6.757 31.240 1.00 0.00 H new ATOM 0 HB3 ALA A 48 28.295 8.124 30.396 1.00 0.00 H new ATOM 336 N THR A 49 29.507 8.131 27.026 1.00 0.00 N ATOM 337 CA THR A 49 28.926 8.327 25.717 1.00 0.00 C ATOM 338 C THR A 49 29.173 7.068 24.892 1.00 0.00 C ATOM 339 O THR A 49 28.274 6.646 24.167 1.00 0.00 O ATOM 340 CB THR A 49 29.488 9.575 25.047 1.00 0.00 C ATOM 0 H THR A 49 30.315 8.717 27.236 1.00 0.00 H new ATOM 0 HA THR A 49 27.852 8.491 25.803 1.00 0.00 H new ATOM 343 N ASP A 50 30.372 6.469 25.012 1.00 0.00 N ATOM 344 CA ASP A 50 30.763 5.268 24.291 1.00 0.00 C ATOM 345 C ASP A 50 31.431 4.266 25.230 1.00 0.00 C ATOM 346 O ASP A 50 31.239 3.065 25.050 1.00 0.00 O ATOM 347 CB ASP A 50 31.717 5.654 23.164 1.00 0.00 C ATOM 0 H ASP A 50 31.103 6.823 25.629 1.00 0.00 H new ATOM 0 HA ASP A 50 29.874 4.795 23.874 1.00 0.00 H new ATOM 350 N VAL A 51 32.216 4.736 26.215 1.00 0.00 N ATOM 351 CA VAL A 51 32.838 3.838 27.171 1.00 0.00 C ATOM 352 C VAL A 51 31.747 2.973 27.791 1.00 0.00 C ATOM 353 O VAL A 51 31.939 1.774 27.987 1.00 0.00 O ATOM 354 CB VAL A 51 33.566 4.642 28.242 1.00 0.00 C ATOM 0 H VAL A 51 32.426 5.724 26.360 1.00 0.00 H new ATOM 0 HA VAL A 51 33.571 3.202 26.675 1.00 0.00 H new ATOM 357 N ALA A 52 30.599 3.608 28.046 1.00 0.00 N ATOM 358 CA ALA A 52 29.415 2.973 28.603 1.00 0.00 C ATOM 359 C ALA A 52 29.735 1.949 29.683 1.00 0.00 C ATOM 360 O ALA A 52 29.254 2.072 30.807 1.00 0.00 O ATOM 361 CB ALA A 52 28.619 2.325 27.474 1.00 0.00 C ATOM 0 H ALA A 52 30.471 4.603 27.864 1.00 0.00 H new ATOM 0 HA ALA A 52 28.824 3.750 29.089 1.00 0.00 H new ATOM 0 HB1 ALA A 52 27.729 1.847 27.884 1.00 0.00 H new ATOM 0 HB2 ALA A 52 28.322 3.088 26.754 1.00 0.00 H new ATOM 0 HB3 ALA A 52 29.236 1.577 26.976 1.00 0.00 H new ATOM 364 N PRO A 53 30.531 0.933 29.335 1.00 0.00 N ATOM 365 CA PRO A 53 30.885 -0.114 30.274 1.00 0.00 C ATOM 366 C PRO A 53 31.911 -1.071 29.681 1.00 0.00 C ATOM 367 O PRO A 53 31.548 -2.110 29.133 1.00 0.00 O ATOM 368 CB PRO A 53 31.423 0.505 31.559 1.00 0.00 C ATOM 0 HA PRO A 53 29.986 -0.688 30.497 1.00 0.00 H new ATOM 370 N LEU A 54 33.196 -0.730 29.810 1.00 0.00 N ATOM 371 CA LEU A 54 34.266 -1.578 29.329 1.00 0.00 C ATOM 372 C LEU A 54 34.385 -2.782 30.255 1.00 0.00 C ATOM 373 O LEU A 54 34.838 -3.843 29.829 1.00 0.00 O ATOM 374 CB LEU A 54 35.569 -0.785 29.298 1.00 0.00 C ATOM 0 H LEU A 54 33.512 0.135 30.248 1.00 0.00 H new ATOM 0 HA LEU A 54 34.054 -1.925 28.318 1.00 0.00 H new ATOM 377 N PHE A 55 33.969 -2.604 31.516 1.00 0.00 N ATOM 378 CA PHE A 55 33.999 -3.656 32.523 1.00 0.00 C ATOM 379 C PHE A 55 32.798 -3.529 33.457 1.00 0.00 C ATOM 380 O PHE A 55 31.920 -2.699 33.230 1.00 0.00 O ATOM 381 CB PHE A 55 35.310 -3.577 33.298 1.00 0.00 C ATOM 0 H PHE A 55 33.601 -1.718 31.861 1.00 0.00 H new ATOM 0 HA PHE A 55 33.939 -4.629 32.036 1.00 0.00 H new ATOM 384 N PRO A 56 32.766 -4.364 34.501 1.00 0.00 N ATOM 385 CA PRO A 56 31.683 -4.385 35.471 1.00 0.00 C ATOM 386 C PRO A 56 31.377 -2.989 35.997 1.00 0.00 C ATOM 387 O PRO A 56 30.216 -2.594 36.069 1.00 0.00 O ATOM 388 CB PRO A 56 32.061 -5.314 36.621 1.00 0.00 C ATOM 0 HA PRO A 56 30.782 -4.752 34.979 1.00 0.00 H new ATOM 390 N ALA A 57 32.424 -2.249 36.368 1.00 0.00 N ATOM 391 CA ALA A 57 32.270 -0.899 36.878 1.00 0.00 C ATOM 392 C ALA A 57 31.824 0.018 35.748 1.00 0.00 C ATOM 393 O ALA A 57 31.038 -0.400 34.900 1.00 0.00 O ATOM 394 CB ALA A 57 33.593 -0.426 37.473 1.00 0.00 C ATOM 0 H ALA A 57 33.391 -2.571 36.321 1.00 0.00 H new ATOM 0 HA ALA A 57 31.513 -0.879 37.662 1.00 0.00 H new ATOM 0 HB1 ALA A 57 33.478 0.588 37.856 1.00 0.00 H new ATOM 0 HB2 ALA A 57 33.884 -1.090 38.286 1.00 0.00 H new ATOM 0 HB3 ALA A 57 34.363 -0.437 36.702 1.00 0.00 H new ATOM 397 N GLY A 58 32.334 1.257 35.732 1.00 0.00 N ATOM 398 CA GLY A 58 32.026 2.252 34.718 1.00 0.00 C ATOM 399 C GLY A 58 33.340 2.693 34.086 1.00 0.00 C ATOM 400 O GLY A 58 33.931 3.676 34.527 1.00 0.00 O ATOM 0 H GLY A 58 32.984 1.594 36.442 1.00 0.00 H new ATOM 0 HA2 GLY A 58 31.360 1.835 33.963 1.00 0.00 H new ATOM 0 HA3 GLY A 58 31.511 3.104 35.162 1.00 0.00 H new ATOM 404 N THR A 59 33.779 1.938 33.072 1.00 0.00 N ATOM 405 CA THR A 59 35.017 2.177 32.348 1.00 0.00 C ATOM 406 C THR A 59 36.158 1.465 33.060 1.00 0.00 C ATOM 407 O THR A 59 37.298 1.925 33.022 1.00 0.00 O ATOM 408 CB THR A 59 35.296 3.668 32.165 1.00 0.00 C ATOM 0 H THR A 59 33.265 1.126 32.730 1.00 0.00 H new ATOM 0 HA THR A 59 34.921 1.768 31.342 1.00 0.00 H new ATOM 411 N SER A 60 35.831 0.337 33.700 1.00 0.00 N ATOM 412 CA SER A 60 36.789 -0.473 34.432 1.00 0.00 C ATOM 413 C SER A 60 36.023 -1.462 35.298 1.00 0.00 C ATOM 414 O SER A 60 34.803 -1.555 35.191 1.00 0.00 O ATOM 415 CB SER A 60 37.680 0.410 35.303 1.00 0.00 C ATOM 0 H SER A 60 34.882 -0.036 33.720 1.00 0.00 H new ATOM 0 HA SER A 60 37.429 -1.009 33.731 1.00 0.00 H new ATOM 418 N SER A 61 36.730 -2.201 36.156 1.00 0.00 N ATOM 419 CA SER A 61 36.090 -3.171 37.024 1.00 0.00 C ATOM 420 C SER A 61 37.092 -3.765 38.003 1.00 0.00 C ATOM 421 O SER A 61 38.192 -3.241 38.166 1.00 0.00 O ATOM 422 CB SER A 61 35.457 -4.269 36.176 1.00 0.00 C ATOM 0 H SER A 61 37.743 -2.141 36.262 1.00 0.00 H new ATOM 0 HA SER A 61 35.314 -2.670 37.603 1.00 0.00 H new ATOM 425 N THR A 62 36.697 -4.867 38.649 1.00 0.00 N ATOM 426 CA THR A 62 37.532 -5.556 39.614 1.00 0.00 C ATOM 427 C THR A 62 37.110 -7.017 39.677 1.00 0.00 C ATOM 428 O THR A 62 36.242 -7.383 40.466 1.00 0.00 O ATOM 429 CB THR A 62 37.391 -4.889 40.979 1.00 0.00 C ATOM 0 H THR A 62 35.784 -5.301 38.510 1.00 0.00 H new ATOM 0 HA THR A 62 38.579 -5.503 39.314 1.00 0.00 H new ATOM 432 N ASP A 63 37.734 -7.853 38.843 1.00 0.00 N ATOM 433 CA ASP A 63 37.415 -9.266 38.796 1.00 0.00 C ATOM 434 C ASP A 63 38.409 -9.998 37.907 1.00 0.00 C ATOM 435 O ASP A 63 38.710 -11.166 38.146 1.00 0.00 O ATOM 436 CB ASP A 63 35.994 -9.443 38.270 1.00 0.00 C ATOM 0 H ASP A 63 38.465 -7.566 38.192 1.00 0.00 H new ATOM 0 HA ASP A 63 37.480 -9.688 39.799 1.00 0.00 H new ATOM 439 N LEU A 64 38.924 -9.303 36.889 1.00 0.00 N ATOM 440 CA LEU A 64 39.876 -9.876 35.957 1.00 0.00 C ATOM 441 C LEU A 64 41.281 -9.800 36.539 1.00 0.00 C ATOM 442 O LEU A 64 42.036 -8.886 36.216 1.00 0.00 O ATOM 443 CB LEU A 64 39.805 -9.111 34.638 1.00 0.00 C ATOM 0 H LEU A 64 38.688 -8.330 36.695 1.00 0.00 H new ATOM 0 HA LEU A 64 39.633 -10.923 35.779 1.00 0.00 H new ATOM 446 N PRO A 65 41.629 -10.766 37.393 1.00 0.00 N ATOM 447 CA PRO A 65 42.942 -10.813 38.008 1.00 0.00 C ATOM 448 C PRO A 65 44.012 -10.785 36.926 1.00 0.00 C ATOM 449 O PRO A 65 45.134 -10.350 37.178 1.00 0.00 O ATOM 450 CB PRO A 65 43.101 -9.632 38.962 1.00 0.00 C ATOM 0 HA PRO A 65 43.052 -11.735 38.578 1.00 0.00 H new ATOM 452 N GLY A 66 43.645 -11.247 35.726 1.00 0.00 N ATOM 453 CA GLY A 66 44.533 -11.281 34.577 1.00 0.00 C ATOM 454 C GLY A 66 43.711 -11.021 33.322 1.00 0.00 C ATOM 455 O GLY A 66 43.355 -11.955 32.607 1.00 0.00 O ATOM 0 H GLY A 66 42.712 -11.610 35.531 1.00 0.00 H new ATOM 0 HA2 GLY A 66 45.315 -10.528 34.680 1.00 0.00 H new ATOM 0 HA3 GLY A 66 45.029 -12.249 34.511 1.00 0.00 H new ATOM 459 N GLN A 67 43.411 -9.745 33.068 1.00 0.00 N ATOM 460 CA GLN A 67 42.622 -9.339 31.921 1.00 0.00 C ATOM 461 C GLN A 67 43.180 -9.935 30.637 1.00 0.00 C ATOM 462 O GLN A 67 42.521 -10.757 30.003 1.00 0.00 O ATOM 463 CB GLN A 67 42.596 -7.816 31.839 1.00 0.00 C ATOM 0 H GLN A 67 43.713 -8.969 33.658 1.00 0.00 H new ATOM 0 HA GLN A 67 41.605 -9.711 32.042 1.00 0.00 H new ATOM 466 N THR A 68 44.392 -9.523 30.253 1.00 0.00 N ATOM 467 CA THR A 68 45.020 -10.013 29.041 1.00 0.00 C ATOM 468 C THR A 68 46.307 -9.242 28.787 1.00 0.00 C ATOM 469 O THR A 68 47.375 -9.839 28.668 1.00 0.00 O ATOM 470 CB THR A 68 44.063 -9.850 27.863 1.00 0.00 C ATOM 0 H THR A 68 44.953 -8.848 30.773 1.00 0.00 H new ATOM 0 HA THR A 68 45.258 -11.071 29.155 1.00 0.00 H new ATOM 473 N GLU A 69 46.199 -7.913 28.704 1.00 0.00 N ATOM 474 CA GLU A 69 47.345 -7.058 28.467 1.00 0.00 C ATOM 475 C GLU A 69 47.032 -5.641 28.924 1.00 0.00 C ATOM 476 O GLU A 69 47.416 -4.675 28.269 1.00 0.00 O ATOM 477 CB GLU A 69 47.704 -7.085 26.984 1.00 0.00 C ATOM 0 H GLU A 69 45.317 -7.411 28.800 1.00 0.00 H new ATOM 0 HA GLU A 69 48.200 -7.422 29.037 1.00 0.00 H new ATOM 480 N ALA A 70 46.324 -5.520 30.050 1.00 0.00 N ATOM 481 CA ALA A 70 45.971 -4.226 30.597 1.00 0.00 C ATOM 482 C ALA A 70 47.232 -3.412 30.860 1.00 0.00 C ATOM 483 O ALA A 70 47.158 -2.198 31.034 1.00 0.00 O ATOM 484 CB ALA A 70 45.177 -4.421 31.885 1.00 0.00 C ATOM 0 H ALA A 70 45.987 -6.313 30.596 1.00 0.00 H new ATOM 0 HA ALA A 70 45.355 -3.681 29.882 1.00 0.00 H new ATOM 0 HB1 ALA A 70 44.910 -3.449 32.299 1.00 0.00 H new ATOM 0 HB2 ALA A 70 44.270 -4.986 31.671 1.00 0.00 H new ATOM 0 HB3 ALA A 70 45.783 -4.968 32.607 1.00 0.00 H new ATOM 487 N LYS A 71 48.388 -4.084 30.886 1.00 0.00 N ATOM 488 CA LYS A 71 49.660 -3.432 31.124 1.00 0.00 C ATOM 489 C LYS A 71 49.762 -3.007 32.580 1.00 0.00 C ATOM 490 O LYS A 71 48.806 -2.481 33.146 1.00 0.00 O ATOM 491 CB LYS A 71 49.815 -2.235 30.189 1.00 0.00 C ATOM 0 H LYS A 71 48.458 -5.091 30.742 1.00 0.00 H new ATOM 0 HA LYS A 71 50.469 -4.132 30.917 1.00 0.00 H new ATOM 494 N ALA A 72 50.926 -3.245 33.190 1.00 0.00 N ATOM 495 CA ALA A 72 51.154 -2.883 34.573 1.00 0.00 C ATOM 496 C ALA A 72 50.236 -3.673 35.493 1.00 0.00 C ATOM 497 O ALA A 72 49.993 -3.252 36.623 1.00 0.00 O ATOM 498 CB ALA A 72 50.919 -1.386 34.744 1.00 0.00 C ATOM 0 H ALA A 72 51.724 -3.690 32.736 1.00 0.00 H new ATOM 0 HA ALA A 72 52.183 -3.122 34.841 1.00 0.00 H new ATOM 0 HB1 ALA A 72 51.089 -1.107 35.784 1.00 0.00 H new ATOM 0 HB2 ALA A 72 51.607 -0.834 34.103 1.00 0.00 H new ATOM 0 HB3 ALA A 72 49.893 -1.145 34.467 1.00 0.00 H new ATOM 501 N ALA A 73 49.738 -4.815 35.008 1.00 0.00 N ATOM 502 CA ALA A 73 48.833 -5.651 35.776 1.00 0.00 C ATOM 503 C ALA A 73 47.683 -4.789 36.273 1.00 0.00 C ATOM 504 O ALA A 73 47.424 -4.712 37.472 1.00 0.00 O ATOM 505 CB ALA A 73 49.584 -6.290 36.940 1.00 0.00 C ATOM 0 H ALA A 73 49.953 -5.177 34.079 1.00 0.00 H new ATOM 0 HA ALA A 73 48.435 -6.453 35.155 1.00 0.00 H new ATOM 0 HB1 ALA A 73 48.901 -6.916 37.514 1.00 0.00 H new ATOM 0 HB2 ALA A 73 50.400 -6.901 36.555 1.00 0.00 H new ATOM 0 HB3 ALA A 73 49.988 -5.509 37.585 1.00 0.00 H new ATOM 508 N ILE A 74 47.008 -4.128 35.333 1.00 0.00 N ATOM 509 CA ILE A 74 45.923 -3.236 35.678 1.00 0.00 C ATOM 510 C ILE A 74 44.785 -3.980 36.359 1.00 0.00 C ATOM 511 O ILE A 74 43.641 -3.537 36.282 1.00 0.00 O ATOM 512 CB ILE A 74 45.437 -2.502 34.431 1.00 0.00 C ATOM 0 H ILE A 74 47.199 -4.199 34.334 1.00 0.00 H new ATOM 0 HA ILE A 74 46.295 -2.501 36.392 1.00 0.00 H new ATOM 515 N TRP A 75 45.108 -5.096 37.025 1.00 0.00 N ATOM 516 CA TRP A 75 44.145 -5.907 37.753 1.00 0.00 C ATOM 517 C TRP A 75 44.251 -5.622 39.249 1.00 0.00 C ATOM 518 O TRP A 75 43.370 -6.028 40.004 1.00 0.00 O ATOM 519 CB TRP A 75 44.438 -7.380 37.481 1.00 0.00 C ATOM 0 H TRP A 75 46.060 -5.459 37.069 1.00 0.00 H new ATOM 0 HA TRP A 75 43.134 -5.665 37.423 1.00 0.00 H new ATOM 522 N ALA A 76 45.324 -4.924 39.654 1.00 0.00 N ATOM 523 CA ALA A 76 45.587 -4.569 41.041 1.00 0.00 C ATOM 524 C ALA A 76 45.486 -3.058 41.205 1.00 0.00 C ATOM 525 O ALA A 76 46.060 -2.317 40.409 1.00 0.00 O ATOM 526 CB ALA A 76 46.987 -5.047 41.417 1.00 0.00 C ATOM 0 H ALA A 76 46.040 -4.589 39.009 1.00 0.00 H new ATOM 0 HA ALA A 76 44.855 -5.044 41.695 1.00 0.00 H new ATOM 0 HB1 ALA A 76 47.194 -4.786 42.455 1.00 0.00 H new ATOM 0 HB2 ALA A 76 47.047 -6.129 41.296 1.00 0.00 H new ATOM 0 HB3 ALA A 76 47.721 -4.568 40.769 1.00 0.00 H new ATOM 529 N ASN A 77 44.735 -2.632 42.227 1.00 0.00 N ATOM 530 CA ASN A 77 44.517 -1.230 42.554 1.00 0.00 C ATOM 531 C ASN A 77 43.306 -0.721 41.788 1.00 0.00 C ATOM 532 O ASN A 77 43.340 0.365 41.216 1.00 0.00 O ATOM 533 CB ASN A 77 45.760 -0.379 42.297 1.00 0.00 C ATOM 0 H ASN A 77 44.254 -3.271 42.860 1.00 0.00 H new ATOM 0 HA ASN A 77 44.318 -1.145 43.622 1.00 0.00 H new ATOM 536 N MET A 78 42.251 -1.542 41.781 1.00 0.00 N ATOM 537 CA MET A 78 41.006 -1.223 41.105 1.00 0.00 C ATOM 538 C MET A 78 40.552 0.191 41.439 1.00 0.00 C ATOM 539 O MET A 78 39.968 0.871 40.598 1.00 0.00 O ATOM 540 CB MET A 78 39.940 -2.238 41.509 1.00 0.00 C ATOM 0 H MET A 78 42.245 -2.449 42.248 1.00 0.00 H new ATOM 0 HA MET A 78 41.164 -1.273 40.028 1.00 0.00 H new ATOM 543 N ASP A 79 40.834 0.640 42.665 1.00 0.00 N ATOM 544 CA ASP A 79 40.455 1.972 43.096 1.00 0.00 C ATOM 545 C ASP A 79 41.243 3.016 42.317 1.00 0.00 C ATOM 546 O ASP A 79 40.653 3.864 41.651 1.00 0.00 O ATOM 547 CB ASP A 79 40.707 2.111 44.595 1.00 0.00 C ATOM 0 H ASP A 79 41.325 0.093 43.372 1.00 0.00 H new ATOM 0 HA ASP A 79 39.394 2.131 42.901 1.00 0.00 H new ATOM 550 N ASP A 80 42.574 2.952 42.410 1.00 0.00 N ATOM 551 CA ASP A 80 43.441 3.882 41.710 1.00 0.00 C ATOM 552 C ASP A 80 43.091 3.873 40.230 1.00 0.00 C ATOM 553 O ASP A 80 42.923 4.927 39.620 1.00 0.00 O ATOM 554 CB ASP A 80 44.898 3.482 41.927 1.00 0.00 C ATOM 0 H ASP A 80 43.070 2.258 42.969 1.00 0.00 H new ATOM 0 HA ASP A 80 43.300 4.891 42.097 1.00 0.00 H new ATOM 557 N PHE A 81 42.977 2.671 39.662 1.00 0.00 N ATOM 558 CA PHE A 81 42.619 2.516 38.269 1.00 0.00 C ATOM 559 C PHE A 81 41.306 3.244 38.023 1.00 0.00 C ATOM 560 O PHE A 81 41.187 4.010 37.069 1.00 0.00 O ATOM 561 CB PHE A 81 42.495 1.032 37.933 1.00 0.00 C ATOM 0 H PHE A 81 43.130 1.792 40.157 1.00 0.00 H new ATOM 0 HA PHE A 81 43.389 2.943 37.627 1.00 0.00 H new ATOM 564 N GLY A 82 40.323 3.013 38.898 1.00 0.00 N ATOM 565 CA GLY A 82 39.036 3.665 38.791 1.00 0.00 C ATOM 566 C GLY A 82 39.245 5.171 38.794 1.00 0.00 C ATOM 567 O GLY A 82 38.550 5.895 38.085 1.00 0.00 O ATOM 0 H GLY A 82 40.405 2.374 39.689 1.00 0.00 H new ATOM 0 HA2 GLY A 82 38.532 3.356 37.875 1.00 0.00 H new ATOM 0 HA3 GLY A 82 38.395 3.372 39.622 1.00 0.00 H new ATOM 571 N ALA A 83 40.213 5.636 39.590 1.00 0.00 N ATOM 572 CA ALA A 83 40.523 7.050 39.677 1.00 0.00 C ATOM 573 C ALA A 83 40.795 7.610 38.288 1.00 0.00 C ATOM 574 O ALA A 83 40.074 8.495 37.834 1.00 0.00 O ATOM 575 CB ALA A 83 41.724 7.257 40.595 1.00 0.00 C ATOM 0 H ALA A 83 40.793 5.043 40.183 1.00 0.00 H new ATOM 0 HA ALA A 83 39.671 7.584 40.097 1.00 0.00 H new ATOM 0 HB1 ALA A 83 41.955 8.320 40.658 1.00 0.00 H new ATOM 0 HB2 ALA A 83 41.492 6.876 41.590 1.00 0.00 H new ATOM 0 HB3 ALA A 83 42.585 6.722 40.194 1.00 0.00 H new ATOM 578 N LYS A 84 41.838 7.099 37.623 1.00 0.00 N ATOM 579 CA LYS A 84 42.196 7.541 36.284 1.00 0.00 C ATOM 580 C LYS A 84 40.975 7.464 35.378 1.00 0.00 C ATOM 581 O LYS A 84 40.766 8.329 34.533 1.00 0.00 O ATOM 582 CB LYS A 84 43.325 6.666 35.746 1.00 0.00 C ATOM 0 H LYS A 84 42.448 6.374 38.000 1.00 0.00 H new ATOM 0 HA LYS A 84 42.540 8.575 36.314 1.00 0.00 H new ATOM 585 N GLY A 85 40.213 6.392 35.589 1.00 0.00 N ATOM 586 CA GLY A 85 38.982 6.159 34.851 1.00 0.00 C ATOM 587 C GLY A 85 38.170 7.445 34.919 1.00 0.00 C ATOM 588 O GLY A 85 37.917 8.089 33.902 1.00 0.00 O ATOM 0 H GLY A 85 40.433 5.668 36.272 1.00 0.00 H new ATOM 0 HA2 GLY A 85 39.198 5.894 33.816 1.00 0.00 H new ATOM 0 HA3 GLY A 85 38.425 5.328 35.284 1.00 0.00 H new ATOM 592 N LYS A 86 37.790 7.796 36.147 1.00 0.00 N ATOM 593 CA LYS A 86 37.074 9.030 36.406 1.00 0.00 C ATOM 594 C LYS A 86 37.818 10.196 35.754 1.00 0.00 C ATOM 595 O LYS A 86 37.194 11.083 35.176 1.00 0.00 O ATOM 596 CB LYS A 86 36.955 9.239 37.913 1.00 0.00 C ATOM 0 H LYS A 86 37.971 7.234 36.979 1.00 0.00 H new ATOM 0 HA LYS A 86 36.072 8.976 35.981 1.00 0.00 H new ATOM 599 N ALA A 87 39.152 10.178 35.847 1.00 0.00 N ATOM 600 CA ALA A 87 39.971 11.238 35.279 1.00 0.00 C ATOM 601 C ALA A 87 39.645 11.451 33.805 1.00 0.00 C ATOM 602 O ALA A 87 39.365 12.570 33.379 1.00 0.00 O ATOM 603 CB ALA A 87 41.449 10.913 35.464 1.00 0.00 C ATOM 0 H ALA A 87 39.681 9.439 36.311 1.00 0.00 H new ATOM 0 HA ALA A 87 39.748 12.166 35.806 1.00 0.00 H new ATOM 0 HB1 ALA A 87 42.054 11.712 35.036 1.00 0.00 H new ATOM 0 HB2 ALA A 87 41.671 10.820 36.527 1.00 0.00 H new ATOM 0 HB3 ALA A 87 41.681 9.974 34.962 1.00 0.00 H new ATOM 606 N MET A 88 39.691 10.368 33.031 1.00 0.00 N ATOM 607 CA MET A 88 39.389 10.415 31.617 1.00 0.00 C ATOM 608 C MET A 88 38.004 11.016 31.449 1.00 0.00 C ATOM 609 O MET A 88 37.782 11.826 30.553 1.00 0.00 O ATOM 610 CB MET A 88 39.451 9.007 31.032 1.00 0.00 C ATOM 0 H MET A 88 39.939 9.440 33.373 1.00 0.00 H new ATOM 0 HA MET A 88 40.116 11.029 31.086 1.00 0.00 H new ATOM 613 N HIS A 89 37.076 10.626 32.328 1.00 0.00 N ATOM 614 CA HIS A 89 35.723 11.164 32.305 1.00 0.00 C ATOM 615 C HIS A 89 35.784 12.682 32.477 1.00 0.00 C ATOM 616 O HIS A 89 35.019 13.416 31.856 1.00 0.00 O ATOM 617 CB HIS A 89 34.903 10.524 33.422 1.00 0.00 C ATOM 0 H HIS A 89 37.243 9.939 33.063 1.00 0.00 H new ATOM 0 HA HIS A 89 35.245 10.938 31.352 1.00 0.00 H new ATOM 620 N GLU A 90 36.666 13.120 33.379 1.00 0.00 N ATOM 621 CA GLU A 90 36.892 14.549 33.586 1.00 0.00 C ATOM 622 C GLU A 90 37.158 15.195 32.220 1.00 0.00 C ATOM 623 O GLU A 90 36.695 16.295 31.928 1.00 0.00 O ATOM 624 CB GLU A 90 38.068 14.757 34.535 1.00 0.00 C ATOM 0 H GLU A 90 37.230 12.511 33.972 1.00 0.00 H new ATOM 0 HA GLU A 90 36.017 15.015 34.040 1.00 0.00 H new ATOM 627 N ALA A 91 37.896 14.452 31.395 1.00 0.00 N ATOM 628 CA ALA A 91 38.206 14.874 30.030 1.00 0.00 C ATOM 629 C ALA A 91 36.953 14.748 29.156 1.00 0.00 C ATOM 630 O ALA A 91 36.701 15.554 28.263 1.00 0.00 O ATOM 631 CB ALA A 91 39.315 13.983 29.484 1.00 0.00 C ATOM 0 H ALA A 91 38.293 13.548 31.652 1.00 0.00 H new ATOM 0 HA ALA A 91 38.534 15.913 30.024 1.00 0.00 H new ATOM 0 HB1 ALA A 91 39.557 14.286 28.465 1.00 0.00 H new ATOM 0 HB2 ALA A 91 40.201 14.079 30.112 1.00 0.00 H new ATOM 0 HB3 ALA A 91 38.981 12.945 29.484 1.00 0.00 H new ATOM 634 N GLY A 92 36.186 13.707 29.467 1.00 0.00 N ATOM 635 CA GLY A 92 34.946 13.411 28.780 1.00 0.00 C ATOM 636 C GLY A 92 34.039 14.639 28.775 1.00 0.00 C ATOM 637 O GLY A 92 33.818 15.257 27.731 1.00 0.00 O ATOM 0 H GLY A 92 36.414 13.045 30.208 1.00 0.00 H new ATOM 0 HA2 GLY A 92 35.154 13.100 27.756 1.00 0.00 H new ATOM 0 HA3 GLY A 92 34.440 12.579 29.270 1.00 0.00 H new ATOM 641 N GLY A 93 33.515 15.014 29.946 1.00 0.00 N ATOM 642 CA GLY A 93 32.627 16.149 30.064 1.00 0.00 C ATOM 643 C GLY A 93 33.358 17.426 29.691 1.00 0.00 C ATOM 644 O GLY A 93 32.762 18.317 29.094 1.00 0.00 O ATOM 0 H GLY A 93 33.700 14.535 30.827 1.00 0.00 H new ATOM 0 HA2 GLY A 93 31.762 16.013 29.414 1.00 0.00 H new ATOM 0 HA3 GLY A 93 32.251 16.221 31.084 1.00 0.00 H new ATOM 648 N ALA A 94 34.645 17.516 30.042 1.00 0.00 N ATOM 649 CA ALA A 94 35.453 18.679 29.732 1.00 0.00 C ATOM 650 C ALA A 94 35.371 18.991 28.245 1.00 0.00 C ATOM 651 O ALA A 94 35.100 20.128 27.865 1.00 0.00 O ATOM 652 CB ALA A 94 36.898 18.417 30.149 1.00 0.00 C ATOM 0 H ALA A 94 35.145 16.784 30.546 1.00 0.00 H new ATOM 0 HA ALA A 94 35.077 19.542 30.282 1.00 0.00 H new ATOM 0 HB1 ALA A 94 37.508 19.290 29.917 1.00 0.00 H new ATOM 0 HB2 ALA A 94 36.938 18.221 31.221 1.00 0.00 H new ATOM 0 HB3 ALA A 94 37.282 17.552 29.608 1.00 0.00 H new ATOM 655 N VAL A 95 35.596 17.982 27.399 1.00 0.00 N ATOM 656 CA VAL A 95 35.523 18.165 25.964 1.00 0.00 C ATOM 657 C VAL A 95 34.107 18.593 25.616 1.00 0.00 C ATOM 658 O VAL A 95 33.911 19.431 24.740 1.00 0.00 O ATOM 659 CB VAL A 95 35.891 16.864 25.260 1.00 0.00 C ATOM 0 H VAL A 95 35.830 17.033 27.692 1.00 0.00 H new ATOM 0 HA VAL A 95 36.225 18.931 25.635 1.00 0.00 H new ATOM 662 N ILE A 96 33.130 18.006 26.315 1.00 0.00 N ATOM 663 CA ILE A 96 31.736 18.363 26.110 1.00 0.00 C ATOM 664 C ILE A 96 31.595 19.876 26.269 1.00 0.00 C ATOM 665 O ILE A 96 31.054 20.560 25.399 1.00 0.00 O ATOM 666 CB ILE A 96 30.865 17.624 27.122 1.00 0.00 C ATOM 0 H ILE A 96 33.284 17.287 27.022 1.00 0.00 H new ATOM 0 HA ILE A 96 31.410 18.076 25.110 1.00 0.00 H new ATOM 669 N ALA A 97 32.111 20.391 27.388 1.00 0.00 N ATOM 670 CA ALA A 97 32.085 21.812 27.664 1.00 0.00 C ATOM 671 C ALA A 97 32.765 22.535 26.511 1.00 0.00 C ATOM 672 O ALA A 97 32.249 23.533 26.013 1.00 0.00 O ATOM 673 CB ALA A 97 32.805 22.089 28.981 1.00 0.00 C ATOM 0 H ALA A 97 32.553 19.832 28.117 1.00 0.00 H new ATOM 0 HA ALA A 97 31.059 22.168 27.758 1.00 0.00 H new ATOM 0 HB1 ALA A 97 32.785 23.159 29.188 1.00 0.00 H new ATOM 0 HB2 ALA A 97 32.305 21.554 29.788 1.00 0.00 H new ATOM 0 HB3 ALA A 97 33.839 21.753 28.908 1.00 0.00 H new ATOM 676 N ALA A 98 33.921 22.014 26.089 1.00 0.00 N ATOM 677 CA ALA A 98 34.668 22.580 24.983 1.00 0.00 C ATOM 678 C ALA A 98 33.754 22.700 23.773 1.00 0.00 C ATOM 679 O ALA A 98 33.781 23.710 23.073 1.00 0.00 O ATOM 680 CB ALA A 98 35.867 21.689 24.671 1.00 0.00 C ATOM 0 H ALA A 98 34.356 21.192 26.508 1.00 0.00 H new ATOM 0 HA ALA A 98 35.034 23.572 25.246 1.00 0.00 H new ATOM 0 HB1 ALA A 98 36.429 22.114 23.839 1.00 0.00 H new ATOM 0 HB2 ALA A 98 36.510 21.624 25.549 1.00 0.00 H new ATOM 0 HB3 ALA A 98 35.519 20.692 24.402 1.00 0.00 H new ATOM 683 N ALA A 99 32.942 21.664 23.542 1.00 0.00 N ATOM 684 CA ALA A 99 31.996 21.648 22.444 1.00 0.00 C ATOM 685 C ALA A 99 31.142 22.902 22.506 1.00 0.00 C ATOM 686 O ALA A 99 31.053 23.644 21.530 1.00 0.00 O ATOM 687 CB ALA A 99 31.112 20.410 22.552 1.00 0.00 C ATOM 0 H ALA A 99 32.929 20.820 24.114 1.00 0.00 H new ATOM 0 HA ALA A 99 32.531 21.621 21.495 1.00 0.00 H new ATOM 0 HB1 ALA A 99 30.400 20.398 21.726 1.00 0.00 H new ATOM 0 HB2 ALA A 99 31.733 19.515 22.509 1.00 0.00 H new ATOM 0 HB3 ALA A 99 30.570 20.431 23.498 1.00 0.00 H new ATOM 690 N ASN A 100 30.521 23.142 23.663 1.00 0.00 N ATOM 691 CA ASN A 100 29.689 24.313 23.853 1.00 0.00 C ATOM 692 C ASN A 100 30.574 25.535 24.057 1.00 0.00 C ATOM 693 O ASN A 100 30.338 26.584 23.463 1.00 0.00 O ATOM 694 CB ASN A 100 28.780 24.098 25.060 1.00 0.00 C ATOM 0 H ASN A 100 30.584 22.534 24.479 1.00 0.00 H new ATOM 0 HA ASN A 100 29.068 24.475 22.972 1.00 0.00 H new ATOM 697 N ALA A 101 31.602 25.391 24.898 1.00 0.00 N ATOM 698 CA ALA A 101 32.520 26.475 25.187 1.00 0.00 C ATOM 699 C ALA A 101 33.178 26.979 23.909 1.00 0.00 C ATOM 700 O ALA A 101 33.316 28.185 23.718 1.00 0.00 O ATOM 701 CB ALA A 101 33.576 25.994 26.179 1.00 0.00 C ATOM 0 H ALA A 101 31.813 24.523 25.390 1.00 0.00 H new ATOM 0 HA ALA A 101 31.965 27.304 25.627 1.00 0.00 H new ATOM 0 HB1 ALA A 101 34.267 26.808 26.398 1.00 0.00 H new ATOM 0 HB2 ALA A 101 33.090 25.673 27.101 1.00 0.00 H new ATOM 0 HB3 ALA A 101 34.125 25.157 25.748 1.00 0.00 H new ATOM 704 N GLY A 102 33.582 26.058 23.030 1.00 0.00 N ATOM 705 CA GLY A 102 34.228 26.423 21.785 1.00 0.00 C ATOM 706 C GLY A 102 35.638 26.927 22.061 1.00 0.00 C ATOM 707 O GLY A 102 36.205 26.638 23.112 1.00 0.00 O ATOM 0 H GLY A 102 33.469 25.054 23.166 1.00 0.00 H new ATOM 0 HA2 GLY A 102 34.264 25.562 21.118 1.00 0.00 H new ATOM 0 HA3 GLY A 102 33.649 27.195 21.278 1.00 0.00 H new ATOM 711 N ASP A 103 36.200 27.686 21.116 1.00 0.00 N ATOM 712 CA ASP A 103 37.533 28.239 21.254 1.00 0.00 C ATOM 713 C ASP A 103 38.586 27.144 21.144 1.00 0.00 C ATOM 714 O ASP A 103 38.525 26.146 21.858 1.00 0.00 O ATOM 715 CB ASP A 103 37.649 28.973 22.588 1.00 0.00 C ATOM 0 H ASP A 103 35.738 27.929 20.240 1.00 0.00 H new ATOM 0 HA ASP A 103 37.707 28.949 20.445 1.00 0.00 H new ATOM 718 N GLY A 104 39.553 27.339 20.244 1.00 0.00 N ATOM 719 CA GLY A 104 40.625 26.383 20.043 1.00 0.00 C ATOM 720 C GLY A 104 41.638 26.467 21.179 1.00 0.00 C ATOM 721 O GLY A 104 42.463 25.569 21.337 1.00 0.00 O ATOM 0 H GLY A 104 39.608 28.161 19.642 1.00 0.00 H new ATOM 0 HA2 GLY A 104 40.215 25.375 19.988 1.00 0.00 H new ATOM 0 HA3 GLY A 104 41.120 26.578 19.092 1.00 0.00 H new ATOM 725 N ALA A 105 41.569 27.541 21.971 1.00 0.00 N ATOM 726 CA ALA A 105 42.472 27.735 23.088 1.00 0.00 C ATOM 727 C ALA A 105 41.981 26.900 24.260 1.00 0.00 C ATOM 728 O ALA A 105 42.718 26.076 24.800 1.00 0.00 O ATOM 729 CB ALA A 105 42.509 29.215 23.458 1.00 0.00 C ATOM 0 H ALA A 105 40.888 28.290 21.850 1.00 0.00 H new ATOM 0 HA ALA A 105 43.481 27.421 22.822 1.00 0.00 H new ATOM 0 HB1 ALA A 105 43.188 29.363 24.298 1.00 0.00 H new ATOM 0 HB2 ALA A 105 42.857 29.795 22.603 1.00 0.00 H new ATOM 0 HB3 ALA A 105 41.509 29.545 23.737 1.00 0.00 H new ATOM 732 N ALA A 106 40.716 27.102 24.637 1.00 0.00 N ATOM 733 CA ALA A 106 40.119 26.372 25.733 1.00 0.00 C ATOM 734 C ALA A 106 39.983 24.915 25.326 1.00 0.00 C ATOM 735 O ALA A 106 40.012 24.026 26.175 1.00 0.00 O ATOM 736 CB ALA A 106 38.756 26.974 26.062 1.00 0.00 C ATOM 0 H ALA A 106 40.091 27.772 24.189 1.00 0.00 H new ATOM 0 HA ALA A 106 40.745 26.438 26.623 1.00 0.00 H new ATOM 0 HB1 ALA A 106 38.305 26.424 26.888 1.00 0.00 H new ATOM 0 HB2 ALA A 106 38.879 28.019 26.346 1.00 0.00 H new ATOM 0 HB3 ALA A 106 38.109 26.909 25.187 1.00 0.00 H new ATOM 739 N PHE A 107 39.847 24.668 24.020 1.00 0.00 N ATOM 740 CA PHE A 107 39.718 23.323 23.503 1.00 0.00 C ATOM 741 C PHE A 107 41.005 22.556 23.763 1.00 0.00 C ATOM 742 O PHE A 107 41.004 21.624 24.559 1.00 0.00 O ATOM 743 CB PHE A 107 39.410 23.378 22.010 1.00 0.00 C ATOM 0 H PHE A 107 39.825 25.395 23.305 1.00 0.00 H new ATOM 0 HA PHE A 107 38.899 22.808 24.006 1.00 0.00 H new ATOM 746 N GLY A 108 42.090 22.953 23.089 1.00 0.00 N ATOM 747 CA GLY A 108 43.387 22.313 23.233 1.00 0.00 C ATOM 748 C GLY A 108 43.760 22.122 24.698 1.00 0.00 C ATOM 749 O GLY A 108 44.317 21.090 25.070 1.00 0.00 O ATOM 0 H GLY A 108 42.085 23.730 22.428 1.00 0.00 H new ATOM 0 HA2 GLY A 108 43.373 21.345 22.732 1.00 0.00 H new ATOM 0 HA3 GLY A 108 44.148 22.917 22.739 1.00 0.00 H new ATOM 753 N ALA A 109 43.434 23.108 25.537 1.00 0.00 N ATOM 754 CA ALA A 109 43.731 23.008 26.952 1.00 0.00 C ATOM 755 C ALA A 109 42.959 21.815 27.500 1.00 0.00 C ATOM 756 O ALA A 109 43.508 20.980 28.216 1.00 0.00 O ATOM 757 CB ALA A 109 43.317 24.298 27.654 1.00 0.00 C ATOM 0 H ALA A 109 42.970 23.972 25.257 1.00 0.00 H new ATOM 0 HA ALA A 109 44.798 22.866 27.122 1.00 0.00 H new ATOM 0 HB1 ALA A 109 43.541 24.221 28.718 1.00 0.00 H new ATOM 0 HB2 ALA A 109 43.866 25.137 27.227 1.00 0.00 H new ATOM 0 HB3 ALA A 109 42.247 24.459 27.519 1.00 0.00 H new ATOM 760 N ALA A 110 41.678 21.747 27.135 1.00 0.00 N ATOM 761 CA ALA A 110 40.809 20.668 27.562 1.00 0.00 C ATOM 762 C ALA A 110 41.328 19.321 27.069 1.00 0.00 C ATOM 763 O ALA A 110 41.527 18.402 27.862 1.00 0.00 O ATOM 764 CB ALA A 110 39.398 20.922 27.039 1.00 0.00 C ATOM 0 H ALA A 110 41.223 22.438 26.538 1.00 0.00 H new ATOM 0 HA ALA A 110 40.792 20.637 28.651 1.00 0.00 H new ATOM 0 HB1 ALA A 110 38.741 20.113 27.358 1.00 0.00 H new ATOM 0 HB2 ALA A 110 39.028 21.868 27.435 1.00 0.00 H new ATOM 0 HB3 ALA A 110 39.416 20.967 25.950 1.00 0.00 H new ATOM 767 N LEU A 111 41.547 19.199 25.756 1.00 0.00 N ATOM 768 CA LEU A 111 42.007 17.973 25.143 1.00 0.00 C ATOM 769 C LEU A 111 43.357 17.527 25.680 1.00 0.00 C ATOM 770 O LEU A 111 43.686 16.347 25.572 1.00 0.00 O ATOM 771 CB LEU A 111 42.078 18.170 23.631 1.00 0.00 C ATOM 0 H LEU A 111 41.405 19.961 25.093 1.00 0.00 H new ATOM 0 HA LEU A 111 41.296 17.185 25.389 1.00 0.00 H new ATOM 774 N GLN A 112 44.146 18.437 26.260 1.00 0.00 N ATOM 775 CA GLN A 112 45.443 18.102 26.810 1.00 0.00 C ATOM 776 C GLN A 112 45.194 17.484 28.173 1.00 0.00 C ATOM 777 O GLN A 112 45.885 16.551 28.569 1.00 0.00 O ATOM 778 CB GLN A 112 46.288 19.367 26.932 1.00 0.00 C ATOM 0 H GLN A 112 43.895 19.421 26.356 1.00 0.00 H new ATOM 0 HA GLN A 112 45.984 17.404 26.170 1.00 0.00 H new ATOM 781 N LYS A 113 44.196 18.021 28.880 1.00 0.00 N ATOM 782 CA LYS A 113 43.806 17.489 30.169 1.00 0.00 C ATOM 783 C LYS A 113 43.496 16.011 29.966 1.00 0.00 C ATOM 784 O LYS A 113 43.894 15.168 30.766 1.00 0.00 O ATOM 785 CB LYS A 113 42.581 18.239 30.683 1.00 0.00 C ATOM 0 H LYS A 113 43.648 18.825 28.573 1.00 0.00 H new ATOM 0 HA LYS A 113 44.599 17.608 30.907 1.00 0.00 H new ATOM 788 N LEU A 114 42.798 15.711 28.867 1.00 0.00 N ATOM 789 CA LEU A 114 42.448 14.349 28.514 1.00 0.00 C ATOM 790 C LEU A 114 43.676 13.598 28.016 1.00 0.00 C ATOM 791 O LEU A 114 43.776 12.384 28.183 1.00 0.00 O ATOM 792 CB LEU A 114 41.384 14.379 27.420 1.00 0.00 C ATOM 0 H LEU A 114 42.464 16.410 28.204 1.00 0.00 H new ATOM 0 HA LEU A 114 42.062 13.836 29.395 1.00 0.00 H new ATOM 795 N GLY A 115 44.615 14.328 27.410 1.00 0.00 N ATOM 796 CA GLY A 115 45.819 13.736 26.863 1.00 0.00 C ATOM 797 C GLY A 115 46.719 13.214 27.972 1.00 0.00 C ATOM 798 O GLY A 115 47.214 12.091 27.892 1.00 0.00 O ATOM 0 H GLY A 115 44.555 15.339 27.289 1.00 0.00 H new ATOM 0 HA2 GLY A 115 45.555 12.921 26.190 1.00 0.00 H new ATOM 0 HA3 GLY A 115 46.357 14.477 26.271 1.00 0.00 H new ATOM 802 N GLY A 116 46.930 14.026 29.010 1.00 0.00 N ATOM 803 CA GLY A 116 47.775 13.655 30.126 1.00 0.00 C ATOM 804 C GLY A 116 47.007 12.749 31.075 1.00 0.00 C ATOM 805 O GLY A 116 47.604 11.954 31.796 1.00 0.00 O ATOM 0 H GLY A 116 46.517 14.955 29.092 1.00 0.00 H new ATOM 0 HA2 GLY A 116 48.668 13.145 29.764 1.00 0.00 H new ATOM 0 HA3 GLY A 116 48.110 14.548 30.653 1.00 0.00 H new ATOM 809 N THR A 117 45.679 12.866 31.077 1.00 0.00 N ATOM 810 CA THR A 117 44.850 12.043 31.932 1.00 0.00 C ATOM 811 C THR A 117 45.071 10.580 31.578 1.00 0.00 C ATOM 812 O THR A 117 45.408 9.772 32.441 1.00 0.00 O ATOM 813 CB THR A 117 43.386 12.432 31.749 1.00 0.00 C ATOM 0 H THR A 117 45.163 13.524 30.494 1.00 0.00 H new ATOM 0 HA THR A 117 45.118 12.196 32.977 1.00 0.00 H new ATOM 816 N CYS A 118 44.890 10.245 30.298 1.00 0.00 N ATOM 817 CA CYS A 118 45.059 8.885 29.827 1.00 0.00 C ATOM 818 C CYS A 118 46.534 8.507 29.776 1.00 0.00 C ATOM 819 O CYS A 118 46.903 7.402 30.167 1.00 0.00 O ATOM 820 CB CYS A 118 44.424 8.749 28.446 1.00 0.00 C ATOM 0 H CYS A 118 44.624 10.909 29.571 1.00 0.00 H new ATOM 0 HA CYS A 118 44.566 8.204 30.521 1.00 0.00 H new ATOM 823 N LYS A 119 47.380 9.423 29.298 1.00 0.00 N ATOM 824 CA LYS A 119 48.804 9.170 29.182 1.00 0.00 C ATOM 825 C LYS A 119 49.425 8.923 30.551 1.00 0.00 C ATOM 826 O LYS A 119 49.985 7.856 30.795 1.00 0.00 O ATOM 827 CB LYS A 119 49.473 10.357 28.495 1.00 0.00 C ATOM 0 H LYS A 119 47.093 10.350 28.985 1.00 0.00 H new ATOM 0 HA LYS A 119 48.958 8.273 28.582 1.00 0.00 H new ATOM 830 N ALA A 120 49.332 9.914 31.441 1.00 0.00 N ATOM 831 CA ALA A 120 49.890 9.804 32.774 1.00 0.00 C ATOM 832 C ALA A 120 49.331 8.571 33.467 1.00 0.00 C ATOM 833 O ALA A 120 50.088 7.788 34.033 1.00 0.00 O ATOM 834 CB ALA A 120 49.569 11.065 33.572 1.00 0.00 C ATOM 0 H ALA A 120 48.871 10.804 31.252 1.00 0.00 H new ATOM 0 HA ALA A 120 50.973 9.701 32.708 1.00 0.00 H new ATOM 0 HB1 ALA A 120 49.990 10.979 34.574 1.00 0.00 H new ATOM 0 HB2 ALA A 120 49.999 11.932 33.071 1.00 0.00 H new ATOM 0 HB3 ALA A 120 48.488 11.186 33.642 1.00 0.00 H new ATOM 837 N CYS A 121 48.006 8.410 33.425 1.00 0.00 N ATOM 838 CA CYS A 121 47.350 7.269 34.037 1.00 0.00 C ATOM 839 C CYS A 121 47.982 5.969 33.553 1.00 0.00 C ATOM 840 O CYS A 121 48.234 5.063 34.346 1.00 0.00 O ATOM 841 CB CYS A 121 45.862 7.302 33.699 1.00 0.00 C ATOM 0 H CYS A 121 47.370 9.064 32.969 1.00 0.00 H new ATOM 0 HA CYS A 121 47.472 7.320 35.119 1.00 0.00 H new ATOM 844 N HIS A 122 48.252 5.886 32.248 1.00 0.00 N ATOM 845 CA HIS A 122 48.847 4.701 31.661 1.00 0.00 C ATOM 846 C HIS A 122 50.191 4.401 32.313 1.00 0.00 C ATOM 847 O HIS A 122 50.320 3.424 33.047 1.00 0.00 O ATOM 848 CB HIS A 122 49.012 4.908 30.158 1.00 0.00 C ATOM 0 H HIS A 122 48.064 6.634 31.581 1.00 0.00 H new ATOM 0 HA HIS A 122 48.192 3.847 31.833 1.00 0.00 H new ATOM 851 N ASP A 123 51.193 5.240 32.033 1.00 0.00 N ATOM 852 CA ASP A 123 52.525 5.065 32.581 1.00 0.00 C ATOM 853 C ASP A 123 52.463 4.953 34.099 1.00 0.00 C ATOM 854 O ASP A 123 53.328 4.333 34.714 1.00 0.00 O ATOM 855 CB ASP A 123 53.399 6.244 32.165 1.00 0.00 C ATOM 0 H ASP A 123 51.096 6.052 31.423 1.00 0.00 H new ATOM 0 HA ASP A 123 52.959 4.144 32.192 1.00 0.00 H new ATOM 858 N ASP A 124 51.432 5.550 34.699 1.00 0.00 N ATOM 859 CA ASP A 124 51.255 5.519 36.136 1.00 0.00 C ATOM 860 C ASP A 124 51.167 4.073 36.596 1.00 0.00 C ATOM 861 O ASP A 124 51.883 3.667 37.509 1.00 0.00 O ATOM 862 CB ASP A 124 49.988 6.285 36.509 1.00 0.00 C ATOM 0 H ASP A 124 50.706 6.063 34.199 1.00 0.00 H new ATOM 0 HA ASP A 124 52.103 5.994 36.629 1.00 0.00 H new ATOM 865 N TYR A 125 50.288 3.298 35.957 1.00 0.00 N ATOM 866 CA TYR A 125 50.121 1.898 36.291 1.00 0.00 C ATOM 867 C TYR A 125 51.467 1.193 36.186 1.00 0.00 C ATOM 868 O TYR A 125 51.928 0.589 37.152 1.00 0.00 O ATOM 869 CB TYR A 125 49.103 1.267 35.346 1.00 0.00 C ATOM 0 H TYR A 125 49.683 3.626 35.204 1.00 0.00 H new ATOM 0 HA TYR A 125 49.752 1.798 37.312 1.00 0.00 H new ATOM 872 N ARG A 126 52.096 1.280 35.011 1.00 0.00 N ATOM 873 CA ARG A 126 53.386 0.660 34.779 1.00 0.00 C ATOM 874 C ARG A 126 54.484 1.515 35.395 1.00 0.00 C ATOM 875 O ARG A 126 55.564 1.649 34.824 1.00 0.00 O ATOM 876 CB ARG A 126 53.608 0.496 33.278 1.00 0.00 C ATOM 0 H ARG A 126 51.722 1.780 34.205 1.00 0.00 H new ATOM 0 HA ARG A 126 53.411 -0.324 35.246 1.00 0.00 H new ATOM 879 N GLU A 127 54.202 2.100 36.561 1.00 0.00 N ATOM 880 CA GLU A 127 55.164 2.935 37.251 1.00 0.00 C ATOM 881 C GLU A 127 56.375 2.104 37.648 1.00 0.00 C ATOM 882 O GLU A 127 56.418 0.903 37.391 1.00 0.00 O ATOM 883 CB GLU A 127 54.510 3.559 38.480 1.00 0.00 C ATOM 0 H GLU A 127 53.308 2.005 37.042 1.00 0.00 H new ATOM 0 HA GLU A 127 55.497 3.735 36.589 1.00 0.00 H new ATOM 886 N GLU A 128 57.362 2.746 38.278 1.00 0.00 N ATOM 887 CA GLU A 128 58.567 2.065 38.708 1.00 0.00 C ATOM 888 C GLU A 128 59.303 2.916 39.732 1.00 0.00 C ATOM 889 O GLU A 128 58.861 4.015 40.062 1.00 0.00 O ATOM 890 CB GLU A 128 59.453 1.788 37.497 1.00 0.00 C ATOM 0 H GLU A 128 57.341 3.742 38.499 1.00 0.00 H new ATOM 0 HA GLU A 128 58.306 1.116 39.175 1.00 0.00 H new ATOM 893 N ASP A 129 60.429 2.406 40.236 1.00 0.00 N ATOM 894 CA ASP A 129 61.220 3.120 41.218 1.00 0.00 C ATOM 895 C ASP A 129 62.392 2.256 41.661 1.00 0.00 C ATOM 896 O ASP A 129 63.321 2.830 42.270 1.00 0.00 O ATOM 897 CB ASP A 129 60.339 3.489 42.409 1.00 0.00 C ATOM 0 H ASP A 129 60.808 1.496 39.973 1.00 0.00 H new ATOM 0 HA ASP A 129 61.615 4.036 40.778 1.00 0.00 H new TER 900 ASP A 129 HETATM 901 FE HEM A 130 44.827 4.275 27.938 1.00 0.00 FE