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 4.881 1.663 2.010 1.00 0.00 N ATOM 50 CA ASN A 13 4.518 2.390 3.223 1.00 0.00 C ATOM 51 C ASN A 13 3.481 3.449 2.930 1.00 0.00 C ATOM 52 O ASN A 13 2.407 3.491 3.541 1.00 0.00 O ATOM 53 N LEU A 14 3.783 4.314 1.984 1.00 0.00 N ATOM 54 CA LEU A 14 2.951 5.455 1.599 1.00 0.00 C ATOM 55 C LEU A 14 3.297 6.678 2.418 1.00 0.00 C ATOM 56 O LEU A 14 3.562 7.763 1.875 1.00 0.00 O ATOM 0 H LEU A 14 4.642 4.247 1.438 1.00 0.00 H new ATOM 69 N CYS A 18 3.895 10.511 0.556 1.00 0.00 N ATOM 70 CA CYS A 18 2.542 11.074 0.502 1.00 0.00 C ATOM 71 C CYS A 18 2.274 12.040 1.639 1.00 0.00 C ATOM 72 O CYS A 18 1.656 13.099 1.451 1.00 0.00 O ATOM 73 N MET A 19 2.701 11.687 2.836 1.00 0.00 N ATOM 74 CA MET A 19 2.441 12.502 4.020 1.00 0.00 C ATOM 75 C MET A 19 3.204 13.806 3.998 1.00 0.00 C ATOM 76 O MET A 19 2.849 14.768 4.706 1.00 0.00 O ATOM 0 H MET A 19 3.233 10.837 3.021 1.00 0.00 H new ATOM 85 N LYS A 22 2.204 16.189 -2.038 1.00 0.00 N ATOM 86 CA LYS A 22 0.973 15.912 -2.773 1.00 0.00 C ATOM 87 C LYS A 22 1.153 14.740 -3.709 1.00 0.00 C ATOM 88 O LYS A 22 2.111 14.670 -4.490 1.00 0.00 O ATOM 89 N CYS A 23 0.226 13.803 -3.656 1.00 0.00 N ATOM 90 CA CYS A 23 0.335 12.566 -4.427 1.00 0.00 C ATOM 91 C CYS A 23 -1.003 12.054 -4.904 1.00 0.00 C ATOM 92 O CYS A 23 -1.126 10.898 -5.348 1.00 0.00 O ATOM 0 H CYS A 23 -0.617 13.870 -3.086 1.00 0.00 H new ATOM 93 N SER A 24 -2.025 12.886 -4.849 1.00 0.00 N ATOM 94 CA SER A 24 -3.384 12.461 -5.174 1.00 0.00 C ATOM 95 C SER A 24 -3.750 11.196 -4.434 1.00 0.00 C ATOM 96 O SER A 24 -3.080 10.768 -3.486 1.00 0.00 O ATOM 0 H SER A 24 -1.945 13.867 -4.581 1.00 0.00 H new ATOM 97 N PHE A 25 -4.824 10.563 -4.868 1.00 0.00 N ATOM 98 CA PHE A 25 -5.306 9.322 -4.265 1.00 0.00 C ATOM 99 C PHE A 25 -4.549 8.122 -4.783 1.00 0.00 C ATOM 100 O PHE A 25 -4.480 7.075 -4.115 1.00 0.00 O ATOM 0 H PHE A 25 -5.392 10.891 -5.650 1.00 0.00 H new ATOM 109 N ALA A 28 -2.244 5.329 -2.785 1.00 0.00 N ATOM 110 CA ALA A 28 -2.980 4.764 -1.641 1.00 0.00 C ATOM 111 C ALA A 28 -3.577 3.437 -2.043 1.00 0.00 C ATOM 112 O ALA A 28 -3.540 2.459 -1.290 1.00 0.00 O ATOM 113 N ARG A 29 -4.183 3.399 -3.214 1.00 0.00 N ATOM 114 CA ARG A 29 -4.635 2.136 -3.792 1.00 0.00 C ATOM 115 C ARG A 29 -3.565 1.072 -3.750 1.00 0.00 C ATOM 116 O ARG A 29 -3.881 -0.137 -3.669 1.00 0.00 O ATOM 0 H ARG A 29 -4.376 4.221 -3.786 1.00 0.00 H new ATOM 121 N VAL A 31 -1.189 0.456 -1.455 1.00 0.00 N ATOM 122 CA VAL A 31 -1.069 -0.176 -0.137 1.00 0.00 C ATOM 123 C VAL A 31 -2.289 -1.027 0.134 1.00 0.00 C ATOM 124 O VAL A 31 -2.191 -2.189 0.556 1.00 0.00 O ATOM 125 N PHE A 32 -3.462 -0.464 -0.085 1.00 0.00 N ATOM 126 CA PHE A 32 -4.705 -1.233 -0.040 1.00 0.00 C ATOM 127 C PHE A 32 -5.367 -1.235 -1.400 1.00 0.00 C ATOM 128 O PHE A 32 -6.048 -0.280 -1.791 1.00 0.00 O ATOM 0 H PHE A 32 -3.587 0.526 -0.297 1.00 0.00 H new ATOM 133 N ASN A 34 -7.918 -3.139 -2.439 1.00 0.00 N ATOM 134 CA ASN A 34 -9.307 -3.032 -2.009 1.00 0.00 C ATOM 135 C ASN A 34 -9.788 -1.599 -1.916 1.00 0.00 C ATOM 136 O ASN A 34 -9.598 -0.929 -0.894 1.00 0.00 O ATOM 137 N THR A 35 -10.434 -1.124 -2.963 1.00 0.00 N ATOM 138 CA THR A 35 -10.918 0.252 -3.020 1.00 0.00 C ATOM 139 C THR A 35 -11.689 0.608 -1.772 1.00 0.00 C ATOM 140 O THR A 35 -11.504 1.690 -1.196 1.00 0.00 O ATOM 0 H THR A 35 -10.640 -1.674 -3.797 1.00 0.00 H new ATOM 145 N ARG A 37 -12.367 0.702 2.035 1.00 0.00 N ATOM 146 CA ARG A 37 -11.375 0.956 3.085 1.00 0.00 C ATOM 147 C ARG A 37 -10.380 1.970 2.543 1.00 0.00 C ATOM 148 O ARG A 37 -10.005 2.927 3.233 1.00 0.00 O ATOM 149 N THR A 38 -9.969 1.779 1.305 1.00 0.00 N ATOM 150 CA THR A 38 -9.296 2.860 0.576 1.00 0.00 C ATOM 151 C THR A 38 -10.337 3.939 0.312 1.00 0.00 C ATOM 152 O THR A 38 -11.548 3.682 0.253 1.00 0.00 O ATOM 0 H THR A 38 -10.081 0.910 0.784 1.00 0.00 H new ATOM 153 N THR A 39 -9.885 5.154 0.091 1.00 0.00 N ATOM 154 CA THR A 39 -10.728 6.344 0.071 1.00 0.00 C ATOM 155 C THR A 39 -11.162 6.755 1.462 1.00 0.00 C ATOM 156 O THR A 39 -10.868 7.889 1.920 1.00 0.00 O ATOM 0 H THR A 39 -8.900 5.354 -0.084 1.00 0.00 H new ATOM 161 N PHE A 41 -10.119 6.393 4.335 1.00 0.00 N ATOM 162 CA PHE A 41 -9.021 6.949 5.126 1.00 0.00 C ATOM 163 C PHE A 41 -8.490 8.205 4.472 1.00 0.00 C ATOM 164 O PHE A 41 -8.061 9.167 5.119 1.00 0.00 O ATOM 165 N TRP A 42 -8.515 8.212 3.149 1.00 0.00 N ATOM 166 CA TRP A 42 -8.144 9.384 2.360 1.00 0.00 C ATOM 167 C TRP A 42 -9.073 10.558 2.569 1.00 0.00 C ATOM 168 O TRP A 42 -8.767 11.691 2.153 1.00 0.00 O ATOM 0 H TRP A 42 -8.793 7.407 2.588 1.00 0.00 H new ATOM 169 N LYS A 43 -10.217 10.340 3.186 1.00 0.00 N ATOM 170 CA LYS A 43 -11.234 11.378 3.334 1.00 0.00 C ATOM 171 C LYS A 43 -10.793 12.434 4.319 1.00 0.00 C ATOM 172 O LYS A 43 -11.038 13.636 4.145 1.00 0.00 O ATOM 0 H LYS A 43 -10.473 9.444 3.600 1.00 0.00 H new ATOM 173 N GLN A 44 -10.118 12.006 5.369 1.00 0.00 N ATOM 174 CA GLN A 44 -9.547 12.928 6.351 1.00 0.00 C ATOM 175 C GLN A 44 -8.259 13.529 5.836 1.00 0.00 C ATOM 176 O GLN A 44 -7.912 14.679 6.131 1.00 0.00 O ATOM 0 H GLN A 44 -9.947 11.021 5.570 1.00 0.00 H new ATOM 177 N TYR A 45 -7.520 12.751 5.067 1.00 0.00 N ATOM 178 CA TYR A 45 -6.298 13.230 4.428 1.00 0.00 C ATOM 179 C TYR A 45 -6.546 14.512 3.669 1.00 0.00 C ATOM 180 O TYR A 45 -5.679 15.389 3.554 1.00 0.00 O ATOM 0 H TYR A 45 -7.743 11.776 4.866 1.00 0.00 H new ATOM 181 N VAL A 46 -7.748 14.650 3.143 1.00 0.00 N ATOM 182 CA VAL A 46 -8.179 15.876 2.473 1.00 0.00 C ATOM 183 C VAL A 46 -8.956 16.747 3.436 1.00 0.00 C ATOM 184 O VAL A 46 -8.661 16.796 4.641 1.00 0.00 O ATOM 0 H VAL A 46 -8.458 13.918 3.165 1.00 0.00 H new