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 5.065 1.585 2.804 1.00 0.00 N ATOM 50 CA ASN A 13 5.749 2.852 3.050 1.00 0.00 C ATOM 51 C ASN A 13 4.958 3.993 2.450 1.00 0.00 C ATOM 52 O ASN A 13 4.858 4.141 1.226 1.00 0.00 O ATOM 53 N LEU A 14 4.366 4.802 3.305 1.00 0.00 N ATOM 54 CA LEU A 14 3.442 5.849 2.870 1.00 0.00 C ATOM 55 C LEU A 14 3.750 7.183 3.509 1.00 0.00 C ATOM 56 O LEU A 14 3.888 8.213 2.830 1.00 0.00 O ATOM 0 H LEU A 14 4.505 4.760 4.315 1.00 0.00 H new ATOM 69 N CYS A 18 4.136 10.560 1.013 1.00 0.00 N ATOM 70 CA CYS A 18 2.763 10.960 0.710 1.00 0.00 C ATOM 71 C CYS A 18 2.191 11.812 1.819 1.00 0.00 C ATOM 72 O CYS A 18 0.975 11.828 2.065 1.00 0.00 O ATOM 73 N MET A 19 3.050 12.525 2.521 1.00 0.00 N ATOM 74 CA MET A 19 2.636 13.329 3.669 1.00 0.00 C ATOM 75 C MET A 19 3.372 14.648 3.690 1.00 0.00 C ATOM 76 O MET A 19 2.780 15.731 3.630 1.00 0.00 O ATOM 0 H MET A 19 4.049 12.568 2.319 1.00 0.00 H new ATOM 85 N LYS A 22 2.511 16.199 -1.397 1.00 0.00 N ATOM 86 CA LYS A 22 1.169 15.796 -1.814 1.00 0.00 C ATOM 87 C LYS A 22 1.231 14.899 -3.027 1.00 0.00 C ATOM 88 O LYS A 22 2.047 15.098 -3.940 1.00 0.00 O ATOM 89 N CYS A 23 0.377 13.889 -3.059 1.00 0.00 N ATOM 90 CA CYS A 23 0.411 12.890 -4.125 1.00 0.00 C ATOM 91 C CYS A 23 -0.941 12.770 -4.790 1.00 0.00 C ATOM 92 O CYS A 23 -1.361 13.659 -5.554 1.00 0.00 O ATOM 0 H CYS A 23 -0.350 13.736 -2.360 1.00 0.00 H new ATOM 93 N SER A 24 -1.665 11.701 -4.521 1.00 0.00 N ATOM 94 CA SER A 24 -2.927 11.421 -5.205 1.00 0.00 C ATOM 95 C SER A 24 -3.595 10.194 -4.631 1.00 0.00 C ATOM 96 O SER A 24 -3.004 9.439 -3.844 1.00 0.00 O ATOM 0 H SER A 24 -1.403 11.001 -3.827 1.00 0.00 H new ATOM 97 N PHE A 25 -4.846 9.980 -5.000 1.00 0.00 N ATOM 98 CA PHE A 25 -5.561 8.766 -4.610 1.00 0.00 C ATOM 99 C PHE A 25 -5.297 7.640 -5.580 1.00 0.00 C ATOM 100 O PHE A 25 -5.503 6.456 -5.276 1.00 0.00 O ATOM 0 H PHE A 25 -5.392 10.627 -5.569 1.00 0.00 H new ATOM 109 N ALA A 28 -3.043 5.008 -4.298 1.00 0.00 N ATOM 110 CA ALA A 28 -3.592 4.470 -3.049 1.00 0.00 C ATOM 111 C ALA A 28 -4.423 3.241 -3.326 1.00 0.00 C ATOM 112 O ALA A 28 -4.660 2.400 -2.451 1.00 0.00 O ATOM 113 N ARG A 29 -4.921 3.128 -4.543 1.00 0.00 N ATOM 114 CA ARG A 29 -5.583 1.909 -4.997 1.00 0.00 C ATOM 115 C ARG A 29 -4.635 0.773 -5.312 1.00 0.00 C ATOM 116 O ARG A 29 -5.031 -0.210 -5.974 1.00 0.00 O ATOM 0 H ARG A 29 -4.881 3.869 -5.243 1.00 0.00 H new ATOM 121 N VAL A 31 -1.672 0.204 -2.790 1.00 0.00 N ATOM 122 CA VAL A 31 -1.364 -0.123 -1.396 1.00 0.00 C ATOM 123 C VAL A 31 -2.529 -0.866 -0.780 1.00 0.00 C ATOM 124 O VAL A 31 -2.376 -1.868 -0.073 1.00 0.00 O ATOM 125 N PHE A 32 -3.728 -0.383 -1.060 1.00 0.00 N ATOM 126 CA PHE A 32 -4.952 -1.089 -0.684 1.00 0.00 C ATOM 127 C PHE A 32 -5.803 -1.333 -1.917 1.00 0.00 C ATOM 128 O PHE A 32 -6.506 -0.436 -2.398 1.00 0.00 O ATOM 0 H PHE A 32 -3.885 0.499 -1.548 1.00 0.00 H new ATOM 133 N ASN A 34 -8.498 -2.973 -2.101 1.00 0.00 N ATOM 134 CA ASN A 34 -9.809 -2.563 -1.607 1.00 0.00 C ATOM 135 C ASN A 34 -9.958 -1.061 -1.672 1.00 0.00 C ATOM 136 O ASN A 34 -9.158 -0.309 -1.094 1.00 0.00 O ATOM 137 N THR A 35 -10.971 -0.598 -2.386 1.00 0.00 N ATOM 138 CA THR A 35 -11.251 0.836 -2.460 1.00 0.00 C ATOM 139 C THR A 35 -12.112 1.273 -1.301 1.00 0.00 C ATOM 140 O THR A 35 -12.111 2.444 -0.898 1.00 0.00 O ATOM 0 H THR A 35 -11.612 -1.185 -2.921 1.00 0.00 H new ATOM 145 N ARG A 37 -11.713 1.131 1.822 1.00 0.00 N ATOM 146 CA ARG A 37 -10.593 0.929 2.737 1.00 0.00 C ATOM 147 C ARG A 37 -9.528 1.982 2.480 1.00 0.00 C ATOM 148 O ARG A 37 -9.295 2.869 3.308 1.00 0.00 O ATOM 149 N THR A 38 -8.861 1.865 1.323 1.00 0.00 N ATOM 150 CA THR A 38 -7.980 2.955 0.898 1.00 0.00 C ATOM 151 C THR A 38 -8.716 4.286 0.979 1.00 0.00 C ATOM 152 O THR A 38 -8.139 5.289 1.419 1.00 0.00 O ATOM 0 H THR A 38 -8.910 1.065 0.692 1.00 0.00 H new ATOM 153 N THR A 39 -9.956 4.339 0.533 1.00 0.00 N ATOM 154 CA THR A 39 -10.723 5.578 0.445 1.00 0.00 C ATOM 155 C THR A 39 -11.054 6.147 1.807 1.00 0.00 C ATOM 156 O THR A 39 -10.740 7.297 2.131 1.00 0.00 O ATOM 0 H THR A 39 -10.470 3.517 0.217 1.00 0.00 H new ATOM 161 N PHE A 41 -9.775 6.089 4.423 1.00 0.00 N ATOM 162 CA PHE A 41 -8.620 6.695 5.084 1.00 0.00 C ATOM 163 C PHE A 41 -8.220 7.982 4.402 1.00 0.00 C ATOM 164 O PHE A 41 -7.823 8.969 5.030 1.00 0.00 O ATOM 165 N TRP A 42 -8.327 7.990 3.084 1.00 0.00 N ATOM 166 CA TRP A 42 -8.084 9.187 2.285 1.00 0.00 C ATOM 167 C TRP A 42 -9.164 10.233 2.438 1.00 0.00 C ATOM 168 O TRP A 42 -9.082 11.320 1.837 1.00 0.00 O ATOM 0 H TRP A 42 -8.584 7.170 2.535 1.00 0.00 H new ATOM 169 N LYS A 43 -10.196 9.955 3.209 1.00 0.00 N ATOM 170 CA LYS A 43 -11.271 10.916 3.451 1.00 0.00 C ATOM 171 C LYS A 43 -10.868 11.964 4.462 1.00 0.00 C ATOM 172 O LYS A 43 -11.393 13.088 4.480 1.00 0.00 O ATOM 0 H LYS A 43 -10.320 9.062 3.687 1.00 0.00 H new ATOM 173 N GLN A 44 -9.947 11.615 5.339 1.00 0.00 N ATOM 174 CA GLN A 44 -9.421 12.550 6.332 1.00 0.00 C ATOM 175 C GLN A 44 -8.231 13.321 5.811 1.00 0.00 C ATOM 176 O GLN A 44 -7.994 14.480 6.181 1.00 0.00 O ATOM 0 H GLN A 44 -9.540 10.681 5.389 1.00 0.00 H new ATOM 177 N TYR A 45 -7.450 12.692 4.954 1.00 0.00 N ATOM 178 CA TYR A 45 -6.197 13.270 4.470 1.00 0.00 C ATOM 179 C TYR A 45 -6.425 14.279 3.367 1.00 0.00 C ATOM 180 O TYR A 45 -5.698 15.268 3.222 1.00 0.00 O ATOM 0 H TYR A 45 -7.659 11.770 4.571 1.00 0.00 H new ATOM 181 N VAL A 46 -7.416 14.020 2.542 1.00 0.00 N ATOM 182 CA VAL A 46 -7.828 14.858 1.429 1.00 0.00 C ATOM 183 C VAL A 46 -7.685 16.353 1.663 1.00 0.00 C ATOM 184 O VAL A 46 -7.700 16.916 2.760 1.00 0.00 O ATOM 0 H VAL A 46 -7.986 13.179 2.631 1.00 0.00 H new