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 4.183 1.285 2.727 1.00 0.00 N ATOM 50 CA ASN A 13 4.916 2.536 2.907 1.00 0.00 C ATOM 51 C ASN A 13 4.060 3.717 2.513 1.00 0.00 C ATOM 52 O ASN A 13 3.729 3.930 1.341 1.00 0.00 O ATOM 53 N LEU A 14 3.674 4.504 3.502 1.00 0.00 N ATOM 54 CA LEU A 14 2.751 5.620 3.298 1.00 0.00 C ATOM 55 C LEU A 14 3.398 6.921 3.714 1.00 0.00 C ATOM 56 O LEU A 14 3.490 7.881 2.938 1.00 0.00 O ATOM 0 H LEU A 14 3.987 4.393 4.467 1.00 0.00 H new ATOM 69 N CYS A 18 3.203 9.074 -0.057 1.00 0.00 N ATOM 70 CA CYS A 18 2.047 9.957 -0.271 1.00 0.00 C ATOM 71 C CYS A 18 1.839 10.852 0.933 1.00 0.00 C ATOM 72 O CYS A 18 0.716 11.084 1.402 1.00 0.00 O ATOM 73 N MET A 19 2.927 11.388 1.447 1.00 0.00 N ATOM 74 CA MET A 19 2.876 12.399 2.506 1.00 0.00 C ATOM 75 C MET A 19 3.979 13.406 2.281 1.00 0.00 C ATOM 76 O MET A 19 4.468 13.591 1.152 1.00 0.00 O ATOM 0 H MET A 19 3.872 11.143 1.150 1.00 0.00 H new ATOM 85 N LYS A 22 1.812 17.524 -1.081 1.00 0.00 N ATOM 86 CA LYS A 22 0.501 17.322 -1.692 1.00 0.00 C ATOM 87 C LYS A 22 0.564 16.296 -2.798 1.00 0.00 C ATOM 88 O LYS A 22 1.015 16.575 -3.919 1.00 0.00 O ATOM 89 N CYS A 23 0.100 15.089 -2.515 1.00 0.00 N ATOM 90 CA CYS A 23 0.061 14.022 -3.515 1.00 0.00 C ATOM 91 C CYS A 23 -1.363 13.708 -3.904 1.00 0.00 C ATOM 92 O CYS A 23 -2.257 14.573 -3.821 1.00 0.00 O ATOM 0 H CYS A 23 -0.257 14.819 -1.599 1.00 0.00 H new ATOM 93 N SER A 24 -1.629 12.486 -4.319 1.00 0.00 N ATOM 94 CA SER A 24 -2.937 12.116 -4.859 1.00 0.00 C ATOM 95 C SER A 24 -3.396 10.768 -4.354 1.00 0.00 C ATOM 96 O SER A 24 -2.612 9.935 -3.884 1.00 0.00 O ATOM 0 H SER A 24 -0.955 11.721 -4.295 1.00 0.00 H new ATOM 97 N PHE A 25 -4.692 10.523 -4.458 1.00 0.00 N ATOM 98 CA PHE A 25 -5.286 9.247 -4.065 1.00 0.00 C ATOM 99 C PHE A 25 -4.867 8.101 -4.959 1.00 0.00 C ATOM 100 O PHE A 25 -4.991 6.921 -4.589 1.00 0.00 O ATOM 0 H PHE A 25 -5.365 11.200 -4.817 1.00 0.00 H new ATOM 109 N ALA A 28 -2.384 5.259 -3.804 1.00 0.00 N ATOM 110 CA ALA A 28 -2.755 4.580 -2.560 1.00 0.00 C ATOM 111 C ALA A 28 -3.430 3.261 -2.853 1.00 0.00 C ATOM 112 O ALA A 28 -3.424 2.331 -2.039 1.00 0.00 O ATOM 113 N ARG A 29 -4.056 3.173 -4.008 1.00 0.00 N ATOM 114 CA ARG A 29 -4.612 1.911 -4.488 1.00 0.00 C ATOM 115 C ARG A 29 -3.649 0.757 -4.349 1.00 0.00 C ATOM 116 O ARG A 29 -4.070 -0.400 -4.132 1.00 0.00 O ATOM 0 H ARG A 29 -4.196 3.961 -4.640 1.00 0.00 H new ATOM 121 N VAL A 31 -1.178 0.188 -2.117 1.00 0.00 N ATOM 122 CA VAL A 31 -0.982 -0.283 -0.743 1.00 0.00 C ATOM 123 C VAL A 31 -2.183 -1.078 -0.288 1.00 0.00 C ATOM 124 O VAL A 31 -2.069 -2.201 0.219 1.00 0.00 O ATOM 125 N PHE A 32 -3.360 -0.508 -0.467 1.00 0.00 N ATOM 126 CA PHE A 32 -4.609 -1.213 -0.194 1.00 0.00 C ATOM 127 C PHE A 32 -5.395 -1.442 -1.464 1.00 0.00 C ATOM 128 O PHE A 32 -6.159 -0.580 -1.920 1.00 0.00 O ATOM 0 H PHE A 32 -3.483 0.447 -0.802 1.00 0.00 H new ATOM 133 N ASN A 34 -7.917 -3.248 -1.787 1.00 0.00 N ATOM 134 CA ASN A 34 -9.266 -2.976 -1.300 1.00 0.00 C ATOM 135 C ASN A 34 -9.616 -1.516 -1.467 1.00 0.00 C ATOM 136 O ASN A 34 -9.149 -0.644 -0.722 1.00 0.00 O ATOM 137 N THR A 35 -10.460 -1.229 -2.443 1.00 0.00 N ATOM 138 CA THR A 35 -10.784 0.153 -2.789 1.00 0.00 C ATOM 139 C THR A 35 -11.622 0.801 -1.714 1.00 0.00 C ATOM 140 O THR A 35 -11.489 1.997 -1.416 1.00 0.00 O ATOM 0 H THR A 35 -10.935 -1.930 -3.012 1.00 0.00 H new ATOM 145 N ARG A 37 -11.610 1.370 1.569 1.00 0.00 N ATOM 146 CA ARG A 37 -10.526 1.394 2.549 1.00 0.00 C ATOM 147 C ARG A 37 -9.575 2.525 2.201 1.00 0.00 C ATOM 148 O ARG A 37 -9.391 3.497 2.939 1.00 0.00 O ATOM 149 N THR A 38 -8.947 2.392 1.049 1.00 0.00 N ATOM 150 CA THR A 38 -8.203 3.480 0.428 1.00 0.00 C ATOM 151 C THR A 38 -8.959 4.787 0.504 1.00 0.00 C ATOM 152 O THR A 38 -8.359 5.873 0.600 1.00 0.00 O ATOM 0 H THR A 38 -8.936 1.525 0.512 1.00 0.00 H new ATOM 153 N THR A 39 -10.277 4.733 0.483 1.00 0.00 N ATOM 154 CA THR A 39 -11.115 5.929 0.430 1.00 0.00 C ATOM 155 C THR A 39 -11.361 6.481 1.815 1.00 0.00 C ATOM 156 O THR A 39 -10.824 7.528 2.196 1.00 0.00 O ATOM 0 H THR A 39 -10.804 3.860 0.502 1.00 0.00 H new ATOM 161 N PHE A 41 -10.231 6.235 4.484 1.00 0.00 N ATOM 162 CA PHE A 41 -9.031 6.675 5.192 1.00 0.00 C ATOM 163 C PHE A 41 -8.495 7.956 4.590 1.00 0.00 C ATOM 164 O PHE A 41 -8.164 8.927 5.281 1.00 0.00 O ATOM 165 N TRP A 42 -8.417 7.981 3.270 1.00 0.00 N ATOM 166 CA TRP A 42 -7.976 9.161 2.532 1.00 0.00 C ATOM 167 C TRP A 42 -8.943 10.318 2.628 1.00 0.00 C ATOM 168 O TRP A 42 -8.630 11.448 2.213 1.00 0.00 O ATOM 0 H TRP A 42 -8.657 7.187 2.677 1.00 0.00 H new ATOM 169 N LYS A 43 -10.121 10.091 3.173 1.00 0.00 N ATOM 170 CA LYS A 43 -11.177 11.102 3.211 1.00 0.00 C ATOM 171 C LYS A 43 -10.869 12.153 4.253 1.00 0.00 C ATOM 172 O LYS A 43 -11.278 13.315 4.151 1.00 0.00 O ATOM 0 H LYS A 43 -10.381 9.204 3.604 1.00 0.00 H new ATOM 173 N GLN A 44 -10.125 11.759 5.271 1.00 0.00 N ATOM 174 CA GLN A 44 -9.632 12.692 6.279 1.00 0.00 C ATOM 175 C GLN A 44 -8.457 13.485 5.752 1.00 0.00 C ATOM 176 O GLN A 44 -8.276 14.670 6.057 1.00 0.00 O ATOM 0 H GLN A 44 -9.845 10.791 5.426 1.00 0.00 H new ATOM 177 N TYR A 45 -7.626 12.832 4.961 1.00 0.00 N ATOM 178 CA TYR A 45 -6.409 13.445 4.435 1.00 0.00 C ATOM 179 C TYR A 45 -6.735 14.613 3.534 1.00 0.00 C ATOM 180 O TYR A 45 -6.026 15.626 3.497 1.00 0.00 O ATOM 0 H TYR A 45 -7.769 11.867 4.663 1.00 0.00 H new ATOM 181 N VAL A 46 -7.826 14.493 2.799 1.00 0.00 N ATOM 182 CA VAL A 46 -8.198 15.514 1.807 1.00 0.00 C ATOM 183 C VAL A 46 -8.613 16.852 2.413 1.00 0.00 C ATOM 184 O VAL A 46 -8.769 17.866 1.729 1.00 0.00 O ATOM 0 H VAL A 46 -8.474 13.707 2.861 1.00 0.00 H new