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 4.973 1.849 -0.171 1.00 0.00 N ATOM 50 CA ASN A 13 5.543 3.160 0.153 1.00 0.00 C ATOM 51 C ASN A 13 4.473 4.061 0.725 1.00 0.00 C ATOM 52 O ASN A 13 3.684 3.631 1.585 1.00 0.00 O ATOM 53 N LEU A 14 4.430 5.311 0.316 1.00 0.00 N ATOM 54 CA LEU A 14 3.367 6.260 0.651 1.00 0.00 C ATOM 55 C LEU A 14 3.762 7.128 1.823 1.00 0.00 C ATOM 56 O LEU A 14 3.871 8.358 1.714 1.00 0.00 O ATOM 0 H LEU A 14 5.153 5.717 -0.278 1.00 0.00 H new ATOM 69 N CYS A 18 4.301 11.199 0.843 1.00 0.00 N ATOM 70 CA CYS A 18 2.894 11.612 0.822 1.00 0.00 C ATOM 71 C CYS A 18 2.274 11.840 2.183 1.00 0.00 C ATOM 72 O CYS A 18 1.337 12.662 2.310 1.00 0.00 O ATOM 73 N MET A 19 2.723 11.140 3.206 1.00 0.00 N ATOM 74 CA MET A 19 2.222 11.369 4.563 1.00 0.00 C ATOM 75 C MET A 19 2.685 12.710 5.082 1.00 0.00 C ATOM 76 O MET A 19 2.042 13.331 5.942 1.00 0.00 O ATOM 0 H MET A 19 3.431 10.409 3.133 1.00 0.00 H new ATOM 85 N LYS A 22 1.900 16.180 -0.428 1.00 0.00 N ATOM 86 CA LYS A 22 0.752 15.917 -1.292 1.00 0.00 C ATOM 87 C LYS A 22 1.123 15.057 -2.480 1.00 0.00 C ATOM 88 O LYS A 22 2.154 15.247 -3.136 1.00 0.00 O ATOM 89 N CYS A 23 0.270 14.096 -2.783 1.00 0.00 N ATOM 90 CA CYS A 23 0.420 13.264 -3.979 1.00 0.00 C ATOM 91 C CYS A 23 -0.918 13.059 -4.648 1.00 0.00 C ATOM 92 O CYS A 23 -1.769 13.963 -4.681 1.00 0.00 O ATOM 0 H CYS A 23 -0.545 13.865 -2.215 1.00 0.00 H new ATOM 93 N SER A 24 -1.139 11.887 -5.209 1.00 0.00 N ATOM 94 CA SER A 24 -2.440 11.517 -5.766 1.00 0.00 C ATOM 95 C SER A 24 -2.956 10.257 -5.112 1.00 0.00 C ATOM 96 O SER A 24 -2.208 9.506 -4.469 1.00 0.00 O ATOM 0 H SER A 24 -0.428 11.160 -5.295 1.00 0.00 H new ATOM 97 N PHE A 25 -4.239 9.996 -5.267 1.00 0.00 N ATOM 98 CA PHE A 25 -4.888 8.875 -4.590 1.00 0.00 C ATOM 99 C PHE A 25 -4.517 7.544 -5.200 1.00 0.00 C ATOM 100 O PHE A 25 -4.676 6.486 -4.561 1.00 0.00 O ATOM 0 H PHE A 25 -4.862 10.546 -5.859 1.00 0.00 H new ATOM 109 N ALA A 28 -2.659 4.308 -3.518 1.00 0.00 N ATOM 110 CA ALA A 28 -3.351 3.981 -2.265 1.00 0.00 C ATOM 111 C ALA A 28 -4.343 2.870 -2.508 1.00 0.00 C ATOM 112 O ALA A 28 -4.581 2.010 -1.653 1.00 0.00 O ATOM 113 N ARG A 29 -4.984 2.899 -3.660 1.00 0.00 N ATOM 114 CA ARG A 29 -5.812 1.781 -4.103 1.00 0.00 C ATOM 115 C ARG A 29 -5.054 0.484 -4.279 1.00 0.00 C ATOM 116 O ARG A 29 -5.683 -0.593 -4.388 1.00 0.00 O ATOM 0 H ARG A 29 -4.951 3.683 -4.311 1.00 0.00 H new ATOM 121 N VAL A 31 -2.085 -0.336 -2.329 1.00 0.00 N ATOM 122 CA VAL A 31 -1.457 -0.710 -1.063 1.00 0.00 C ATOM 123 C VAL A 31 -2.483 -1.228 -0.084 1.00 0.00 C ATOM 124 O VAL A 31 -2.203 -2.115 0.738 1.00 0.00 O ATOM 125 N PHE A 32 -3.684 -0.674 -0.132 1.00 0.00 N ATOM 126 CA PHE A 32 -4.792 -1.185 0.675 1.00 0.00 C ATOM 127 C PHE A 32 -5.536 -2.300 -0.026 1.00 0.00 C ATOM 128 O PHE A 32 -6.221 -3.115 0.619 1.00 0.00 O ATOM 0 H PHE A 32 -3.921 0.127 -0.718 1.00 0.00 H new ATOM 133 N ASN A 34 -8.216 -2.787 -1.409 1.00 0.00 N ATOM 134 CA ASN A 34 -9.654 -2.958 -1.201 1.00 0.00 C ATOM 135 C ASN A 34 -10.472 -1.772 -1.665 1.00 0.00 C ATOM 136 O ASN A 34 -11.710 -1.788 -1.567 1.00 0.00 O ATOM 137 N THR A 35 -9.842 -0.748 -2.206 1.00 0.00 N ATOM 138 CA THR A 35 -10.484 0.514 -2.577 1.00 0.00 C ATOM 139 C THR A 35 -11.285 1.111 -1.446 1.00 0.00 C ATOM 140 O THR A 35 -10.827 2.059 -0.772 1.00 0.00 O ATOM 0 H THR A 35 -8.842 -0.763 -2.408 1.00 0.00 H new ATOM 145 N ARG A 37 -11.556 1.474 1.588 1.00 0.00 N ATOM 146 CA ARG A 37 -10.434 1.261 2.493 1.00 0.00 C ATOM 147 C ARG A 37 -9.174 1.746 1.788 1.00 0.00 C ATOM 148 O ARG A 37 -8.465 0.977 1.135 1.00 0.00 O ATOM 149 N THR A 38 -8.900 3.024 1.902 1.00 0.00 N ATOM 150 CA THR A 38 -7.921 3.813 1.164 1.00 0.00 C ATOM 151 C THR A 38 -8.555 5.135 0.756 1.00 0.00 C ATOM 152 O THR A 38 -7.949 6.203 0.899 1.00 0.00 O ATOM 0 H THR A 38 -9.402 3.600 2.578 1.00 0.00 H new ATOM 153 N THR A 39 -9.755 5.078 0.211 1.00 0.00 N ATOM 154 CA THR A 39 -10.542 6.274 -0.070 1.00 0.00 C ATOM 155 C THR A 39 -11.026 6.914 1.212 1.00 0.00 C ATOM 156 O THR A 39 -10.789 8.095 1.490 1.00 0.00 O ATOM 0 H THR A 39 -10.215 4.206 -0.051 1.00 0.00 H new ATOM 161 N PHE A 41 -9.998 6.828 4.125 1.00 0.00 N ATOM 162 CA PHE A 41 -8.913 7.459 4.874 1.00 0.00 C ATOM 163 C PHE A 41 -8.387 8.666 4.132 1.00 0.00 C ATOM 164 O PHE A 41 -7.977 9.676 4.715 1.00 0.00 O ATOM 165 N TRP A 42 -8.405 8.582 2.813 1.00 0.00 N ATOM 166 CA TRP A 42 -8.041 9.702 1.949 1.00 0.00 C ATOM 167 C TRP A 42 -9.022 10.846 2.047 1.00 0.00 C ATOM 168 O TRP A 42 -8.734 11.979 1.619 1.00 0.00 O ATOM 0 H TRP A 42 -8.672 7.738 2.307 1.00 0.00 H new ATOM 169 N LYS A 43 -10.187 10.605 2.616 1.00 0.00 N ATOM 170 CA LYS A 43 -11.253 11.603 2.673 1.00 0.00 C ATOM 171 C LYS A 43 -10.969 12.626 3.748 1.00 0.00 C ATOM 172 O LYS A 43 -11.208 13.829 3.596 1.00 0.00 O ATOM 0 H LYS A 43 -10.427 9.715 3.053 1.00 0.00 H new ATOM 173 N GLN A 44 -10.433 12.155 4.860 1.00 0.00 N ATOM 174 CA GLN A 44 -9.998 13.029 5.946 1.00 0.00 C ATOM 175 C GLN A 44 -8.673 13.683 5.634 1.00 0.00 C ATOM 176 O GLN A 44 -8.388 14.811 6.062 1.00 0.00 O ATOM 0 H GLN A 44 -10.286 11.162 5.040 1.00 0.00 H new ATOM 177 N TYR A 45 -7.829 12.984 4.898 1.00 0.00 N ATOM 178 CA TYR A 45 -6.476 13.454 4.616 1.00 0.00 C ATOM 179 C TYR A 45 -6.496 14.764 3.865 1.00 0.00 C ATOM 180 O TYR A 45 -5.766 15.711 4.185 1.00 0.00 O ATOM 0 H TYR A 45 -8.055 12.081 4.480 1.00 0.00 H new ATOM 181 N VAL A 46 -7.345 14.844 2.859 1.00 0.00 N ATOM 182 CA VAL A 46 -7.441 16.052 2.024 1.00 0.00 C ATOM 183 C VAL A 46 -8.133 17.229 2.705 1.00 0.00 C ATOM 184 O VAL A 46 -8.126 18.365 2.226 1.00 0.00 O ATOM 0 H VAL A 46 -7.983 14.094 2.591 1.00 0.00 H new