Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2du1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A N LEU 235.A O no hydrogen 3.313 N/A THR 2.A OG1 SER 234.A OG no hydrogen 3.192 N/A ILE 3.A N ALA 233.A O no hydrogen 2.987 N/A PHE 5.A N PHE 231.A O no hydrogen 2.904 N/A PHE 7.A N TRP 229.A O no hydrogen 2.854 N/A PHE 10.A N SER 29.A O no hydrogen 3.039 N/A GLN 16.A N GLU 14.A OE1 no hydrogen 3.217 N/A LEU 17.A N GLU 14.A O no hydrogen 2.957 N/A LYS 18.A N LEU 50.A O no hydrogen 2.757 N/A GLN 20.A N ARG 48.A O no hydrogen 3.013 N/A GLN 20.A NE2 THR 98.A O no hydrogen 3.186 N/A ASP 22.A N THR 46.A O no hydrogen 2.998 N/A ALA 23.A N GLN 20.A O no hydrogen 3.188 N/A ARG 24.A N GLU 32.A O no hydrogen 3.034 N/A SER 26.A N VAL 30.A O no hydrogen 2.859 N/A SER 26.A OG ASN 28.A OD1 no hydrogen 2.517 N/A SER 26.A OG VAL 30.A O no hydrogen 3.350 N/A SER 29.A N SER 26.A O no hydrogen 3.272 N/A VAL 30.A N SER 26.A OG no hydrogen 3.272 N/A LEU 31.A N ILE 226.A O no hydrogen 3.038 N/A GLU 32.A N ARG 24.A O no hydrogen 2.874 N/A LEU 33.A N HIS 224.A O no hydrogen 3.123 N/A THR 34.A OG1 HIS 224.A ND1 no hydrogen 2.894 N/A LYS 35.A N SER 45.A OG no hydrogen 2.786 N/A VAL 37.A N VAL 40.A O no hydrogen 2.728 N/A VAL 40.A N VAL 37.A O no hydrogen 2.941 N/A THR 42.A N LYS 35.A O no hydrogen 3.168 N/A ASN 44.A N GLY 211.A O no hydrogen 2.681 N/A SER 45.A N THR 210.A OG1 no hydrogen 2.765 N/A SER 45.A OG ASP 22.A OD2 no hydrogen 2.646 N/A THR 46.A N ASP 22.A OD2 no hydrogen 3.203 N/A GLY 47.A N ALA 208.A O no hydrogen 3.303 N/A ARG 48.A N GLN 20.A O no hydrogen 3.286 N/A ARG 48.A NH1 GLN 20.A OE1 no hydrogen 2.471 N/A ARG 48.A NH1 THR 98.A O no hydrogen 3.428 N/A ARG 48.A NH2 THR 98.A OG1 no hydrogen 3.056 N/A ALA 49.A N PHE 206.A O no hydrogen 2.990 N/A LEU 50.A N LYS 18.A O no hydrogen 2.907 N/A TYR 51.A N VAL 204.A O no hydrogen 3.041 N/A TYR 51.A OH GLN 16.A OE1 no hydrogen 3.116 N/A ALA 52.A N GLN 16.A O no hydrogen 2.798 N/A VAL 55.A N VAL 202.A O no hydrogen 2.772 N/A GLN 56.A NE2 TRP 58.A O no hydrogen 2.943 N/A VAL 57.A N GLU 200.A O no hydrogen 2.841 N/A TRP 58.A NE1 LEU 198.A O no hydrogen 2.834 N/A ASP 59.A N ASN 64.A O no hydrogen 2.943 N/A SER 60.A N GLU 200.A OE1 no hydrogen 2.899 N/A SER 60.A OG GLU 200.A OE1 no hydrogen 3.000 N/A SER 60.A OG GLU 200.A OE2 no hydrogen 3.513 N/A THR 62.A N ASP 59.A OD2 no hydrogen 2.913 N/A THR 62.A OG1 ASP 59.A OD2 no hydrogen 3.189 N/A THR 62.A OG1 GLY 237.A O no hydrogen 2.611 N/A GLY 63.A N ASP 59.A O no hydrogen 2.646 N/A ASN 64.A N THR 62.A OG1 no hydrogen 3.211 N/A ALA 66.A N VAL 57.A O no hydrogen 2.580 N/A SER 67.A N SER 234.A O no hydrogen 3.177 N/A SER 67.A OG TYR 166.A O no hydrogen 3.460 N/A PHE 68.A N TYR 166.A O no hydrogen 3.061 N/A GLU 69.A N SER 232.A O no hydrogen 2.970 N/A THR 70.A N ILE 164.A O no hydrogen 2.815 N/A THR 70.A OG1 SER 230.A O no hydrogen 2.832 N/A ARG 71.A N SER 230.A O no hydrogen 3.061 N/A ARG 71.A NE GLU 69.A OE2 no hydrogen 3.042 N/A ARG 71.A NH2 GLU 69.A OE2 no hydrogen 2.885 N/A PHE 72.A N VAL 162.A O no hydrogen 3.119 N/A SER 73.A N SER 228.A O no hydrogen 3.243 N/A SER 73.A OG ASN 161.A OD1 no hydrogen 3.091 N/A PHE 74.A N ALA 160.A O no hydrogen 3.068 N/A SER 75.A N ASP 225.A O no hydrogen 2.887 N/A SER 75.A OG GLY 158.A O no hydrogen 2.758 N/A ARG 77.A N THR 223.A OG1 no hydrogen 2.779 N/A GLN 78.A N ASN 156.A OD1 no hydrogen 2.860 N/A ASP 87.A N ALA 209.A O no hydrogen 2.597 N/A LEU 89.A N PHE 123.A O no hydrogen 3.195 N/A VAL 90.A N SER 207.A O no hydrogen 2.795 N/A PHE 91.A N VAL 121.A O no hydrogen 2.945 N/A PHE 92.A N GLY 205.A O no hydrogen 2.821 N/A ILE 93.A N VAL 119.A O no hydrogen 2.828 N/A ALA 94.A N ASN 203.A O no hydrogen 3.134 N/A ASN 97.A N ASN 203.A OD1 no hydrogen 3.328 N/A GLY 101.A N GLY 108.A O no hydrogen 2.637 N/A GLU 102.A N TYR 110.A O no hydrogen 2.828 N/A TYR 106.A N GLY 103.A O no hydrogen 3.035 N/A PHE 107.A N GLY 104.A O no hydrogen 2.962 N/A ILE 109.A N TYR 106.A O no hydrogen 3.051 N/A SER 114.A N ASN 111.A O no hydrogen 3.263 N/A PHE 118.A N ASN 142.A OD1 no hydrogen 3.153 N/A VAL 119.A N ILE 93.A O no hydrogen 3.057 N/A ALA 120.A N ASP 140.A O no hydrogen 2.791 N/A VAL 121.A N PHE 91.A O no hydrogen 2.833 N/A GLU 122.A N GLY 138.A O no hydrogen 2.886 N/A PHE 123.A N LEU 89.A O no hydrogen 2.858 N/A ASP 124.A N HIS 136.A O no hydrogen 2.999 N/A THR 125.A N ASP 87.A O no hydrogen 3.008 N/A THR 125.A OG1 GLU 222.A OE1 no hydrogen 3.274 N/A THR 125.A OG1 GLU 222.A OE2 no hydrogen 2.915 N/A PHE 126.A N ASP 124.A OD1 no hydrogen 3.176 N/A ARG 127.A NE ASP 131.A O no hydrogen 2.876 N/A ARG 127.A NH2 ASP 131.A O no hydrogen 3.441 N/A ASN 128.A N ASP 131.A OD2 no hydrogen 2.980 N/A ASP 131.A N ASN 128.A O no hydrogen 2.925 N/A HIS 136.A N ASP 124.A O no hydrogen 3.070 N/A HIS 136.A ND1 GLN 133.A O no hydrogen 2.695 N/A ILE 137.A N VAL 150.A O no hydrogen 2.747 N/A GLY 138.A N GLU 122.A O no hydrogen 3.075 N/A ILE 139.A N LYS 148.A O no hydrogen 3.013 N/A ASP 140.A N ALA 120.A O no hydrogen 2.816 N/A ASN 142.A N PHE 118.A O no hydrogen 2.765 N/A ILE 145.A N SER 143.A OG no hydrogen 2.770 N/A SER 146.A OG ASP 140.A OD1 no hydrogen 2.402 N/A THR 147.A N ILE 139.A O no hydrogen 2.854 N/A THR 147.A OG1 ILE 139.A O no hydrogen 3.275 N/A THR 147.A OG1 ASP 190.A OD2 no hydrogen 2.796 N/A VAL 150.A N ILE 137.A O no hydrogen 2.912 N/A PHE 152.A N PRO 135.A O no hydrogen 3.166 N/A THR 153.A N TYR 186.A OH no hydrogen 3.350 N/A ASN 156.A ND2 GLN 78.A O no hydrogen 3.281 N/A GLY 157.A N ILE 76.A O no hydrogen 2.934 N/A GLY 158.A N ASP 155.A O no hydrogen 2.728 N/A ALA 160.A N PHE 74.A O no hydrogen 2.947 N/A ASN 161.A N VAL 178.A O no hydrogen 2.756 N/A VAL 162.A N PHE 72.A O no hydrogen 2.909 N/A VAL 163.A N VAL 176.A O no hydrogen 2.964 N/A ILE 164.A N THR 70.A O no hydrogen 2.778 N/A LYS 165.A N HIS 174.A O no hydrogen 2.884 N/A TYR 166.A N PHE 68.A O no hydrogen 2.820 N/A TYR 166.A OH VAL 192.A O no hydrogen 2.659 N/A ASP 167.A N ILE 172.A O no hydrogen 3.157 N/A ALA 168.A N SER 67.A OG no hydrogen 2.906 N/A SER 169.A OG ASP 167.A OD1 no hydrogen 2.873 N/A SER 169.A OG ASP 167.A OD2 no hydrogen 2.684 N/A THR 170.A N ASP 167.A OD2 no hydrogen 3.079 N/A THR 170.A OG1 ASP 167.A OD2 no hydrogen 2.705 N/A LYS 171.A N ASP 167.A O no hydrogen 2.674 N/A LYS 171.A NZ ASP 193.A OD2 no hydrogen 2.746 N/A ILE 172.A N THR 170.A OG1 no hydrogen 3.281 N/A LEU 173.A N ASP 190.A O no hydrogen 2.829 N/A HIS 174.A N LYS 165.A O no hydrogen 2.882 N/A VAL 175.A N ILE 188.A O no hydrogen 2.888 N/A VAL 176.A N VAL 163.A O no hydrogen 2.846 N/A LEU 177.A N TYR 186.A O no hydrogen 2.877 N/A VAL 178.A N ASN 161.A O no hydrogen 2.831 N/A PHE 179.A N THR 184.A O no hydrogen 3.195 N/A LEU 182.A N PHE 179.A O no hydrogen 3.000 N/A GLY 183.A N PHE 179.A O no hydrogen 2.753 N/A TYR 186.A N LEU 177.A O no hydrogen 2.840 N/A ILE 188.A N VAL 175.A O no hydrogen 3.113 N/A ASP 190.A N LEU 173.A O no hydrogen 3.036 N/A VAL 192.A N LYS 171.A O no hydrogen 2.904 N/A LYS 195.A NZ GLY 63.A O no hydrogen 2.720 N/A GLN 196.A N ASP 193.A O no hydrogen 2.957 N/A VAL 197.A N LEU 194.A O no hydrogen 2.920 N/A LEU 198.A N LEU 194.A O no hydrogen 2.748 N/A VAL 202.A N VAL 55.A O no hydrogen 2.802 N/A ASN 203.A N ALA 94.A O no hydrogen 2.820 N/A ASN 203.A ND2 VAL 202.A O no hydrogen 3.524 N/A GLY 205.A N PHE 92.A O no hydrogen 3.093 N/A PHE 206.A N ALA 49.A O no hydrogen 2.927 N/A SER 207.A N VAL 90.A O no hydrogen 3.055 N/A SER 207.A OG PHE 107.A O no hydrogen 2.659 N/A ALA 208.A N GLY 47.A O no hydrogen 3.098 N/A ALA 209.A N GLY 88.A O no hydrogen 3.316 N/A THR 210.A N SER 45.A O no hydrogen 2.839 N/A THR 210.A OG1 THR 42.A O no hydrogen 2.937 N/A THR 210.A OG1 SER 45.A O no hydrogen 3.341 N/A GLY 211.A N ALA 220.A O no hydrogen 2.658 N/A SER 214.A N ASP 212.A OD2 no hydrogen 2.852 N/A SER 214.A OG ASP 212.A OD2 no hydrogen 2.845 N/A GLY 215.A N ASP 212.A O no hydrogen 2.931 N/A LYS 216.A N PRO 213.A O no hydrogen 2.737 N/A ASN 219.A ND2 ARG 82.A O no hydrogen 3.552 N/A ALA 220.A N GLN 217.A O no hydrogen 3.183 N/A THR 221.A N ASN 219.A O no hydrogen 2.612 N/A THR 221.A OG1 THR 42.A O no hydrogen 2.886 N/A THR 223.A N ARG 77.A O no hydrogen 3.050 N/A HIS 224.A ND1 THR 34.A OG1 no hydrogen 2.894 N/A HIS 224.A NE2 GLU 222.A OE2 no hydrogen 2.482 N/A ASP 225.A N SER 75.A O no hydrogen 3.045 N/A ILE 226.A N LEU 31.A O no hydrogen 2.857 N/A LEU 227.A N SER 73.A O no hydrogen 2.745 N/A TRP 229.A N PHE 7.A O no hydrogen 3.004 N/A TRP 229.A NE1 THR 70.A OG1 no hydrogen 2.940 N/A SER 230.A N ARG 71.A O no hydrogen 2.872 N/A PHE 231.A N PHE 5.A O no hydrogen 2.911 N/A SER 232.A N GLU 69.A O no hydrogen 2.992 N/A ALA 233.A N ILE 3.A O no hydrogen 2.797 N/A SER 234.A N SER 67.A O no hydrogen 2.903 N/A SER 234.A OG THR 2.A OG1 no hydrogen 3.192 N/A LEU 235.A N LYS 1.A O no hydrogen 2.672 N/A