Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1wu8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N LYS 27.A O no hydrogen 2.889 N/A THR 2.A N VAL 58.A O no hydrogen 2.903 N/A THR 2.A OG1 HIS 59.A ND1 no hydrogen 2.683 N/A LEU 3.A N VAL 29.A O no hydrogen 2.848 N/A THR 4.A N VAL 60.A O no hydrogen 3.075 N/A THR 5.A N THR 32.A O no hydrogen 2.990 N/A THR 5.A OG1 HIS 33.A ND1 no hydrogen 2.650 N/A PHE 7.A N THR 5.A OG1 no hydrogen 3.232 N/A GLY 8.A N HIS 33.A O no hydrogen 2.756 N/A GLU 16.A N PRO 12.A O no hydrogen 2.899 N/A LYS 17.A NZ ASP 30.A OD1 no hydrogen 2.556 N/A VAL 18.A N GLY 15.A O no hydrogen 3.020 N/A ALA 19.A N GLU 16.A O no hydrogen 2.947 N/A ARG 21.A N VAL 18.A O no hydrogen 2.804 N/A ARG 21.A N ALA 19.A O no hydrogen 3.220 N/A ASN 23.A ND2 ALA 133.A O no hydrogen 3.226 N/A ALA 26.A N ASN 23.A O no hydrogen 3.056 N/A VAL 29.A N ILE 1.A O no hydrogen 2.690 N/A VAL 31.A N LEU 3.A O no hydrogen 2.883 N/A HIS 33.A ND1 THR 5.A OG1 no hydrogen 2.650 N/A HIS 33.A NE2 ASP 30.A OD2 no hydrogen 2.748 N/A SER 34.A N THR 32.A OG1 no hydrogen 2.901 N/A VAL 35.A N THR 5.A O no hydrogen 3.341 N/A THR 36.A N GLU 42.A OE2 no hydrogen 3.065 N/A THR 36.A OG1 GLU 42.A OE1 no hydrogen 3.010 N/A THR 36.A OG1 GLU 42.A OE2 no hydrogen 3.326 N/A ARG 37.A NE HIS 38.A NE2 no hydrogen 2.943 N/A ARG 37.A NH2 HIS 38.A NE2 no hydrogen 3.131 N/A HIS 38.A N ASP 6.A OD2 no hydrogen 2.935 N/A SER 39.A N THR 36.A O no hydrogen 2.895 N/A GLU 42.A N SER 39.A OG no hydrogen 3.319 N/A GLY 43.A N SER 39.A O no hydrogen 2.952 N/A SER 44.A N ILE 40.A O no hydrogen 2.774 N/A SER 44.A OG LEU 89.A O no hydrogen 2.750 N/A PHE 45.A N LEU 41.A O no hydrogen 3.007 N/A VAL 46.A N GLU 42.A O no hydrogen 3.075 N/A GLN 48.A N PHE 45.A O no hydrogen 3.239 N/A GLN 48.A NE2 PHE 45.A O no hydrogen 3.425 N/A VAL 49.A N VAL 46.A O no hydrogen 3.257 N/A LYS 51.A N GLU 47.A O no hydrogen 3.106 N/A LYS 51.A N GLN 48.A O no hydrogen 3.126 N/A LYS 51.A NZ GLN 48.A OE1 no hydrogen 2.985 N/A LYS 51.A NZ HIS 222.A O no hydrogen 3.145 N/A LYS 51.A NZ ASP 223.A OD2 no hydrogen 2.665 N/A TYR 52.A N VAL 49.A O no hydrogen 3.135 N/A SER 53.A N VAL 49.A O no hydrogen 3.018 N/A SER 53.A OG VAL 49.A O no hydrogen 2.884 N/A GLY 56.A N ASP 79.A O no hydrogen 2.969 N/A THR 57.A N PRO 54.A O no hydrogen 3.189 N/A THR 57.A OG1 PRO 54.A O no hydrogen 2.469 N/A HIS 59.A N TYR 81.A O no hydrogen 2.842 N/A HIS 59.A ND1 THR 2.A OG1 no hydrogen 2.683 N/A HIS 59.A NE2 GLN 80.A OE1 no hydrogen 2.905 N/A VAL 60.A N THR 2.A O no hydrogen 2.957 N/A GLY 61.A N VAL 83.A O no hydrogen 2.932 N/A VAL 62.A N THR 4.A O no hydrogen 2.726 N/A VAL 67.A N ASP 64.A O no hydrogen 3.053 N/A THR 69.A N GLY 66.A O no hydrogen 3.016 N/A THR 69.A OG1 GLY 66.A O no hydrogen 2.541 N/A ARG 71.A N THR 69.A OG1 no hydrogen 3.337 N/A ARG 71.A NE ASP 64.A OD1 no hydrogen 2.776 N/A ARG 71.A NE ASP 64.A OD2 no hydrogen 3.153 N/A ARG 71.A NH1 ARG 71.A O no hydrogen 2.870 N/A ARG 71.A NH2 ASP 64.A OD2 no hydrogen 2.513 N/A ARG 71.A NH2 HIS 123.A ND1 no hydrogen 2.808 N/A ARG 72.A NE ASP 86.A OD2 no hydrogen 3.004 N/A ARG 72.A NH2 ASP 86.A OD2 no hydrogen 2.928 N/A ARG 72.A NH2 SER 152.A OG no hydrogen 3.191 N/A ILE 74.A N VAL 84.A O no hydrogen 2.949 N/A VAL 75.A N TYR 103.A O no hydrogen 2.875 N/A ILE 76.A N LEU 82.A O no hydrogen 2.718 N/A GLU 77.A N SER 101.A O no hydrogen 2.862 N/A ASP 79.A N LYS 98.A O no hydrogen 2.999 N/A GLN 80.A NE2 VAL 50.A O no hydrogen 3.071 N/A TYR 81.A N THR 57.A O no hydrogen 2.922 N/A TYR 81.A OH GLU 77.A OE2 no hydrogen 3.253 N/A LEU 82.A N ILE 76.A O no hydrogen 2.971 N/A VAL 83.A N HIS 59.A O no hydrogen 2.880 N/A VAL 84.A N ILE 74.A O no hydrogen 3.139 N/A ASP 86.A N ARG 72.A O no hydrogen 2.734 N/A ASN 87.A N PRO 85.A O no hydrogen 2.911 N/A ASN 87.A ND2 ILE 63.A O no hydrogen 2.893 N/A LEU 89.A N ASN 87.A OD1 no hydrogen 3.173 N/A THR 91.A N GLY 88.A O no hydrogen 2.890 N/A THR 91.A OG1 GLY 88.A O no hydrogen 2.503 N/A LEU 92.A N SER 44.A OG no hydrogen 3.087 N/A LEU 94.A N ALA 90.A O no hydrogen 2.891 N/A LYS 95.A N LEU 92.A O no hydrogen 3.048 N/A LYS 95.A NZ GLU 47.A OE2 no hydrogen 2.797 N/A LYS 95.A NZ GLU 185.A OE2 no hydrogen 2.875 N/A HIS 96.A N PRO 93.A O no hydrogen 2.968 N/A HIS 96.A NE2 GLU 47.A OE2 no hydrogen 2.918 N/A ILE 97.A N LEU 94.A O no hydrogen 3.204 N/A LYS 98.A N ASP 79.A OD2 no hydrogen 3.123 N/A LYS 100.A N GLU 77.A O no hydrogen 2.727 N/A SER 101.A N GLU 77.A O no hydrogen 3.187 N/A SER 101.A OG TYR 103.A OH no hydrogen 3.407 N/A TYR 103.A N VAL 75.A O no hydrogen 2.781 N/A TYR 103.A OH SER 101.A OG no hydrogen 3.407 N/A GLU 104.A N ARG 146.A O no hydrogen 2.862 N/A ILE 105.A N ALA 73.A O no hydrogen 2.742 N/A ILE 106.A N PHE 144.A O no hydrogen 2.989 N/A LYS 109.A N ILE 106.A O no hydrogen 2.828 N/A ILE 110.A N ILE 106.A O no hydrogen 3.199 N/A ARG 111.A N PRO 107.A O no hydrogen 2.943 N/A PHE 113.A N ILE 110.A O no hydrogen 2.822 N/A THR 114.A N ILE 110.A O no hydrogen 3.111 N/A THR 114.A OG1 TRP 116.A O no hydrogen 3.466 N/A GLY 115.A N ARG 111.A O no hydrogen 3.008 N/A TRP 116.A NE1 ASP 126.A OD2 no hydrogen 2.866 N/A SER 119.A N ASP 126.A OD1 no hydrogen 2.792 N/A SER 119.A OG ASP 126.A OD1 no hydrogen 2.807 N/A PHE 122.A N SER 119.A OG no hydrogen 2.950 N/A ARG 125.A NE ASP 126.A OD2 no hydrogen 2.858 N/A ARG 125.A NH1 GLU 16.A OE1 no hydrogen 2.682 N/A ARG 125.A NH2 ASP 126.A OD1 no hydrogen 3.218 N/A ASP 126.A N PHE 122.A O no hydrogen 3.309 N/A ILE 127.A N HIS 123.A O no hydrogen 2.639 N/A PHE 128.A N HIS 123.A O no hydrogen 2.914 N/A GLY 129.A N GLY 124.A O no hydrogen 2.909 N/A ALA 131.A N ILE 127.A O no hydrogen 2.935 N/A GLY 132.A N PHE 128.A O no hydrogen 3.052 N/A ALA 133.A N GLY 129.A O no hydrogen 3.020 N/A LEU 134.A N PRO 130.A O no hydrogen 2.873 N/A ILE 135.A N ALA 131.A O no hydrogen 3.071 N/A GLU 136.A N GLY 132.A O no hydrogen 2.941 N/A LYS 137.A N ALA 133.A O no hydrogen 3.195 N/A LYS 137.A N LEU 134.A O no hydrogen 3.079 N/A GLY 138.A N ILE 135.A O no hydrogen 3.027 N/A ILE 139.A N LEU 134.A O no hydrogen 3.031 N/A GLU 142.A N GLU 142.A OE1 no hydrogen 2.698 N/A GLU 143.A N HIS 140.A O no hydrogen 2.968 N/A PHE 144.A N PRO 141.A O no hydrogen 2.868 N/A ARG 146.A N GLU 104.A O no hydrogen 3.066 N/A ILE 148.A N VAL 102.A O no hydrogen 2.959 N/A SER 152.A N PRO 149.A O no hydrogen 2.597 N/A SER 152.A OG PRO 149.A O no hydrogen 2.584 N/A ILE 153.A N VAL 150.A O no hydrogen 3.291 N/A VAL 154.A N ASP 86.A OD1 no hydrogen 3.024 N/A LEU 156.A N THR 91.A OG1 no hydrogen 3.026 N/A ARG 161.A N ILE 168.A O no hydrogen 3.321 N/A GLU 163.A N VAL 166.A O no hydrogen 2.661 N/A VAL 166.A N GLU 163.A O no hydrogen 3.327 N/A TRP 167.A N VAL 247.A O no hydrogen 2.610 N/A ILE 168.A N ARG 161.A O no hydrogen 2.643 N/A LEU 169.A N LEU 245.A O no hydrogen 3.057 N/A LYS 170.A N ASN 183.A OD1 no hydrogen 2.588 N/A VAL 171.A N ASP 243.A O no hydrogen 2.927 N/A ILE 172.A N ILE 181.A O no hydrogen 3.028 N/A ASP 175.A N ASN 179.A O no hydrogen 3.201 N/A PHE 177.A N ASP 175.A OD1 no hydrogen 2.817 N/A GLY 178.A N ASP 175.A O no hydrogen 3.081 N/A ASN 179.A N ASP 175.A OD1 no hydrogen 2.929 N/A ASN 179.A ND2 ASP 175.A OD2 no hydrogen 3.051 N/A VAL 180.A N ILE 227.A O no hydrogen 2.948 N/A ILE 181.A N TYR 173.A O no hydrogen 2.780 N/A LEU 182.A N LEU 225.A O no hydrogen 2.872 N/A ASN 183.A N LYS 170.A O no hydrogen 2.971 N/A ASN 183.A ND2 VAL 158.A O no hydrogen 3.066 N/A LEU 184.A N LEU 182.A O no hydrogen 2.677 N/A TYR 187.A OH TYR 204.A OH no hydrogen 2.904 N/A LYS 189.A NZ GLU 206.A OE2 no hydrogen 3.324 N/A ARG 191.A N LEU 250.A O no hydrogen 2.799 N/A THR 192.A N LEU 250.A O no hydrogen 3.349 N/A VAL 193.A N LEU 202.A O no hydrogen 2.859 N/A GLU 194.A N ARG 248.A O no hydrogen 2.883 N/A LEU 196.A N ARG 246.A O no hydrogen 2.941 N/A PHE 198.A N LEU 195.A O no hydrogen 2.903 N/A ASN 199.A N LEU 196.A O no hydrogen 3.390 N/A LEU 200.A N LEU 195.A O no hydrogen 3.401 N/A LEU 202.A N VAL 193.A O no hydrogen 2.780 N/A TYR 204.A N ARG 191.A O no hydrogen 2.923 N/A TYR 204.A OH TYR 187.A OH no hydrogen 2.904 N/A LEU 205.A N ALA 217.A O no hydrogen 3.012 N/A TYR 208.A OH GLU 226.A OE2 no hydrogen 2.650 N/A LEU 210.A N THR 207.A O no hydrogen 3.280 N/A VAL 211.A N TYR 208.A O no hydrogen 3.375 N/A GLU 212.A N GLU 215.A OE2 no hydrogen 3.005 N/A GLY 214.A N ASN 230.A O no hydrogen 3.017 N/A GLU 215.A N GLU 212.A O no hydrogen 3.086 N/A ALA 217.A N PRO 203.A O no hydrogen 3.020 N/A LEU 218.A N GLU 226.A O no hydrogen 2.852 N/A TYR 224.A OH GLU 47.A OE1 no hydrogen 2.752 N/A TYR 224.A OH GLU 47.A OE2 no hydrogen 3.143 N/A LEU 225.A N LEU 184.A O no hydrogen 3.051 N/A GLU 226.A N LEU 218.A O no hydrogen 3.131 N/A ILE 227.A N VAL 180.A O no hydrogen 2.865 N/A ALA 228.A N LEU 216.A O no hydrogen 2.916 N/A ASN 230.A N GLU 215.A O no hydrogen 2.922 N/A ASN 230.A ND2 VAL 211.A O no hydrogen 2.710 N/A ALA 234.A N GLY 178.A O no hydrogen 2.826 N/A GLU 235.A N SER 232.A OG no hydrogen 3.082 N/A ARG 236.A N SER 232.A O no hydrogen 2.962 N/A ARG 236.A NH1 GLY 214.A O no hydrogen 3.061 N/A ARG 236.A NH2 GLY 214.A O no hydrogen 2.578 N/A LEU 237.A N ALA 233.A O no hydrogen 2.791 N/A VAL 239.A N ALA 234.A O no hydrogen 3.228 N/A LYS 240.A N ASP 243.A OD2 no hydrogen 2.634 N/A GLY 242.A N VAL 171.A O no hydrogen 2.798 N/A ASP 243.A N LYS 240.A O no hydrogen 2.995 N/A LEU 245.A N LEU 169.A O no hydrogen 2.815 N/A ARG 246.A N ASP 197.A OD2 no hydrogen 2.744 N/A ARG 246.A NH1 GLU 163.A OE1 no hydrogen 3.053 N/A VAL 247.A N TRP 167.A O no hydrogen 2.728 N/A ARG 248.A N GLU 194.A O no hydrogen 3.182 N/A ARG 248.A NE ASP 165.A OD1 no hydrogen 3.063 N/A ARG 248.A NH1 GLU 194.A OE2 no hydrogen 3.020 N/A LEU 250.A N THR 192.A O no hydrogen 2.907 N/A