Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2hku_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A NH2 GLU 50.A OE1 no hydrogen 3.174 N/A ALA 5.A N GLN 1.A O no hydrogen 3.066 N/A LEU 6.A N THR 2.A O no hydrogen 2.863 N/A PHE 7.A N ARG 3.A O no hydrogen 3.074 N/A THR 8.A N ASP 4.A O no hydrogen 2.956 N/A THR 8.A OG1 ASP 4.A O no hydrogen 3.182 N/A ALA 9.A N ALA 5.A O no hydrogen 3.109 N/A ALA 10.A N LEU 6.A O no hydrogen 2.721 N/A THR 11.A N PHE 7.A O no hydrogen 2.795 N/A THR 11.A OG1 PHE 7.A O no hydrogen 2.721 N/A GLU 12.A N THR 8.A O no hydrogen 3.027 N/A LEU 13.A N ALA 9.A O no hydrogen 2.989 N/A PHE 14.A N ALA 10.A O no hydrogen 2.855 N/A LEU 15.A N THR 11.A O no hydrogen 3.040 N/A GLU 16.A N GLU 12.A O no hydrogen 3.261 N/A HIS 17.A N LEU 13.A O no hydrogen 2.862 N/A GLY 18.A N PHE 14.A O no hydrogen 2.966 N/A VAL 21.A N GLY 18.A O no hydrogen 3.400 N/A GLN 25.A N PRO 22.A O no hydrogen 3.175 N/A ILE 26.A N PRO 22.A O no hydrogen 3.441 N/A CYS 27.A N ILE 23.A O no hydrogen 2.832 N/A CYS 27.A SG ILE 23.A O no hydrogen 3.453 N/A ALA 28.A N THR 24.A O no hydrogen 2.754 N/A ALA 29.A N GLN 25.A O no hydrogen 3.013 N/A ALA 30.A N ILE 26.A O no hydrogen 2.799 N/A GLY 31.A N ALA 28.A O no hydrogen 3.298 N/A ALA 32.A N CYS 27.A O no hydrogen 2.890 N/A HIS 33.A N GLN 36.A OE1 no hydrogen 2.995 N/A ASN 35.A N HIS 33.A ND1 no hydrogen 2.851 N/A GLN 36.A N HIS 33.A O no hydrogen 2.835 N/A VAL 37.A N PRO 34.A O no hydrogen 3.164 N/A THR 38.A OG1 ASN 35.A O no hydrogen 3.388 N/A TYR 39.A N ASN 35.A O no hydrogen 3.031 N/A TYR 40.A N GLN 36.A O no hydrogen 2.771 N/A TYR 41.A N VAL 37.A O no hydrogen 2.869 N/A TYR 41.A OH ARG 3.A O no hydrogen 3.014 N/A GLY 42.A N THR 38.A O no hydrogen 2.826 N/A LYS 44.A NZ GLU 19.A O no hydrogen 3.053 N/A LYS 44.A NZ VAL 21.A O no hydrogen 2.744 N/A ARG 46.A N SER 43.A OG no hydrogen 3.112 N/A LEU 47.A N SER 43.A O no hydrogen 3.122 N/A PHE 48.A N LYS 44.A O no hydrogen 2.895 N/A VAL 49.A N GLU 45.A O no hydrogen 2.854 N/A GLU 50.A N ARG 46.A O no hydrogen 2.933 N/A VAL 51.A N LEU 47.A O no hydrogen 2.872 N/A ALA 52.A N PHE 48.A O no hydrogen 2.892 N/A CYS 53.A N VAL 49.A O no hydrogen 2.908 N/A CYS 53.A SG VAL 49.A O no hydrogen 3.328 N/A CYS 53.A SG LEU 109.A O no hydrogen 3.721 N/A CYS 53.A SG THR 113.A OG1 no hydrogen 3.139 N/A ALA 54.A N GLU 50.A O no hydrogen 2.984 N/A ALA 55.A N VAL 51.A O no hydrogen 2.862 N/A VAL 56.A N ALA 52.A O no hydrogen 3.094 N/A LEU 57.A N CYS 53.A O no hydrogen 3.087 N/A ARG 58.A N ALA 54.A O no hydrogen 2.836 N/A ALA 59.A N ALA 55.A O no hydrogen 2.839 N/A GLY 60.A N VAL 56.A O no hydrogen 2.848 N/A LYS 61.A N LEU 57.A O no hydrogen 2.937 N/A LYS 61.A NZ ASP 65.A OD2 no hydrogen 2.758 N/A ARG 62.A N ARG 58.A O no hydrogen 2.807 N/A ARG 62.A NH1 ASP 66.A OD1 no hydrogen 2.981 N/A ALA 63.A N ALA 59.A O no hydrogen 3.084 N/A GLU 64.A N GLY 60.A O no hydrogen 3.083 N/A ASP 65.A N LYS 61.A O no hydrogen 2.766 N/A ASP 66.A N ARG 62.A O no hydrogen 2.817 N/A ALA 67.A N ALA 63.A O no hydrogen 2.890 N/A ALA 68.A N GLU 64.A O no hydrogen 2.929 N/A THR 69.A OG1 ASP 66.A O no hydrogen 3.077 N/A THR 72.A OG1 ARG 186.A O no hydrogen 2.656 N/A VAL 73.A N THR 188.A O no hydrogen 2.642 N/A GLY 74.A N ARG 186.A O no hydrogen 2.768 N/A ASP 75.A N THR 72.A OG1 no hydrogen 3.356 N/A TYR 76.A N THR 72.A O no hydrogen 2.684 N/A THR 77.A N VAL 73.A O no hydrogen 2.924 N/A THR 77.A OG1 VAL 73.A O no hydrogen 3.090 N/A GLU 78.A N GLY 74.A O no hydrogen 3.050 N/A LYS 79.A N ASP 75.A O no hydrogen 3.064 N/A LEU 80.A N TYR 76.A O no hydrogen 2.740 N/A VAL 81.A N THR 77.A O no hydrogen 2.956 N/A GLY 82.A N GLU 78.A O no hydrogen 2.746 N/A SER 83.A N LYS 79.A O no hydrogen 3.022 N/A LEU 84.A N LEU 80.A O no hydrogen 3.219 N/A LEU 85.A N VAL 81.A O no hydrogen 2.892 N/A GLY 86.A N GLY 82.A O no hydrogen 2.999 N/A GLY 88.A N SER 83.A O no hydrogen 2.630 N/A ALA 89.A N GLY 86.A O no hydrogen 3.150 N/A VAL 92.A N GLY 88.A O no hydrogen 3.086 N/A GLU 93.A N ALA 89.A O no hydrogen 2.747 N/A LEU 94.A N PRO 90.A O no hydrogen 2.844 N/A PHE 95.A N SER 91.A O no hydrogen 3.137 N/A THR 96.A N VAL 92.A O no hydrogen 2.802 N/A THR 96.A OG1 GLU 93.A O no hydrogen 2.785 N/A SER 97.A N GLU 93.A O no hydrogen 2.993 N/A SER 97.A OG GLU 93.A O no hydrogen 3.401 N/A ALA 98.A N LEU 94.A O no hydrogen 2.776 N/A THR 100.A OG1 ALA 98.A O no hydrogen 3.562 N/A THR 100.A OG1 THR 100.A O no hydrogen 2.484 N/A LEU 106.A N ARG 103.A O no hydrogen 2.986 N/A ARG 107.A N ARG 103.A O no hydrogen 2.873 N/A ASP 108.A N SER 104.A O no hydrogen 3.022 N/A ILE 110.A N LEU 106.A O no hydrogen 3.303 N/A THR 111.A N ARG 107.A O no hydrogen 2.810 N/A THR 111.A OG1 ARG 107.A O no hydrogen 3.157 N/A THR 111.A OG1 ASP 108.A O no hydrogen 3.561 N/A ASP 112.A N ASP 108.A O no hydrogen 2.858 N/A THR 113.A N LEU 109.A O no hydrogen 3.011 N/A THR 113.A OG1 LEU 109.A O no hydrogen 2.644 N/A LEU 114.A N ILE 110.A O no hydrogen 2.902 N/A ARG 115.A N THR 111.A O no hydrogen 2.974 N/A THR 116.A N ASP 112.A O no hydrogen 3.098 N/A THR 116.A OG1 ASP 112.A O no hydrogen 3.036 N/A LEU 117.A N THR 113.A O no hydrogen 2.938 N/A HIS 118.A N LEU 114.A O no hydrogen 3.007 N/A SER 119.A N ARG 115.A O no hydrogen 2.805 N/A SER 119.A OG ARG 115.A O no hydrogen 3.109 N/A SER 120.A N THR 116.A O no hydrogen 2.808 N/A SER 120.A OG GLU 64.A OE2 no hydrogen 3.451 N/A SER 120.A OG LEU 117.A O no hydrogen 2.572 N/A GLY 121.A N LEU 117.A O no hydrogen 2.996 N/A GLY 121.A N HIS 118.A O no hydrogen 3.133 N/A GLU 122.A N HIS 118.A O no hydrogen 3.182 N/A VAL 123.A N SER 119.A O no hydrogen 3.160 N/A ALA 124.A N SER 120.A O no hydrogen 2.993 N/A ILE 126.A N GLY 121.A O no hydrogen 2.970 N/A ARG 127.A N GLU 122.A O no hydrogen 3.023 N/A THR 128.A N ALA 124.A O no hydrogen 2.936 N/A THR 128.A OG1 TYR 76.A OH no hydrogen 3.074 N/A THR 128.A OG1 ALA 124.A O no hydrogen 2.914 N/A LEU 129.A N LEU 125.A O no hydrogen 3.034 N/A THR 131.A N THR 128.A O no hydrogen 3.235 N/A THR 131.A OG1 THR 128.A O no hydrogen 3.016 N/A TRP 133.A N LEU 129.A O no hydrogen 2.855 N/A TRP 133.A NE1 LEU 179.A O no hydrogen 2.729 N/A GLN 134.A NE2 GLY 132.A O no hydrogen 3.270 N/A ARG 136.A N GLU 142.A OE2 no hydrogen 2.778 N/A ARG 136.A NE GLU 142.A OE1 no hydrogen 3.317 N/A ARG 136.A NE GLU 142.A OE2 no hydrogen 2.843 N/A ARG 136.A NH1 GLU 142.A OE1 no hydrogen 2.931 N/A ARG 136.A NH1 ASN 178.A O no hydrogen 2.976 N/A ARG 136.A NH2 ASN 178.A O no hydrogen 2.846 N/A ALA 137.A N GLU 142.A OE2 no hydrogen 3.011 N/A GLU 142.A N GLY 138.A O no hydrogen 3.152 N/A SER 143.A N ILE 139.A O no hydrogen 3.141 N/A SER 143.A OG HIS 118.A O no hydrogen 2.586 N/A LYS 144.A N ASP 140.A O no hydrogen 3.142 N/A ALA 145.A N VAL 141.A O no hydrogen 2.832 N/A PHE 146.A N GLU 142.A O no hydrogen 3.040 N/A TRP 147.A N SER 143.A O no hydrogen 2.912 N/A SER 148.A N LYS 144.A O no hydrogen 2.941 N/A SER 148.A OG LYS 144.A O no hydrogen 2.785 N/A SER 148.A OG ALA 145.A O no hydrogen 3.495 N/A ALA 149.A N ALA 145.A O no hydrogen 3.344 N/A ILE 150.A N PHE 146.A O no hydrogen 3.040 N/A PHE 151.A N TRP 147.A O no hydrogen 2.983 N/A GLY 152.A N SER 148.A O no hydrogen 2.978 N/A LEU 153.A N ALA 149.A O no hydrogen 2.712 N/A VAL 154.A N ILE 150.A O no hydrogen 2.910 N/A ILE 155.A N PHE 151.A O no hydrogen 2.943 N/A GLN 156.A N GLY 152.A O no hydrogen 3.171 N/A GLN 156.A NE2 GLY 152.A O no hydrogen 2.891 N/A LYS 157.A N LEU 153.A O no hydrogen 2.844 N/A LYS 157.A NZ LEU 85.A O no hydrogen 2.684 N/A THR 158.A N VAL 154.A O no hydrogen 3.188 N/A THR 158.A OG1 GLU 93.A OE1 no hydrogen 3.102 N/A ALA 159.A N ILE 155.A O no hydrogen 3.043 N/A THR 160.A N GLN 156.A O no hydrogen 3.023 N/A THR 160.A OG1 GLN 156.A O no hydrogen 2.529 N/A THR 160.A OG1 LYS 157.A O no hydrogen 3.104 N/A THR 160.A OG1 SER 163.A O no hydrogen 3.202 N/A GLY 161.A N THR 158.A O no hydrogen 3.331 N/A GLU 162.A N LYS 157.A O no hydrogen 2.653 N/A PHE 164.A N SER 163.A OG no hydrogen 2.683 N/A TYR 166.A N SER 163.A O no hydrogen 2.930 N/A SER 167.A N GLU 170.A OE1 no hydrogen 3.185 N/A SER 167.A OG GLU 170.A OE1 no hydrogen 2.682 N/A GLU 170.A N SER 167.A OG no hydrogen 3.288 N/A ALA 171.A N SER 167.A O no hydrogen 2.868 N/A VAL 172.A N LEU 168.A O no hydrogen 3.047 N/A ALA 173.A N GLU 169.A O no hydrogen 3.028 N/A VAL 174.A N GLU 170.A O no hydrogen 3.092 N/A VAL 174.A N ALA 171.A O no hydrogen 3.147 N/A ILE 175.A N ALA 171.A O no hydrogen 3.418 N/A PHE 176.A N VAL 172.A O no hydrogen 3.058 N/A ALA 177.A N ALA 173.A O no hydrogen 2.932 N/A ASN 178.A N VAL 174.A O no hydrogen 2.788 N/A LEU 179.A N ILE 175.A O no hydrogen 2.964 N/A GLN 180.A N PHE 176.A O no hydrogen 2.878 N/A ARG 186.A N PRO 182.A O no hydrogen 2.921 N/A ARG 186.A NH1 ILE 181.A O no hydrogen 2.485 N/A ASN 187.A N GLU 183.A O no hydrogen 3.028 N/A ASN 187.A N THR 184.A O no hydrogen 3.223 N/A THR 188.A N THR 184.A O no hydrogen 3.185 N/A THR 188.A OG1 THR 184.A O no hydrogen 2.847 N/A THR 188.A OG1 VAL 185.A O no hydrogen 3.276 N/A