Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3qun_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 10.A N GLY 7.A O no hydrogen 3.115 N/A ASP 13.A N ARG 159.A O no hydrogen 2.758 N/A PHE 14.A N ARG 159.A O no hydrogen 3.108 N/A LEU 15.A N ARG 55.A O no hydrogen 2.912 N/A ALA 16.A N ARG 161.A O no hydrogen 2.859 N/A ILE 17.A N VAL 57.A O no hydrogen 3.120 N/A LYS 18.A N VAL 163.A O no hydrogen 2.770 N/A LYS 18.A NZ ASP 146.A OD1 no hydrogen 2.998 N/A VAL 19.A N ILE 59.A O no hydrogen 2.939 N/A GLY 20.A N LEU 165.A O no hydrogen 2.917 N/A LEU 23.A N GLY 20.A O no hydrogen 3.048 N/A PHE 24.A N GLY 21.A O no hydrogen 3.240 N/A SER 25.A OG GLY 21.A O no hydrogen 2.954 N/A ARG 26.A N SER 32.A O no hydrogen 3.071 N/A SER 32.A N GLU 29.A O no hydrogen 3.292 N/A SER 32.A OG GLU 29.A O no hydrogen 2.698 N/A ASP 34.A N PHE 24.A O no hydrogen 2.710 N/A ALA 37.A N ASP 34.A OD1 no hydrogen 2.909 N/A VAL 38.A N ASP 34.A O no hydrogen 3.026 N/A THR 39.A N ASP 35.A O no hydrogen 2.890 N/A THR 39.A OG1 ASP 35.A O no hydrogen 2.723 N/A THR 39.A OG1 ASP 35.A OD2 no hydrogen 3.514 N/A ARG 40.A N ASP 36.A O no hydrogen 2.953 N/A ARG 40.A NH1 ASP 36.A OD2 no hydrogen 3.485 N/A PHE 41.A N ALA 37.A O no hydrogen 2.941 N/A ALA 42.A N VAL 38.A O no hydrogen 2.892 N/A ARG 43.A N THR 39.A O no hydrogen 3.178 N/A ASN 44.A N ARG 40.A O no hydrogen 3.304 N/A PHE 45.A N PHE 41.A O no hydrogen 2.777 N/A ALA 46.A N ALA 42.A O no hydrogen 2.832 N/A ARG 47.A N ARG 43.A O no hydrogen 3.490 N/A ALA 49.A N PHE 45.A O no hydrogen 2.753 N/A GLU 50.A N ALA 46.A O no hydrogen 3.016 N/A THR 51.A N ARG 47.A O no hydrogen 3.372 N/A THR 51.A OG1 ARG 47.A O no hydrogen 3.136 N/A TYR 52.A N LEU 48.A O no hydrogen 2.775 N/A TYR 52.A OH PRO 12.A O no hydrogen 2.729 N/A TYR 52.A OH THR 230.A O no hydrogen 3.259 N/A ARG 55.A N TYR 52.A O no hydrogen 2.680 N/A ARG 55.A NH2 THR 51.A O no hydrogen 2.966 N/A VAL 57.A N LEU 15.A O no hydrogen 2.999 N/A LEU 58.A N PRO 126.A O no hydrogen 3.052 N/A ILE 59.A N ILE 17.A O no hydrogen 2.870 N/A SER 60.A N LEU 128.A O no hydrogen 2.870 N/A SER 60.A OG GLY 61.A O no hydrogen 2.751 N/A GLY 61.A N VAL 19.A O no hydrogen 2.785 N/A ALA 69.A N PHE 66.A O no hydrogen 2.992 N/A GLY 70.A N SER 67.A O no hydrogen 2.938 N/A THR 72.A N LEU 68.A O no hydrogen 3.406 N/A THR 72.A OG1 ASP 131.A OD1 no hydrogen 2.639 N/A GLU 73.A N ALA 69.A O no hydrogen 3.407 N/A ALA 74.A N GLY 70.A O no hydrogen 2.968 N/A THR 75.A N LEU 71.A O no hydrogen 2.893 N/A THR 75.A OG1 LEU 71.A O no hydrogen 3.565 N/A THR 75.A OG1 GLY 130.A O no hydrogen 2.767 N/A PHE 76.A N THR 72.A O no hydrogen 2.994 N/A GLU 77.A N GLU 73.A O no hydrogen 3.038 N/A VAL 78.A N ALA 74.A O no hydrogen 3.327 N/A LYS 79.A N THR 75.A O no hydrogen 3.170 N/A LYS 79.A NZ THR 75.A O no hydrogen 2.943 N/A LYS 80.A N PHE 76.A O no hydrogen 2.837 N/A LYS 80.A NZ GLU 84.A OE2 no hydrogen 2.705 N/A ARG 81.A N GLU 77.A O no hydrogen 3.001 N/A TRP 82.A N VAL 78.A O no hydrogen 3.200 N/A TRP 82.A NE1 SER 60.A OG no hydrogen 2.884 N/A ALA 83.A N LYS 79.A O no hydrogen 2.881 N/A GLU 84.A N LYS 80.A O no hydrogen 2.841 N/A LYS 85.A N ARG 81.A O no hydrogen 3.129 N/A LYS 85.A NZ ASP 35.A OD1 no hydrogen 2.707 N/A LYS 85.A NZ THR 39.A OG1 no hydrogen 3.012 N/A LEU 86.A N TRP 82.A O no hydrogen 2.934 N/A ARG 87.A N ALA 83.A O no hydrogen 2.893 N/A ARG 87.A NH1 ALA 93.A O no hydrogen 3.043 N/A GLY 88.A N GLU 84.A O no hydrogen 3.002 N/A ILE 89.A N LEU 86.A O no hydrogen 3.037 N/A GLY 90.A N ARG 87.A O no hydrogen 3.079 N/A VAL 91.A N LEU 86.A O no hydrogen 3.095 N/A ALA 93.A N VAL 91.A O no hydrogen 2.925 N/A PHE 94.A N LEU 125.A O no hydrogen 2.995 N/A LEU 96.A N VAL 127.A O no hydrogen 3.014 N/A GLN 97.A NE2 THR 72.A OG1 no hydrogen 2.904 N/A ALA 99.A N ASP 131.A OD2 no hydrogen 3.090 N/A ALA 100.A N GLN 97.A O no hydrogen 2.979 N/A MET 101.A N LEU 98.A O no hydrogen 3.003 N/A CYS 102.A SG THR 103.A O no hydrogen 3.952 N/A THR 103.A N GLN 110.A O no hydrogen 3.197 N/A LEU 104.A N PHE 134.A O no hydrogen 2.755 N/A ARG 105.A N ILE 108.A O no hydrogen 2.954 N/A ASN 106.A N GLU 136.A OE2 no hydrogen 2.486 N/A ILE 108.A N ARG 105.A O no hydrogen 3.096 N/A GLN 110.A N THR 103.A O no hydrogen 2.637 N/A ARG 112.A N.A MET 101.A O no hydrogen 2.732 N/A ARG 112.A N.B MET 101.A O no hydrogen 2.600 N/A ARG 112.A NH1.A LEU 111.A O.B no hydrogen 2.928 N/A ARG 112.A NH1.B THR 103.A OG1 no hydrogen 3.293 N/A SER 113.A OG.B ARG 112.A O.A no hydrogen 2.777 N/A ARG 117.A N SER 113.A O.A no hydrogen 2.713 N/A ASP 118.A N GLU 114.A O.A no hydrogen 2.870 N/A ASP 118.A N GLU 114.A O.B no hydrogen 3.120 N/A VAL 119.A N VAL 115.A O no hydrogen 2.955 N/A LEU 120.A N LEU 116.A O no hydrogen 2.994 N/A ASP 121.A N ARG 117.A O no hydrogen 2.320 N/A GLY 123.A N LEU 120.A O no hydrogen 2.543 N/A ALA 124.A N VAL 119.A O no hydrogen 2.823 N/A LEU 125.A N ASP 92.A O no hydrogen 2.766 N/A VAL 127.A N PHE 94.A O no hydrogen 2.974 N/A LEU 128.A N LEU 58.A O no hydrogen 2.778 N/A ASP 131.A N PHE 143.A O no hydrogen 2.961 N/A ALA 132.A N ASP 131.A OD1 no hydrogen 2.829 N/A LEU 133.A N TRP 141.A O no hydrogen 2.840 N/A ASP 135.A N LYS 139.A O no hydrogen 2.677 N/A GLU 136.A N GLU 136.A OE1 no hydrogen 2.658 N/A GLY 138.A N ASP 135.A O no hydrogen 2.781 N/A LYS 139.A N ASP 135.A OD1 no hydrogen 2.561 N/A TRP 141.A N LEU 133.A O no hydrogen 2.733 N/A TRP 141.A NE1 ASP 135.A OD2 no hydrogen 3.062 N/A PHE 143.A N ASP 131.A O no hydrogen 2.743 N/A ASP 146.A N SER 144.A OG no hydrogen 2.987 N/A ARG 147.A N SER 144.A O no hydrogen 2.998 N/A ARG 147.A NE GLU 150.A OE2 no hydrogen 2.932 N/A ARG 147.A NH2 GLY 107.A O no hydrogen 3.527 N/A ARG 147.A NH2 GLU 150.A OE1 no hydrogen 2.972 N/A VAL 148.A N SER 145.A O no hydrogen 3.086 N/A GLU 150.A N ARG 147.A O no hydrogen 2.916 N/A VAL 151.A N VAL 148.A O no hydrogen 2.893 N/A LEU 152.A N PRO 149.A O no hydrogen 3.101 N/A LEU 153.A N GLU 150.A O no hydrogen 3.278 N/A MET 155.A N LEU 152.A O no hydrogen 2.977 N/A VAL 156.A N LEU 152.A O no hydrogen 2.995 N/A ARG 159.A N ASP 13.A OD2 no hydrogen 2.863 N/A ARG 159.A NE THR 11.A O no hydrogen 2.821 N/A ARG 159.A NH1 PRO 5.A O no hydrogen 2.897 N/A ARG 159.A NH2 THR 11.A O no hydrogen 3.106 N/A ARG 161.A N PHE 14.A O no hydrogen 2.872 N/A ARG 161.A NE GLU 214.A OE1 no hydrogen 2.905 N/A ARG 161.A NH1 LEU 229.A O no hydrogen 2.724 N/A ARG 161.A NH1 ALA 231.A O no hydrogen 2.781 N/A ARG 161.A NH2 GLU 214.A OE1 no hydrogen 2.865 N/A ARG 161.A NH2 ALA 231.A O no hydrogen 2.989 N/A VAL 162.A N GLU 214.A O no hydrogen 2.914 N/A VAL 163.A N ALA 16.A O no hydrogen 2.888 N/A THR 164.A N PHE 216.A O no hydrogen 2.843 N/A LEU 165.A N LYS 18.A O no hydrogen 2.831 N/A THR 166.A N MET 218.A O no hydrogen 2.906 N/A THR 166.A OG1 ASP 167.A OD1 no hydrogen 3.542 N/A ASP 167.A N THR 166.A OG1 no hydrogen 2.734 N/A ILE 171.A N THR 243.A OG1 no hydrogen 2.782 N/A THR 173.A N THR 177.A O no hydrogen 2.493 N/A THR 173.A OG1 THR 177.A O no hydrogen 3.420 N/A THR 177.A N THR 173.A O no hydrogen 3.265 N/A LEU 179.A N ILE 171.A O no hydrogen 2.782 N/A VAL 182.A N ARG 244.A O no hydrogen 2.795 N/A ALA 184.A N THR 246.A O no hydrogen 2.792 N/A ARG 185.A N ASP 183.A OD1 no hydrogen 2.857 N/A SER 186.A N ASP 183.A O no hydrogen 2.977 N/A TYR 191.A N PRO 187.A O no hydrogen 3.252 N/A TYR 191.A OH ASP 203.A OD1 no hydrogen 2.528 N/A ALA 192.A N GLU 188.A O no hydrogen 2.871 N/A ALA 193.A N GLN 189.A O no hydrogen 3.155 N/A ALA 193.A N ALA 190.A O no hydrogen 3.098 N/A LEU 194.A N TYR 191.A O no hydrogen 3.229 N/A THR 200.A N GLY 196.A O no hydrogen 2.770 N/A THR 200.A N ALA 197.A O no hydrogen 3.143 N/A THR 200.A OG1 GLY 196.A O no hydrogen 2.447 N/A LYS 201.A N ALA 197.A O no hydrogen 3.376 N/A LYS 201.A NZ ASP 146.A OD1 no hydrogen 3.178 N/A LYS 201.A NZ ASP 146.A OD2 no hydrogen 3.140 N/A LEU 202.A N MET 198.A O no hydrogen 2.925 N/A ASP 203.A N HIS 199.A O no hydrogen 2.916 N/A ALA 204.A N THR 200.A O no hydrogen 3.069 N/A LEU 205.A N LYS 201.A O no hydrogen 2.898 N/A VAL 206.A N LEU 202.A O no hydrogen 2.901 N/A THR 207.A N ASP 203.A O no hydrogen 3.063 N/A THR 207.A OG1 ASP 203.A O no hydrogen 2.987 N/A CYS 208.A N ALA 204.A O no hydrogen 3.062 N/A CYS 208.A SG ALA 204.A O no hydrogen 3.423 N/A ALA 209.A N LEU 205.A O no hydrogen 2.857 N/A ARG 210.A N VAL 206.A O no hydrogen 2.915 N/A ARG 211.A N CYS 208.A O no hydrogen 2.938 N/A GLY 212.A N ALA 209.A O no hydrogen 2.890 N/A ALA 213.A N CYS 208.A O no hydrogen 3.150 N/A GLU 214.A N LEU 160.A O no hydrogen 2.889 N/A CYS 215.A N ILE 245.A O no hydrogen 3.010 N/A CYS 215.A SG LEU 205.A O no hydrogen 3.620 N/A PHE 216.A N VAL 162.A O no hydrogen 2.877 N/A ILE 217.A N THR 243.A O no hydrogen 2.887 N/A MET 218.A N THR 164.A O no hydrogen 3.136 N/A ARG 219.A NE ASP 169.A OD1 no hydrogen 2.972 N/A GLY 220.A N THR 166.A O no hydrogen 2.965 N/A GLY 223.A N ASP 221.A OD1 no hydrogen 2.782 N/A SER 224.A N ASP 221.A O no hydrogen 2.920 N/A GLU 227.A N ASP 225.A OD1 no hydrogen 2.940 N/A LEU 229.A N LEU 226.A O no hydrogen 2.822 N/A THR 230.A N GLU 227.A O no hydrogen 3.056 N/A THR 230.A OG1 GLU 227.A O no hydrogen 2.723 N/A ALA 231.A N PHE 228.A O no hydrogen 3.023 N/A SER 234.A N SER 8.A O no hydrogen 2.923 N/A SER 234.A OG SER 8.A O no hydrogen 3.246 N/A SER 235.A N PRO 232.A O no hydrogen 3.005 N/A SER 235.A OG PRO 232.A O no hydrogen 3.052 N/A TRP 236.A N PHE 233.A O no hydrogen 3.064 N/A TRP 236.A NE1 ALA 231.A O no hydrogen 3.239 N/A ARG 241.A NH1 ASP 169.A OD2 no hydrogen 3.318 N/A THR 243.A N ILE 217.A O no hydrogen 2.863 N/A THR 243.A OG1 LEU 179.A O no hydrogen 2.609 N/A ARG 244.A N PRO 180.A O no hydrogen 2.886 N/A ARG 244.A NE GLU 214.A OE2 no hydrogen 2.988 N/A ARG 244.A NH1 GLU 181.A OE1 no hydrogen 3.181 N/A ARG 244.A NH2 GLU 214.A OE2 no hydrogen 2.952 N/A ILE 245.A N CYS 215.A O no hydrogen 2.768 N/A THR 246.A N VAL 182.A O no hydrogen 3.092 N/A THR 246.A OG1 THR 247.A O no hydrogen 3.376 N/A