Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3q80_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N ASP 47.A OD2 no hydrogen 2.801 N/A VAL 4.A N PHE 94.A O no hydrogen 3.157 N/A ALA 5.A N THR 48.A O no hydrogen 2.810 N/A ILE 6.A N LEU 96.A O no hydrogen 2.716 N/A VAL 7.A N VAL 50.A O no hydrogen 2.758 N/A ALA 9.A N ALA 52.A O no hydrogen 2.773 N/A GLU 14.A N SER 12.A OG no hydrogen 3.117 N/A ALA 17.A N GLY 13.A O no hydrogen 3.199 N/A LYS 22.A NZ ILE 203.A O no hydrogen 2.818 N/A PHE 24.A N PRO 21.A O no hydrogen 2.870 N/A TYR 25.A N LYS 22.A O no hydrogen 2.936 N/A GLN 26.A NE2 GLY 29.A O no hydrogen 3.633 N/A LEU 27.A N GLN 30.A O no hydrogen 2.856 N/A GLN 30.A N LEU 27.A O no hydrogen 3.127 N/A LEU 32.A N TYR 25.A O no hydrogen 3.039 N/A ILE 33.A N ALA 23.A O no hydrogen 2.993 N/A GLU 34.A N THR 31.A OG1 no hydrogen 3.145 N/A ARG 35.A N THR 31.A O no hydrogen 2.930 N/A ARG 35.A NE LEU 27.A O no hydrogen 3.053 N/A ARG 35.A NH2 LEU 27.A O no hydrogen 2.904 N/A ARG 35.A NH2 ASP 28.A O no hydrogen 3.456 N/A ALA 36.A N LEU 32.A O no hydrogen 2.770 N/A VAL 37.A N ILE 33.A O no hydrogen 3.022 N/A ASP 38.A N GLU 34.A O no hydrogen 2.962 N/A GLY 39.A N ARG 35.A O no hydrogen 3.004 N/A LEU 40.A N ALA 36.A O no hydrogen 3.135 N/A LEU 41.A N VAL 37.A O no hydrogen 3.068 N/A ASP 42.A N ASP 38.A O no hydrogen 2.848 N/A SER 43.A N LEU 40.A O no hydrogen 3.222 N/A SER 43.A OG LEU 40.A O no hydrogen 2.650 N/A GLY 44.A N LEU 41.A O no hydrogen 3.286 N/A VAL 45.A N SER 43.A OG no hydrogen 3.051 N/A ASP 47.A N VAL 3.A O no hydrogen 2.851 N/A THR 48.A N VAL 3.A O no hydrogen 3.316 N/A VAL 50.A N ALA 5.A O no hydrogen 2.802 N/A VAL 51.A N MET 70.A O no hydrogen 2.846 N/A ALA 52.A N VAL 7.A O no hydrogen 2.995 N/A VAL 53.A N VAL 72.A O no hydrogen 2.936 N/A ARG 57.A N PRO 54.A O no hydrogen 2.890 N/A ARG 57.A NH1 GLU 60.A OE1 no hydrogen 2.837 N/A THR 58.A OG1 ALA 55.A O no hydrogen 3.486 N/A ALA 61.A N ARG 57.A O no hydrogen 2.904 N/A ARG 62.A N THR 58.A O no hydrogen 3.119 N/A GLN 63.A N ASP 59.A O no hydrogen 3.006 N/A ILE 64.A N GLU 60.A O no hydrogen 2.921 N/A LEU 65.A N ALA 61.A O no hydrogen 2.829 N/A GLY 66.A N ARG 62.A O no hydrogen 2.777 N/A ARG 68.A N LEU 65.A O no hydrogen 3.272 N/A ARG 68.A NE LEU 65.A O no hydrogen 2.954 N/A ARG 68.A NH1 GLU 34.A OE2 no hydrogen 2.939 N/A ARG 68.A NH1 ASP 38.A OD1 no hydrogen 2.909 N/A ARG 68.A NH2 GLU 34.A OE2 no hydrogen 2.885 N/A ARG 68.A NH2 ILE 64.A O no hydrogen 2.909 N/A MET 70.A N VAL 49.A O no hydrogen 2.912 N/A VAL 72.A N VAL 51.A O no hydrogen 2.914 N/A GLY 74.A N VAL 53.A O no hydrogen 2.744 N/A GLY 75.A N THR 81.A OG1 no hydrogen 2.817 N/A SER 76.A N ASP 80.A OD2 no hydrogen 3.255 N/A SER 76.A OG.B ASP 80.A OD2 no hydrogen 3.312 N/A ARG 78.A NE ASP 99.A OD1 no hydrogen 2.866 N/A ARG 78.A NH1 ASP 180.A OD1 no hydrogen 3.552 N/A ARG 78.A NH1 ASP 180.A OD2 no hydrogen 2.869 N/A ARG 78.A NH2 ASP 99.A OD1 no hydrogen 2.907 N/A ARG 78.A NH2 ASP 180.A OD2 no hydrogen 3.325 N/A THR 79.A OG1 TYR 177.A O no hydrogen 3.244 N/A ASP 80.A N ASN 77.A OD1 no hydrogen 2.705 N/A THR 81.A N ASN 77.A O no hydrogen 2.857 N/A THR 81.A OG1 ASN 77.A O no hydrogen 3.174 N/A VAL 82.A N ARG 78.A O no hydrogen 2.979 N/A ASN 83.A N THR 79.A O no hydrogen 2.923 N/A LEU 84.A N ASP 80.A O no hydrogen 2.961 N/A ALA 85.A N THR 81.A O no hydrogen 3.061 N/A LEU 86.A N VAL 82.A O no hydrogen 2.929 N/A THR 87.A N LEU 84.A O no hydrogen 3.363 N/A THR 87.A OG1 LEU 84.A O no hydrogen 2.777 N/A VAL 88.A N ALA 85.A O no hydrogen 3.107 N/A LEU 89.A N LEU 86.A O no hydrogen 2.935 N/A SER 90.A N THR 87.A O no hydrogen 3.064 N/A PHE 94.A N GLU 2.A O no hydrogen 3.130 N/A VAL 95.A N PHE 161.A O no hydrogen 2.886 N/A LEU 96.A N VAL 4.A O no hydrogen 2.830 N/A VAL 97.A N GLN 159.A O no hydrogen 2.799 N/A HIS 98.A N ILE 6.A O no hydrogen 2.778 N/A HIS 98.A ND1 THR 157.A OG1 no hydrogen 2.740 N/A ASP 99.A N THR 157.A OG1 no hydrogen 3.090 N/A ALA 100.A N PRO 8.A O no hydrogen 3.277 N/A ARG 102.A N ASP 99.A O no hydrogen 3.130 N/A ARG 102.A NE ASP 99.A OD2 no hydrogen 3.259 N/A ARG 102.A NH1 ALA 200.A O no hydrogen 2.857 N/A THR 105.A N ARG 102.A O no hydrogen 3.259 N/A THR 105.A OG1 ARG 102.A O no hydrogen 2.729 N/A LEU 109.A N PRO 106.A O no hydrogen 2.965 N/A ALA 111.A N PRO 107.A O no hydrogen 3.072 N/A ARG 112.A N ALA 108.A O no hydrogen 2.863 N/A ARG 112.A NH1 ASP 195.A O no hydrogen 2.800 N/A VAL 113.A N LEU 109.A O no hydrogen 3.010 N/A VAL 114.A N VAL 110.A O no hydrogen 3.111 N/A GLU 115.A N ALA 111.A O no hydrogen 2.829 N/A ALA 116.A N ARG 112.A O no hydrogen 3.260 N/A LEU 117.A N VAL 113.A O no hydrogen 3.125 N/A ARG 118.A N VAL 114.A O no hydrogen 2.929 N/A ARG 118.A NH2 GLY 1.A O no hydrogen 3.105 N/A ASP 119.A N GLU 115.A O no hydrogen 2.893 N/A ASP 119.A N ALA 116.A O no hydrogen 3.074 N/A GLY 120.A N LEU 117.A O no hydrogen 3.096 N/A TYR 121.A N ALA 116.A O no hydrogen 3.236 N/A VAL 124.A N GLY 160.A O no hydrogen 2.862 N/A VAL 125.A N GLN 192.A O no hydrogen 3.009 N/A VAL 127.A N VAL 194.A O no hydrogen 2.853 N/A LEU 128.A N ALA 154.A O no hydrogen 2.888 N/A LYS 135.A NZ THR 146.A OG1 no hydrogen 2.757 N/A ALA 136.A N GLY 145.A O no hydrogen 2.922 N/A ASP 138.A N VAL 142.A O no hydrogen 2.934 N/A ASN 140.A N ASP 138.A OD1 no hydrogen 2.824 N/A GLY 141.A N ASP 138.A O no hydrogen 3.062 N/A VAL 142.A N ASP 138.A OD1 no hydrogen 3.033 N/A LEU 144.A N ALA 136.A O no hydrogen 2.729 N/A GLY 151.A N GLU 148.A O no hydrogen 3.090 N/A LEU 152.A N ARG 149.A O no hydrogen 2.989 N/A ARG 153.A NH1 ALA 150.A O no hydrogen 2.687 N/A ARG 153.A NH1 LEU 152.A O no hydrogen 2.849 N/A ALA 154.A N LEU 128.A O no hydrogen 2.884 N/A GLN 156.A N PRO 126.A O no hydrogen 2.928 N/A GLN 156.A NE2 ASP 197.A O no hydrogen 2.884 N/A THR 157.A OG1 HIS 98.A ND1 no hydrogen 2.740 N/A GLN 159.A N VAL 97.A O no hydrogen 2.955 N/A GLN 159.A NE2 GLN 156.A O no hydrogen 3.494 N/A GLN 159.A NE2 ASP 179.A OD2 no hydrogen 2.853 N/A GLY 160.A N VAL 124.A O no hydrogen 2.826 N/A PHE 161.A N VAL 95.A O no hydrogen 2.925 N/A THR 162.A N ALA 122.A O no hydrogen 3.036 N/A THR 163.A N GLU 93.A O no hydrogen 2.971 N/A THR 163.A OG1 PRO 92.A O no hydrogen 2.711 N/A LEU 166.A N THR 162.A O no hydrogen 3.198 N/A LEU 167.A N THR 163.A O no hydrogen 2.947 N/A ARG 168.A N ASP 164.A O no hydrogen 2.980 N/A ARG 168.A NH2 ASP 164.A OD1 no hydrogen 3.400 N/A SER 169.A N LEU 165.A O no hydrogen 3.003 N/A SER 169.A OG LEU 165.A O no hydrogen 2.785 N/A TYR 170.A N LEU 166.A O no hydrogen 2.920 N/A TYR 170.A OH ASP 180.A OD1 no hydrogen 2.508 N/A GLN 171.A N LEU 167.A O no hydrogen 2.876 N/A ARG 172.A N ARG 168.A O no hydrogen 3.022 N/A GLY 173.A N SER 169.A O no hydrogen 2.849 N/A SER 174.A N TYR 170.A O no hydrogen 2.922 N/A SER 174.A OG TYR 170.A O no hydrogen 2.899 N/A LEU 175.A N ARG 172.A O no hydrogen 3.239 N/A ASP 180.A N GLN 159.A OE1 no hydrogen 3.276 N/A ALA 181.A N GLN 159.A OE1 no hydrogen 2.881 N/A SER 182.A N ASP 179.A OD1 no hydrogen 2.969 N/A SER 182.A OG ASP 179.A OD1 no hydrogen 2.543 N/A LEU 183.A N ASP 180.A O no hydrogen 3.010 N/A GLU 185.A N ALA 181.A O no hydrogen 2.817 N/A HIS 186.A N SER 182.A O no hydrogen 2.968 N/A ILE 187.A N LEU 183.A O no hydrogen 3.359 N/A GLY 188.A N GLU 185.A O no hydrogen 2.943 N/A GLY 189.A N VAL 184.A O no hydrogen 2.818 N/A GLN 192.A N ALA 123.A O no hydrogen 2.857 N/A VAL 194.A N VAL 125.A O no hydrogen 2.891 N/A GLY 196.A N VAL 127.A O no hydrogen 2.689 N/A ASP 197.A N GLN 156.A OE1 no hydrogen 2.837 N/A LEU 199.A N ASP 197.A OD1 no hydrogen 2.868 N/A ALA 200.A N ASP 197.A O no hydrogen 2.787 N/A PHE 201.A N PRO 198.A O no hydrogen 3.259 N/A LYS 202.A NZ THR 204.A OG1 no hydrogen 2.876 N/A ILE 203.A N ALA 101.A O no hydrogen 2.912 N/A THR 204.A N ASP 208.A OD2 no hydrogen 2.771 N/A THR 204.A OG1 LYS 202.A O no hydrogen 2.869 N/A THR 205.A N ASP 208.A OD2 no hydrogen 2.983 N/A ASP 208.A N THR 205.A OG1 no hydrogen 3.381 N/A LEU 209.A N THR 205.A O no hydrogen 3.325 N/A LEU 210.A N LYS 206.A O no hydrogen 3.176 N/A LEU 211.A N LEU 207.A O no hydrogen 3.152 N/A ALA 212.A N ASP 208.A O no hydrogen 2.899 N/A GLN 213.A N LEU 209.A O no hydrogen 2.929 N/A ALA 214.A N LEU 210.A O no hydrogen 3.136 N/A ILE 215.A N LEU 211.A O no hydrogen 2.963 N/A VAL 216.A N ALA 212.A O no hydrogen 2.981 N/A ARG 217.A N GLN 213.A O no hydrogen 2.943 N/A GLY 218.A N ILE 215.A O no hydrogen 3.180 N/A