Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3c9q_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N GLY 82.A O no hydrogen 3.413 N/A ALA 1.A N GLN 84.A OE1 no hydrogen 3.381 N/A TYR 4.A OH HIS 78.A ND1 no hydrogen 2.584 N/A TYR 4.A OH TYR 88.A OH no hydrogen 2.574 N/A ALA 7.A N TYR 88.A OH no hydrogen 2.755 N/A SER 8.A OG PRO 9.A O no hydrogen 2.865 N/A ARG 11.A NH1 LEU 90.A O no hydrogen 3.001 N/A ARG 11.A NH1 THR 92.A O no hydrogen 2.845 N/A ARG 11.A NH2 THR 92.A O no hydrogen 3.096 N/A ARG 11.A NH2 LEU 94.A O no hydrogen 2.778 N/A ALA 13.A N PRO 10.A O no hydrogen 2.970 N/A CYS 14.A N ARG 11.A O no hydrogen 3.163 N/A CYS 14.A SG PRO 9.A O no hydrogen 3.483 N/A CYS 14.A SG PRO 10.A O no hydrogen 3.548 N/A TYR 16.A OH ASP 91.A OD1 no hydrogen 2.486 N/A SER 17.A N ASN 24.A OD1 no hydrogen 2.976 N/A CYS 19.A SG SER 18.A OG no hydrogen 3.717 N/A TYR 20.A N SER 17.A O no hydrogen 3.105 N/A TYR 20.A OH GLU 149.A O no hydrogen 2.777 N/A CYS 21.A SG GLU 22.A OE1 no hydrogen 3.848 N/A CYS 21.A SG HIS 73.A ND1 no hydrogen 3.804 N/A GLU 22.A N GLU 22.A OE1 no hydrogen 2.767 N/A GLU 23.A N TYR 20.A O no hydrogen 2.835 N/A ASN 24.A N TYR 20.A O no hydrogen 2.937 N/A ASN 24.A ND2 SER 17.A O no hydrogen 3.084 N/A VAL 25.A N CYS 21.A O no hydrogen 2.899 N/A TRP 26.A N GLU 22.A O no hydrogen 3.086 N/A LYS 27.A N GLU 23.A O no hydrogen 2.851 N/A LYS 27.A NZ GLU 30.A OE1 no hydrogen 3.094 N/A LEU 28.A N ASN 24.A O no hydrogen 3.100 N/A CYS 29.A N VAL 25.A O no hydrogen 2.916 N/A CYS 29.A SG VAL 25.A O no hydrogen 3.482 N/A GLU 30.A N TRP 26.A O no hydrogen 2.876 N/A TYR 31.A N LYS 27.A O no hydrogen 2.981 N/A ILE 32.A N LEU 28.A O no hydrogen 3.019 N/A LYS 33.A N CYS 29.A O no hydrogen 2.884 N/A ASN 34.A N GLU 30.A O no hydrogen 2.894 N/A HIS 35.A N ILE 32.A O no hydrogen 3.190 N/A HIS 35.A ND1 TYR 31.A O no hydrogen 2.815 N/A GLN 37.A NE2 PRO 6.A O no hydrogen 2.897 N/A TYR 38.A OH GLN 5.A O no hydrogen 2.623 N/A GLU 42.A N PRO 39.A O no hydrogen 3.105 N/A CYS 43.A N LEU 40.A O no hydrogen 2.922 N/A TYR 44.A N LEU 77.A O.A no hydrogen 2.881 N/A TYR 44.A N LEU 77.A O.B no hydrogen 2.884 N/A ALA 45.A N ILE 125.A O no hydrogen 2.813 N/A VAL 46.A N VAL 75.A O no hydrogen 2.898 N/A PHE 47.A N ARG 123.A O no hydrogen 2.877 N/A ILE 48.A N HIS 73.A O no hydrogen 2.770 N/A SER 49.A N LYS 121.A O no hydrogen 3.139 N/A SER 49.A OG ASN 50.A O no hydrogen 3.458 N/A SER 49.A OG ASP 71.A O no hydrogen 2.770 N/A ASN 50.A ND2 ARG 119.A O no hydrogen 2.898 N/A LYS 53.A N ASN 50.A O no hydrogen 3.016 N/A ILE 56.A N.A VAL 68.A O no hydrogen 2.957 N/A ILE 56.A N.B VAL 68.A O no hydrogen 2.923 N/A TRP 57.A N ALA 107.A O no hydrogen 2.800 N/A GLN 59.A NE2 ASP 89.A OD2 no hydrogen 3.044 N/A GLN 60.A N ASP 91.A O no hydrogen 2.872 N/A GLN 60.A NE2 THR 92.A O no hydrogen 3.004 N/A ARG 62.A N GLN 59.A O no hydrogen 3.048 N/A ARG 62.A NE ASP 65.A O no hydrogen 2.946 N/A ARG 62.A NE ASP 65.A OD2 no hydrogen 3.303 N/A ARG 62.A NH1 ASP 65.A OD2 no hydrogen 2.804 N/A VAL 68.A N ILE 56.A O.A no hydrogen 3.061 N/A VAL 68.A N ILE 56.A O.B no hydrogen 2.887 N/A TRP 70.A N ILE 54.A O no hydrogen 2.924 N/A TRP 70.A NE1 GLN 59.A OE1 no hydrogen 3.004 N/A TYR 72.A N ASP 71.A OD1 no hydrogen 2.955 N/A TYR 72.A OH GLU 22.A OE1 no hydrogen 2.591 N/A HIS 73.A N ILE 48.A O no hydrogen 2.987 N/A HIS 73.A NE2 ASP 89.A OD1 no hydrogen 2.899 N/A HIS 73.A NE2 ASP 89.A OD2 no hydrogen 3.194 N/A VAL 75.A N VAL 46.A O no hydrogen 2.974 N/A LEU 76.A N TYR 88.A O no hydrogen 3.059 N/A LEU 77.A N.A TYR 44.A O no hydrogen 2.856 N/A LEU 77.A N.B TYR 44.A O no hydrogen 2.889 N/A HIS 78.A N PHE 86.A O no hydrogen 2.891 N/A HIS 78.A ND1 TYR 4.A OH no hydrogen 2.584 N/A HIS 78.A NE2 GLU 42.A OE1 no hydrogen 2.834 N/A VAL 79.A N GLU 42.A O no hydrogen 2.851 N/A SER 80.A N GLN 84.A O no hydrogen 2.951 N/A SER 80.A OG GLN 84.A O no hydrogen 3.015 N/A GLY 82.A N SER 80.A OG no hydrogen 3.219 N/A PHE 86.A N HIS 78.A O no hydrogen 2.875 N/A ILE 87.A N CYS 98.A O no hydrogen 2.764 N/A TYR 88.A N LEU 76.A O no hydrogen 2.804 N/A TYR 88.A OH TYR 4.A OH no hydrogen 2.574 N/A ASP 91.A N ASP 89.A OD1 no hydrogen 2.946 N/A THR 92.A N ASP 89.A O no hydrogen 3.035 N/A THR 92.A OG1 LYS 58.A O no hydrogen 2.980 N/A VAL 93.A N LYS 58.A O no hydrogen 2.816 N/A LEU 94.A N THR 92.A OG1 no hydrogen 3.037 N/A CYS 98.A N ILE 87.A O no hydrogen 2.853 N/A CYS 98.A SG LEU 99.A O no hydrogen 3.473 N/A PHE 100.A N SER 85.A O no hydrogen 2.878 N/A TYR 103.A N LEU 99.A O no hydrogen 2.992 N/A TYR 103.A OH ASP 89.A OD2 no hydrogen 2.579 N/A VAL 104.A N PHE 100.A O no hydrogen 2.943 N/A GLU 105.A N ASP 101.A O no hydrogen 2.903 N/A ASP 106.A N THR 102.A O no hydrogen 2.884 N/A ALA 107.A N TYR 103.A O no hydrogen 2.798 N/A ILE 108.A N TYR 103.A O no hydrogen 3.110 N/A LYS 109.A N VAL 104.A O no hydrogen 2.776 N/A ASP 112.A N SER 110.A OG no hydrogen 2.952 N/A ILE 114.A N ASP 111.A O no hydrogen 3.119 N/A HIS 115.A NE2 GLN 117.A OE1 no hydrogen 2.863 N/A PHE 118.A N HIS 115.A O no hydrogen 2.875 N/A ARG 119.A N PRO 116.A O no hydrogen 3.125 N/A ARG 119.A NE ASP 111.A O no hydrogen 2.994 N/A ARG 119.A NE ILE 114.A O no hydrogen 3.191 N/A ARG 119.A NH2 ASP 111.A O no hydrogen 3.394 N/A ARG 120.A N ASP 111.A OD2 no hydrogen 2.949 N/A ARG 120.A NE ASP 111.A OD1 no hydrogen 2.854 N/A ARG 120.A NH1 ILE 108.A O no hydrogen 2.841 N/A ARG 120.A NH1 LYS 109.A O no hydrogen 3.042 N/A ARG 120.A NH1 ASP 111.A OD1 no hydrogen 2.799 N/A ARG 120.A NH2 PRO 55.A O no hydrogen 2.805 N/A ARG 120.A NH2 ILE 108.A O no hydrogen 2.740 N/A LYS 121.A N SER 49.A O no hydrogen 2.904 N/A PHE 122.A N TYR 180.A O no hydrogen 2.933 N/A ARG 123.A N PHE 47.A O no hydrogen 2.770 N/A ARG 123.A NE PHE 168.A O no hydrogen 3.228 N/A ARG 123.A NE SER 170.A O no hydrogen 2.955 N/A ARG 123.A NH1 VAL 174.A O no hydrogen 2.834 N/A ARG 123.A NH1 TRP 176.A O no hydrogen 2.857 N/A ARG 123.A NH2 SER 170.A O no hydrogen 2.858 N/A ARG 123.A NH2 ASP 171.A O no hydrogen 3.065 N/A ARG 123.A NH2 VAL 174.A O no hydrogen 3.019 N/A VAL 124.A N ALA 178.A O no hydrogen 2.810 N/A ILE 125.A N ALA 45.A O no hydrogen 2.837 N/A ALA 127.A N CYS 43.A O no hydrogen 2.893 N/A SER 129.A OG ASN 133.A OD1 no hydrogen 3.048 N/A TYR 130.A N CYS 126.A O no hydrogen 2.873 N/A TYR 130.A OH GLU 22.A O no hydrogen 2.725 N/A LEU 131.A N ALA 127.A O no hydrogen 2.989 N/A LYS 132.A N ASP 128.A O no hydrogen 2.971 N/A ASN 133.A N SER 129.A O no hydrogen 2.868 N/A PHE 134.A N TYR 130.A O no hydrogen 2.902 N/A ALA 135.A N ASN 164.A OD1 no hydrogen 2.930 N/A SER 136.A N ILE 157.A O no hydrogen 2.948 N/A ARG 138.A N SER 136.A OG no hydrogen 3.071 N/A ARG 138.A NE GLU 23.A OE2 no hydrogen 2.846 N/A ARG 138.A NH1 TYR 154.A O no hydrogen 2.988 N/A ARG 138.A NH2 GLU 23.A OE1 no hydrogen 2.881 N/A ARG 138.A NH2 TYR 154.A O no hydrogen 3.025 N/A SER 139.A N ASP 137.A OD1 no hydrogen 3.012 N/A SER 139.A OG ASP 137.A OD1 no hydrogen 2.671 N/A ASP 142.A N ASN 146.A O no hydrogen 2.787 N/A SER 144.A N ASP 142.A OD1 no hydrogen 2.837 N/A ASN 146.A N ASP 142.A OD1 no hydrogen 2.777 N/A ARG 148.A NE HIS 140.A O no hydrogen 2.892 N/A ARG 148.A NH2 HIS 140.A O no hydrogen 3.291 N/A TYR 154.A OH GLU 23.A OE1 no hydrogen 2.704 N/A THR 159.A N SER 162.A O no hydrogen 2.999 N/A THR 159.A OG1 SER 162.A O no hydrogen 3.380 N/A ASP 161.A N THR 159.A OG1 no hydrogen 3.141 N/A SER 162.A N THR 159.A OG1 no hydrogen 3.029 N/A LYS 163.A NZ GLU 158.A OE1 no hydrogen 3.311 N/A ASN 164.A ND2 ASN 133.A O no hydrogen 2.914 N/A ASP 167.A N ASN 164.A O no hydrogen 2.862 N/A PHE 168.A N LEU 165.A O no hydrogen 2.901 N/A ILE 169.A N LEU 165.A O no hydrogen 2.990 N/A SER 170.A N ASN 166.A O no hydrogen 2.935 N/A LYS 173.A N ASP 171.A OD1 no hydrogen 2.921 N/A VAL 174.A N ASP 171.A O no hydrogen 3.017 N/A ALA 178.A N VAL 124.A O no hydrogen 2.987 N/A TYR 180.A N PHE 122.A O no hydrogen 2.800 N/A THR 181.A N GLU 184.A OE1 no hydrogen 2.983 N/A GLU 184.A N THR 181.A OG1 no hydrogen 3.151 N/A PHE 185.A N THR 181.A O no hydrogen 2.805 N/A THR 186.A N LEU 182.A O no hydrogen 2.946 N/A THR 186.A OG1.A LEU 182.A O no hydrogen 3.241 N/A THR 186.A OG1.A SER 183.A O no hydrogen 3.104 N/A THR 186.A OG1.B LEU 182.A O no hydrogen 2.999 N/A HIS 187.A N SER 183.A O no hydrogen 2.907 N/A ARG 188.A N GLU 184.A O no hydrogen 2.971 N/A PHE 189.A N PHE 185.A O no hydrogen 3.090 N/A GLY 190.A N THR 186.A O no hydrogen 2.737 N/A SER 191.A N ASP 101.A OD1 no hydrogen 2.993 N/A SER 191.A OG GLY 83.A O no hydrogen 3.206 N/A