Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8qux_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PRO 1.A N GLN 10.A O no hydrogen 2.711 N/A PRO 1.A N ASP 48.A OD2 no hydrogen 2.762 N/A ILE 2.A N GLY 43.A O no hydrogen 2.687 N/A VAL 3.A N VAL 8.A O no hydrogen 2.888 N/A ASN 5.A N GLN 6.A O no hydrogen 2.589 N/A VAL 8.A N VAL 3.A O no hydrogen 2.793 N/A GLN 10.A N PRO 1.A O no hydrogen 2.741 N/A SER 13.A OG THR 16.A OG1 no hydrogen 2.813 N/A THR 16.A N SER 13.A OG no hydrogen 3.008 N/A THR 16.A OG1 SER 13.A OG no hydrogen 2.813 N/A LEU 17.A N SER 13.A O no hydrogen 2.961 N/A ASN 18.A N PRO 14.A O no hydrogen 2.982 N/A ALA 19.A N ARG 15.A O no hydrogen 2.980 N/A TRP 20.A N THR 16.A O no hydrogen 3.173 N/A VAL 21.A N LEU 17.A O no hydrogen 3.225 N/A LYS 22.A N ASN 18.A O no hydrogen 2.941 N/A VAL 23.A N ALA 19.A O no hydrogen 2.903 N/A VAL 24.A N TRP 20.A O no hydrogen 3.188 N/A GLU 25.A N VAL 21.A O no hydrogen 3.095 N/A GLU 26.A N LYS 22.A O no hydrogen 2.854 N/A LYS 27.A N VAL 23.A O no hydrogen 2.728 N/A LYS 27.A NZ GLU 32.A OE2 no hydrogen 2.742 N/A ALA 28.A N VAL 24.A O no hydrogen 2.837 N/A SER 30.A N LYS 27.A O no hydrogen 3.079 N/A SER 30.A OG GLU 32.A OE1 no hydrogen 2.496 N/A SER 30.A OG GLU 32.A OE2 no hydrogen 3.341 N/A GLU 32.A N GLU 32.A OE1 no hydrogen 2.655 N/A VAL 33.A N SER 30.A O no hydrogen 2.950 N/A ILE 34.A N PRO 31.A O no hydrogen 3.071 N/A MET 36.A N GLU 32.A O no hydrogen 3.460 N/A PHE 37.A N VAL 33.A O no hydrogen 2.799 N/A SER 38.A N ILE 34.A O no hydrogen 2.930 N/A ALA 39.A N PRO 35.A O no hydrogen 3.054 N/A LEU 40.A N MET 36.A O no hydrogen 2.887 N/A SER 41.A N PHE 37.A O no hydrogen 3.035 N/A SER 41.A OG PHE 37.A O no hydrogen 2.665 N/A SER 41.A OG SER 38.A O no hydrogen 3.025 N/A CYS 42.A N ALA 39.A O no hydrogen 3.172 N/A ALA 44.A N SER 41.A O no hydrogen 3.019 N/A THR 45.A N ASP 48.A OD2 no hydrogen 3.314 N/A GLN 47.A N GLN 111.A OE1 no hydrogen 3.040 N/A ASP 48.A N THR 45.A OG1 no hydrogen 2.897 N/A LEU 49.A N THR 45.A O no hydrogen 2.961 N/A ASN 50.A N PRO 46.A O no hydrogen 2.915 N/A ASN 50.A ND2 ALA 102.A O no hydrogen 2.856 N/A THR 51.A N GLN 47.A O no hydrogen 2.804 N/A THR 51.A OG1 GLN 47.A O no hydrogen 3.072 N/A MET 52.A N ASP 48.A O no hydrogen 2.948 N/A LEU 53.A N LEU 49.A O no hydrogen 3.074 N/A ASN 54.A N ASN 50.A O no hydrogen 2.669 N/A THR 55.A N THR 51.A O no hydrogen 3.027 N/A THR 55.A OG1 THR 51.A O no hydrogen 3.133 N/A THR 55.A OG1 MET 52.A O no hydrogen 2.661 N/A VAL 56.A N LEU 53.A O no hydrogen 3.301 N/A GLN 60.A NE2 GLY 58.A O no hydrogen 2.969 N/A MET 63.A N HIS 59.A O no hydrogen 2.957 N/A GLN 64.A N GLN 60.A O no hydrogen 2.992 N/A MET 65.A N ALA 61.A O no hydrogen 2.874 N/A LEU 66.A N ALA 62.A O no hydrogen 2.762 N/A LYS 67.A N MET 63.A O no hydrogen 3.062 N/A LYS 67.A NZ GLN 64.A OE1 no hydrogen 3.442 N/A GLU 68.A N GLN 64.A O no hydrogen 3.209 N/A THR 69.A N MET 65.A O no hydrogen 3.040 N/A THR 69.A OG1 MET 65.A O no hydrogen 3.459 N/A ILE 70.A N LEU 66.A O no hydrogen 2.934 N/A ASN 71.A N LYS 67.A O no hydrogen 2.898 N/A GLU 72.A N GLU 68.A O no hydrogen 3.126 N/A GLU 73.A N THR 69.A O no hydrogen 3.091 N/A ALA 74.A N ILE 70.A O no hydrogen 2.745 N/A ALA 75.A N ASN 71.A O no hydrogen 2.815 N/A GLU 76.A N GLU 72.A O no hydrogen 3.033 N/A TRP 77.A N GLU 73.A O no hydrogen 2.816 N/A TRP 77.A NE1 PRO 96.A O no hydrogen 3.226 N/A ASP 78.A N ALA 74.A O no hydrogen 2.862 N/A ARG 79.A N ALA 75.A O no hydrogen 2.823 N/A ARG 79.A NE GLU 76.A OE1 no hydrogen 2.894 N/A ARG 79.A NH2 GLU 76.A OE1 no hydrogen 3.208 N/A ARG 79.A NH2 GLU 76.A OE2 no hydrogen 2.776 N/A LEU 80.A N GLU 76.A O no hydrogen 2.988 N/A HIS 81.A N TRP 77.A O no hydrogen 2.731 N/A GLN 92.A N ALA 89.A O no hydrogen 2.915 N/A GLN 92.A NE2 PRO 90.A O no hydrogen 3.418 N/A ARG 94.A NE GLU 110.A OE2 no hydrogen 2.865 N/A ARG 94.A NH1 ASP 100.A OD1 no hydrogen 3.426 N/A ARG 94.A NH1 ASP 100.A OD2 no hydrogen 2.655 N/A ARG 94.A NH2 ASP 100.A OD1 no hydrogen 2.756 N/A ARG 94.A NH2 GLU 110.A OE1 no hydrogen 3.066 N/A ARG 94.A NH2 GLU 110.A OE2 no hydrogen 3.484 N/A ARG 97.A N ASP 100.A OD2 no hydrogen 2.912 N/A GLY 98.A N ASP 78.A OD1 no hydrogen 2.846 N/A SER 99.A OG THR 105.A OG1 no hydrogen 2.507 N/A ASP 100.A N ARG 97.A O no hydrogen 2.885 N/A ILE 101.A N ARG 97.A O no hydrogen 2.940 N/A ALA 102.A N GLY 98.A O no hydrogen 2.960 N/A GLY 103.A N ASP 100.A O no hydrogen 3.206 N/A THR 104.A N SER 99.A O no hydrogen 2.909 N/A THR 104.A OG1 SER 99.A O no hydrogen 2.868 N/A THR 105.A N SER 99.A O no hydrogen 3.149 N/A THR 105.A OG1 SER 99.A OG no hydrogen 2.507 N/A THR 105.A OG1 ASP 100.A OD1 no hydrogen 2.606 N/A SER 106.A OG ASP 100.A O no hydrogen 2.685 N/A THR 107.A N GLU 110.A OE1 no hydrogen 2.908 N/A GLN 109.A NE2 GLN 109.A O no hydrogen 2.852 N/A GLU 110.A N THR 107.A OG1 no hydrogen 3.105 N/A GLN 111.A N THR 107.A O no hydrogen 3.029 N/A GLN 111.A NE2 SER 106.A O no hydrogen 3.545 N/A GLN 111.A NE2 SER 106.A OG no hydrogen 2.741 N/A ILE 112.A N LEU 108.A O no hydrogen 2.755 N/A GLY 113.A N GLN 109.A O no hydrogen 2.899 N/A TRP 114.A N GLU 110.A O no hydrogen 2.963 N/A TRP 114.A NE1 ARG 94.A O no hydrogen 2.917 N/A MET 115.A N GLN 111.A O no hydrogen 3.101 N/A THR 116.A N ILE 112.A O no hydrogen 2.922 N/A THR 116.A OG1 ILE 112.A O no hydrogen 2.717 N/A HIS 117.A N TRP 114.A O no hydrogen 3.358 N/A ILE 121.A N TRP 114.A O no hydrogen 2.721 N/A VAL 123.A N ILE 121.A O no hydrogen 2.831 N/A ILE 126.A N PRO 122.A O no hydrogen 2.945 N/A TYR 127.A N VAL 123.A O no hydrogen 2.959 N/A TYR 127.A OH ASN 50.A OD1 no hydrogen 2.595 N/A LYS 128.A N GLY 124.A O no hydrogen 2.994 N/A LYS 128.A NZ SER 38.A O no hydrogen 3.158 N/A LYS 128.A NZ SER 41.A O no hydrogen 3.047 N/A ARG 129.A N GLU 125.A O no hydrogen 3.094 N/A TRP 130.A N ILE 126.A O no hydrogen 3.266 N/A ILE 131.A N TYR 127.A O no hydrogen 2.961 N/A ILE 132.A N LYS 128.A O no hydrogen 2.877 N/A LEU 133.A N ARG 129.A O no hydrogen 2.960 N/A GLY 134.A N TRP 130.A O no hydrogen 3.014 N/A LEU 135.A N ILE 131.A O no hydrogen 2.778 N/A ASN 136.A N ILE 132.A O no hydrogen 2.892 N/A LYS 137.A N LEU 133.A O no hydrogen 3.394 N/A LYS 137.A NZ THR 69.A OG1 no hydrogen 3.146 N/A LYS 137.A NZ GLU 72.A OE1 no hydrogen 3.317 N/A ILE 138.A N GLY 134.A O no hydrogen 3.381 N/A VAL 139.A N LEU 135.A O no hydrogen 2.894 N/A ARG 140.A N ASN 136.A O no hydrogen 3.069 N/A MET 141.A N LYS 137.A O no hydrogen 2.879 N/A TYR 142.A N ILE 138.A O no hydrogen 2.748 N/A TYR 142.A N VAL 139.A O no hydrogen 3.203 N/A SER 143.A N VAL 139.A O no hydrogen 2.788 N/A SER 143.A OG GLU 172.A OE2 no hydrogen 2.791 N/A LEU 148.A N SER 146.A OG no hydrogen 3.002 N/A ASP 149.A N SER 146.A O no hydrogen 3.174 N/A ILE 150.A N ILE 147.A O no hydrogen 3.009 N/A GLN 152.A N ASN 190.A O no hydrogen 2.857 N/A GLN 152.A NE2 GLU 156.A O no hydrogen 2.796 N/A GLY 153.A N GLU 156.A OE1 no hydrogen 3.008 N/A GLU 156.A N GLY 153.A O no hydrogen 3.059 N/A TYR 161.A N PRO 157.A O no hydrogen 3.120 N/A TYR 161.A OH LEU 187.A O no hydrogen 2.344 N/A VAL 162.A N PHE 158.A O no hydrogen 2.860 N/A ASP 163.A N ARG 159.A O no hydrogen 3.002 N/A ARG 164.A N ASP 160.A O no hydrogen 3.040 N/A ARG 164.A NE GLU 156.A OE2 no hydrogen 2.752 N/A ARG 164.A NH2 ARG 151.A O no hydrogen 2.881 N/A ARG 164.A NH2 GLU 156.A OE1 no hydrogen 2.781 N/A ARG 164.A NH2 GLU 156.A OE2 no hydrogen 3.217 N/A PHE 165.A N TYR 161.A O no hydrogen 2.811 N/A TYR 166.A N VAL 162.A O no hydrogen 2.902 N/A TYR 166.A OH LYS 179.A O no hydrogen 3.120 N/A LYS 167.A N ASP 163.A O no hydrogen 2.977 N/A THR 168.A N ARG 164.A O no hydrogen 2.924 N/A THR 168.A OG1 ARG 164.A O no hydrogen 2.916 N/A LEU 169.A N PHE 165.A O no hydrogen 2.945 N/A ARG 170.A N TYR 166.A O no hydrogen 3.109 N/A ALA 171.A N LYS 167.A O no hydrogen 3.069 N/A GLU 172.A N THR 168.A O no hydrogen 2.950 N/A GLN 173.A N ARG 170.A O no hydrogen 3.028 N/A GLN 173.A NE2 ASN 136.A OD1 no hydrogen 3.403 N/A ALA 174.A N LEU 169.A O no hydrogen 3.198 N/A VAL 178.A N SER 175.A O no hydrogen 3.190 N/A LYS 179.A N SER 175.A O no hydrogen 3.025 N/A ASN 180.A N GLN 176.A O no hydrogen 2.854 N/A ALA 181.A N GLU 177.A O no hydrogen 3.043 N/A ALA 182.A N VAL 178.A O no hydrogen 3.108 N/A GLU 184.A N ALA 181.A O no hydrogen 3.120 N/A THR 185.A N ALA 182.A O no hydrogen 3.121 N/A THR 185.A OG1 ALA 182.A O no hydrogen 3.386 N/A LEU 186.A N THR 185.A OG1 no hydrogen 2.554 N/A LEU 187.A N ALA 182.A O no hydrogen 3.013 N/A GLN 189.A N THR 185.A O no hydrogen 2.802 N/A ASN 190.A N LEU 186.A O no hydrogen 2.854 N/A ASN 190.A ND2 ILE 150.A O no hydrogen 2.849 N/A ALA 191.A N VAL 188.A O no hydrogen 2.998 N/A ASN 192.A N GLN 152.A OE1 no hydrogen 2.858 N/A ASN 192.A ND2 GLY 153.A O no hydrogen 3.025 N/A CYS 195.A N.A ASN 192.A OD1 no hydrogen 3.117 N/A CYS 195.A N.B ASN 192.A OD1 no hydrogen 3.108 N/A CYS 195.A SG.B GLN 152.A OE1 no hydrogen 3.664 N/A LYS 196.A N ASN 192.A O no hydrogen 2.758 N/A LYS 196.A NZ GLN 189.A O no hydrogen 2.754 N/A LYS 196.A NZ GLN 189.A OE1 no hydrogen 2.995 N/A THR 197.A N PRO 193.A O no hydrogen 2.969 N/A THR 197.A OG1 PRO 193.A O no hydrogen 2.858 N/A ILE 198.A N ASP 194.A O no hydrogen 3.189 N/A LEU 199.A N CYS 195.A O.A no hydrogen 2.724 N/A LEU 199.A N CYS 195.A O.B no hydrogen 2.741 N/A LYS 200.A N LYS 196.A O no hydrogen 2.739 N/A ALA 201.A N THR 197.A O no hydrogen 3.123 N/A LEU 202.A N ILE 198.A O no hydrogen 3.215 N/A LEU 202.A N LEU 199.A O no hydrogen 3.088 N/A GLY 203.A N LYS 200.A O no hydrogen 3.259 N/A GLY 205.A N GLU 184.A OE2 no hydrogen 2.731 N/A THR 207.A N GLU 210.A OE1 no hydrogen 2.884 N/A GLU 210.A N THR 207.A OG1 no hydrogen 2.929 N/A MET 211.A N THR 207.A O no hydrogen 3.008 N/A MET 212.A N LEU 208.A O no hydrogen 2.876 N/A THR 213.A N GLU 209.A O no hydrogen 2.941 N/A THR 213.A OG1 GLU 209.A O no hydrogen 2.701 N/A ALA 214.A N GLU 210.A O no hydrogen 2.910 N/A CYS 215.A N.A MET 211.A O no hydrogen 3.009 N/A CYS 215.A N.B MET 211.A O no hydrogen 3.017 N/A CYS 215.A SG.A CYS 195.A O.A no hydrogen 3.598 N/A CYS 215.A SG.A CYS 195.A O.B no hydrogen 3.582 N/A CYS 215.A SG.B CYS 195.A O.A no hydrogen 3.811 N/A CYS 215.A SG.B CYS 195.A O.B no hydrogen 3.797 N/A CYS 215.A SG.B MET 211.A O no hydrogen 3.740 N/A GLN 216.A N THR 213.A O no hydrogen 3.060 N/A