Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4qu8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 9.A N GLU 234.A O no hydrogen 2.859 N/A TYR 9.A OH ASP 154.A OD1 no hydrogen 2.507 N/A LYS 10.A NZ ASP 12.A OD1 no hydrogen 2.847 N/A LYS 10.A NZ ASP 12.A OD2 no hydrogen 3.562 N/A TYR 13.A N SER 84.A OG no hydrogen 3.273 N/A GLU 15.A N LYS 82.A O no hydrogen 3.002 N/A CYS 19.A N GLU 56.A O no hydrogen 2.873 N/A ILE 20.A N VAL 87.A O no hydrogen 2.865 N/A ILE 21.A N ARG 58.A O no hydrogen 2.852 N/A ILE 22.A N VAL 89.A O no hydrogen 2.848 N/A ASN 23.A N LYS 60.A O no hydrogen 2.802 N/A ASN 23.A ND2 ASP 40.A OD1 no hydrogen 2.989 N/A ASN 23.A ND2 ASN 61.A OD1 no hydrogen 3.122 N/A ASN 24.A N LEU 91.A O no hydrogen 2.989 N/A ASN 24.A ND2 LEU 63.A O no hydrogen 3.141 N/A ASN 24.A ND2 PHE 100.A O no hydrogen 3.077 N/A LYS 25.A N ASP 62.A OD1 no hydrogen 2.830 N/A LYS 25.A NZ ASP 40.A OD2 no hydrogen 3.169 N/A ASN 26.A N ASP 62.A OD1 no hydrogen 3.040 N/A HIS 28.A N THR 102.A O no hydrogen 2.795 N/A THR 31.A N HIS 28.A O no hydrogen 3.034 N/A THR 31.A OG1 HIS 28.A O no hydrogen 2.719 N/A GLY 32.A N LYS 29.A O no hydrogen 2.984 N/A ALA 33.A N THR 31.A OG1 no hydrogen 3.121 N/A ARG 36.A N LYS 25.A O no hydrogen 2.931 N/A ARG 36.A NH1 ASN 24.A O no hydrogen 2.990 N/A ARG 36.A NH1 THR 39.A OG1 no hydrogen 3.002 N/A THR 39.A N ARG 36.A O no hydrogen 3.099 N/A THR 39.A OG1 ASN 23.A OD1 no hydrogen 2.593 N/A ASP 42.A N GLY 38.A O no hydrogen 3.344 N/A ALA 43.A N THR 39.A O no hydrogen 2.875 N/A ALA 44.A N ASP 40.A O no hydrogen 2.984 N/A ASN 45.A N VAL 41.A O no hydrogen 2.970 N/A LEU 46.A N ASP 42.A O no hydrogen 2.866 N/A ARG 47.A N ALA 43.A O no hydrogen 2.989 N/A ARG 47.A NH1.A ASN 59.A OD1 no hydrogen 2.857 N/A GLU 48.A N ALA 44.A O no hydrogen 3.119 N/A THR 49.A N ASN 45.A O no hydrogen 2.869 N/A THR 49.A OG1 ASN 45.A O no hydrogen 2.778 N/A THR 49.A OG1 ASN 45.A OD1 no hydrogen 3.439 N/A PHE 50.A N LEU 46.A O no hydrogen 2.917 N/A ARG 51.A N ARG 47.A O no hydrogen 2.922 N/A ARG 51.A NE GLU 48.A OE2 no hydrogen 2.984 N/A ARG 51.A NH2 GLU 48.A OE1 no hydrogen 2.844 N/A ARG 51.A NH2 GLU 48.A OE2 no hydrogen 3.474 N/A ASN 52.A N GLU 48.A O no hydrogen 3.076 N/A LEU 53.A N PHE 50.A O no hydrogen 3.110 N/A LYS 54.A N ARG 51.A O no hydrogen 2.931 N/A TYR 55.A N PHE 50.A O no hydrogen 3.027 N/A TYR 55.A OH SER 85.A OG no hydrogen 2.778 N/A GLU 56.A N GLY 17.A O no hydrogen 2.933 N/A ARG 58.A N CYS 19.A O no hydrogen 2.859 N/A ARG 58.A NH1 GLU 78.A OE2 no hydrogen 2.790 N/A ARG 58.A NH2 GLU 56.A OE2 no hydrogen 3.284 N/A ARG 58.A NH2 GLU 78.A OE1 no hydrogen 3.163 N/A ARG 58.A NH2 GLU 78.A OE2 no hydrogen 3.381 N/A ASN 59.A ND2 ALA 43.A O no hydrogen 3.567 N/A LYS 60.A N ILE 21.A O no hydrogen 2.778 N/A ASP 62.A N ASN 23.A O no hydrogen 2.926 N/A LEU 63.A N ASN 24.A OD1 no hydrogen 2.852 N/A THR 64.A N GLU 67.A OE1 no hydrogen 2.920 N/A THR 64.A OG1 GLU 66.A OE1 no hydrogen 3.502 N/A ARG 65.A N ASN 103.A OD1 no hydrogen 2.884 N/A ARG 65.A NE GLU 66.A OE2 no hydrogen 3.529 N/A ARG 65.A NH1 PRO 105.A O no hydrogen 3.548 N/A GLU 66.A N GLU 66.A OE1 no hydrogen 2.842 N/A GLU 67.A N THR 64.A OG1 no hydrogen 3.057 N/A ILE 68.A N THR 64.A O no hydrogen 2.912 N/A VAL 69.A N ARG 65.A O no hydrogen 3.088 N/A GLU 70.A N GLU 66.A O no hydrogen 3.007 N/A LEU 71.A N GLU 67.A O no hydrogen 2.914 N/A MET 72.A N ILE 68.A O no hydrogen 2.959 N/A ARG 73.A N VAL 69.A O no hydrogen 2.866 N/A ASP 74.A N GLU 70.A O no hydrogen 2.882 N/A VAL 75.A N LEU 71.A O no hydrogen 2.848 N/A SER 76.A N MET 72.A O no hydrogen 2.896 N/A SER 76.A OG MET 72.A O no hydrogen 3.467 N/A SER 76.A OG ARG 73.A O no hydrogen 2.752 N/A LYS 77.A N ASP 74.A O no hydrogen 3.069 N/A GLU 78.A N VAL 75.A O no hydrogen 3.075 N/A HIS 80.A N SER 122.A OG no hydrogen 2.899 N/A HIS 80.A NE2 VAL 75.A O no hydrogen 2.865 N/A SER 81.A N ASP 79.A OD1 no hydrogen 2.938 N/A SER 81.A OG ASP 79.A OD1 no hydrogen 2.663 N/A ARG 83.A N HIS 80.A O no hydrogen 2.898 N/A ARG 83.A NE GLU 15.A OE2 no hydrogen 3.446 N/A ARG 83.A NH1 GLU 78.A OE1 no hydrogen 2.989 N/A ARG 83.A NH2 GLU 78.A OE1 no hydrogen 3.262 N/A SER 84.A N GLU 15.A O no hydrogen 2.838 N/A SER 84.A OG GLU 15.A O no hydrogen 3.362 N/A SER 85.A N MET 16.A O no hydrogen 2.936 N/A SER 85.A OG MET 16.A O no hydrogen 2.805 N/A SER 85.A OG TYR 55.A OH no hydrogen 2.778 N/A PHE 86.A N PRO 127.A O no hydrogen 3.035 N/A VAL 87.A N LEU 18.A O no hydrogen 2.959 N/A CYS 88.A N LEU 129.A O no hydrogen 2.856 N/A CYS 88.A SG ILE 20.A O no hydrogen 4.004 N/A VAL 89.A N ILE 20.A O no hydrogen 2.687 N/A LEU 90.A N ILE 131.A O no hydrogen 2.820 N/A LEU 91.A N ILE 22.A O no hydrogen 2.894 N/A SER 92.A N GLN 133.A O no hydrogen 3.058 N/A SER 92.A OG PHE 100.A O no hydrogen 2.624 N/A HIS 93.A NE2 THR 34.A O no hydrogen 2.750 N/A GLU 95.A N ILE 98.A O no hydrogen 3.273 N/A ILE 98.A N GLU 95.A O no hydrogen 2.961 N/A ILE 99.A N VAL 106.A O no hydrogen 2.965 N/A PHE 100.A N HIS 93.A O no hydrogen 2.912 N/A GLY 101.A N GLY 104.A O no hydrogen 2.697 N/A THR 102.A N LEU 63.A O no hydrogen 2.898 N/A ASN 103.A ND2 GLU 66.A OE1 no hydrogen 2.992 N/A GLY 104.A N GLY 101.A O no hydrogen 3.210 N/A VAL 106.A N ILE 99.A O no hydrogen 2.727 N/A LEU 108.A N GLY 97.A O no hydrogen 2.884 N/A LYS 109.A NZ GLU 152.A OE1 no hydrogen 2.958 N/A LYS 110.A N ASP 107.A O no hydrogen 3.109 N/A THR 112.A N LEU 108.A O no hydrogen 2.981 N/A THR 112.A OG1 LEU 108.A O no hydrogen 3.294 N/A THR 112.A OG1 LYS 109.A O no hydrogen 3.459 N/A THR 112.A OG1 TYR 157.A OH no hydrogen 3.367 N/A ASN 113.A N LYS 109.A O no hydrogen 2.927 N/A PHE 115.A N THR 112.A O no hydrogen 2.926 N/A ARG 116.A N ASN 113.A O no hydrogen 3.129 N/A ARG 116.A NE ASP 118.A OD1 no hydrogen 2.998 N/A ARG 116.A NH2 ASP 118.A OD1 no hydrogen 3.449 N/A ARG 116.A NH2 ASP 118.A OD2 no hydrogen 2.836 N/A GLY 117.A N VAL 151.A O no hydrogen 3.093 N/A ARG 119.A N ARG 116.A O no hydrogen 2.837 N/A CYS 120.A N ARG 116.A O no hydrogen 2.952 N/A CYS 120.A SG SER 76.A O no hydrogen 3.518 N/A LEU 123.A N CYS 120.A O no hydrogen 3.079 N/A THR 124.A N ARG 121.A O no hydrogen 3.339 N/A THR 124.A OG1 GLY 117.A O no hydrogen 2.758 N/A THR 124.A OG1 CYS 120.A O no hydrogen 3.511 N/A THR 124.A OG1 ARG 121.A O no hydrogen 3.157 N/A LYS 126.A N LEU 123.A O no hydrogen 2.911 N/A LYS 126.A NZ HIS 80.A O no hydrogen 2.928 N/A LYS 126.A NZ SER 81.A O no hydrogen 3.233 N/A LYS 126.A NZ ARG 83.A O no hydrogen 2.856 N/A LYS 126.A NZ SER 122.A O no hydrogen 2.979 N/A LYS 128.A N ASP 154.A O no hydrogen 2.835 N/A LYS 128.A NZ LEU 123.A O no hydrogen 2.883 N/A LYS 128.A NZ LYS 126.A O no hydrogen 2.847 N/A LEU 129.A N PHE 86.A O no hydrogen 2.824 N/A PHE 130.A N LEU 156.A O no hydrogen 2.733 N/A ILE 131.A N CYS 88.A O no hydrogen 2.845 N/A ILE 132.A N ALA 158.A O no hydrogen 2.963 N/A GLN 133.A N LEU 90.A O no hydrogen 2.874 N/A GLN 133.A NE2 SER 167.A OG no hydrogen 2.916 N/A CYS 135.A SG SER 167.A O no hydrogen 3.825 N/A ARG 136.A N TYR 165.A O no hydrogen 2.921 N/A ARG 136.A NE GLU 96.A OE2 no hydrogen 3.326 N/A ARG 136.A NH1 THR 161.A O no hydrogen 2.981 N/A ARG 136.A NH1 HIS 228.A NE2.A no hydrogen 3.273 N/A ARG 136.A NH2 GLU 96.A OE2 no hydrogen 3.054 N/A ARG 136.A NH2 HIS 228.A NE2.A no hydrogen 3.495 N/A GLU 139.A N GLY 164.A O no hydrogen 2.992 N/A CYS 142.A SG.A GLY 143.A O no hydrogen 3.473 N/A GLY 143.A N ASP 141.A OD1 no hydrogen 2.888 N/A ALA 153.A N PRO 150.A O no hydrogen 3.125 N/A ASP 154.A N MET 230.A O no hydrogen 2.853 N/A LEU 156.A N LYS 128.A O no hydrogen 2.909 N/A TYR 157.A N HIS 228.A O no hydrogen 2.876 N/A TYR 157.A OH THR 112.A OG1 no hydrogen 3.367 N/A ALA 158.A N PHE 130.A O no hydrogen 2.820 N/A TYR 159.A N CYS 226.A O no hydrogen 2.987 N/A SER 160.A N ILE 132.A O no hydrogen 3.053 N/A SER 160.A OG ILE 132.A O no hydrogen 3.406 N/A SER 160.A OG SER 167.A OG no hydrogen 2.769 N/A THR 161.A OG1 TYR 166.A O no hydrogen 2.845 N/A GLY 164.A N GLU 96.A OE1 no hydrogen 3.228 N/A TYR 165.A N ALA 162.A O no hydrogen 3.181 N/A TYR 166.A N GLU 139.A O no hydrogen 2.950 N/A SER 167.A OG SER 160.A OG no hydrogen 2.769 N/A TRP 168.A N GLN 223.A OE1 no hydrogen 2.711 N/A ARG 169.A NH2 SER 37.A O no hydrogen 2.859 N/A ASN 170.A N GLY 174.A O no hydrogen 2.936 N/A LYS 172.A N ASN 170.A OD1 no hydrogen 2.937 N/A LYS 172.A NZ ASP 173.A OD1 no hydrogen 2.927 N/A ASP 173.A N ASN 170.A OD1 no hydrogen 2.823 N/A GLY 174.A N ASN 170.A O no hydrogen 2.950 N/A SER 175.A N ASP 42.A OD1 no hydrogen 2.906 N/A SER 175.A N ASP 42.A OD2 no hydrogen 3.221 N/A SER 175.A OG ASP 42.A OD2 no hydrogen 2.621 N/A TRP 176.A N TRP 168.A O no hydrogen 3.323 N/A ILE 178.A N SER 175.A OG no hydrogen 3.145 N/A GLN 179.A N SER 175.A O no hydrogen 2.995 N/A GLN 179.A NE2 GLY 174.A O no hydrogen 2.982 N/A GLN 179.A NE2 SER 175.A O no hydrogen 3.474 N/A SER 180.A N TRP 176.A O no hydrogen 3.085 N/A SER 180.A OG TRP 176.A O no hydrogen 2.793 N/A LEU 181.A N PHE 177.A O no hydrogen 2.790 N/A CYS 182.A N ILE 178.A O no hydrogen 2.968 N/A CYS 182.A SG THR 49.A OG1 no hydrogen 3.418 N/A CYS 182.A SG ILE 178.A O no hydrogen 3.425 N/A ALA 183.A N GLN 179.A O no hydrogen 3.115 N/A MET 184.A N SER 180.A O no hydrogen 2.933 N/A LEU 185.A N LEU 181.A O no hydrogen 2.897 N/A LYS 186.A N CYS 182.A O no hydrogen 2.917 N/A GLN 187.A N ALA 183.A O no hydrogen 3.070 N/A TYR 188.A N MET 184.A O no hydrogen 2.833 N/A ALA 189.A N LEU 185.A O no hydrogen 2.970 N/A LYS 191.A N TYR 188.A O no hydrogen 2.933 N/A LYS 191.A NZ GLN 187.A O no hydrogen 3.321 N/A LEU 192.A N TYR 188.A O no hydrogen 2.854 N/A PHE 194.A N LEU 235.A O no hydrogen 2.949 N/A MET 195.A N GLU 193.A OE1 no hydrogen 2.772 N/A ILE 197.A N GLU 193.A O no hydrogen 3.017 N/A LEU 198.A N PHE 194.A O no hydrogen 2.878 N/A THR 199.A N MET 195.A O no hydrogen 2.912 N/A THR 199.A OG1 MET 195.A O no hydrogen 2.775 N/A ARG 200.A N HIS 196.A O no hydrogen 3.135 N/A VAL 201.A N ILE 197.A O no hydrogen 3.023 N/A ASN 202.A N LEU 198.A O no hydrogen 2.869 N/A ARG 203.A N THR 199.A O no hydrogen 3.047 N/A LYS 204.A N ARG 200.A O no hydrogen 2.971 N/A LYS 204.A NZ GLU 208.A OE1 no hydrogen 2.991 N/A VAL 205.A N VAL 201.A O no hydrogen 3.023 N/A ALA 206.A N ASN 202.A O no hydrogen 2.981 N/A THR 207.A N ARG 203.A O no hydrogen 2.914 N/A THR 207.A OG1 ARG 203.A O no hydrogen 2.654 N/A GLU 208.A N LYS 204.A O no hydrogen 2.882 N/A SER 211.A N LYS 221.A O no hydrogen 2.916 N/A SER 211.A OG PHE 218.A O no hydrogen 2.774 N/A SER 213.A N HIS 219.A ND1 no hydrogen 3.086 N/A SER 213.A OG ASP 215.A O no hydrogen 3.380 N/A ASP 215.A N SER 213.A OG no hydrogen 3.003 N/A THR 217.A N ASP 215.A OD1 no hydrogen 3.001 N/A THR 217.A OG1 ASP 215.A OD1 no hydrogen 3.530 N/A PHE 218.A N ASP 215.A O no hydrogen 2.889 N/A HIS 219.A N ALA 216.A O no hydrogen 3.387 N/A ALA 220.A N SER 211.A O no hydrogen 3.014 N/A LYS 221.A N SER 211.A OG no hydrogen 2.851 N/A LYS 222.A N ASP 141.A O no hydrogen 2.747 N/A LYS 222.A NZ ALA 206.A O no hydrogen 2.899 N/A LYS 222.A NZ PHE 209.A O no hydrogen 2.821 N/A GLN 223.A NE2 SER 160.A O no hydrogen 2.770 N/A CYS 226.A N TYR 159.A O no hydrogen 2.996 N/A CYS 226.A SG ILE 227.A O no hydrogen 4.018 N/A CYS 226.A SG HIS 228.A NE2.A no hydrogen 2.996 N/A HIS 228.A N TYR 157.A O no hydrogen 2.843 N/A MET 230.A N PHE 155.A O no hydrogen 2.883 N/A LEU 231.A N SER 229.A OG no hydrogen 3.164 N/A THR 232.A N TYR 9.A OH no hydrogen 2.988 N/A THR 232.A OG1 ASP 154.A OD1 no hydrogen 2.724 N/A GLU 234.A N ASN 7.A O no hydrogen 2.885 N/A LEU 235.A N GLU 193.A OE2 no hydrogen 2.826 N/A TYR 236.A OH GLU 234.A OE1 no hydrogen 2.611 N/A