Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4qdk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A NZ ASP 114.A OD2 no hydrogen 2.897 N/A ILE 5.A N ASP 1.A O no hydrogen 3.265 N/A VAL 6.A N ASP 2.A O no hydrogen 2.949 N/A ARG 7.A N LYS 3.A O no hydrogen 2.864 N/A ASP 8.A N THR 4.A O no hydrogen 2.874 N/A TYR 9.A N ILE 5.A O no hydrogen 3.122 N/A PHE 10.A N VAL 6.A O no hydrogen 3.057 N/A ASN 11.A N ASP 8.A O no hydrogen 3.237 N/A SER 12.A N TYR 9.A O no hydrogen 3.057 N/A SER 12.A OG ASP 8.A O no hydrogen 2.830 N/A SER 12.A OG TYR 9.A O no hydrogen 3.381 N/A GLY 14.A N TYR 9.A O no hydrogen 2.758 N/A ASP 16.A N SER 12.A O no hydrogen 3.379 N/A ARG 17.A N THR 13.A O no hydrogen 3.187 N/A TRP 18.A N GLY 14.A O no hydrogen 2.958 N/A ARG 19.A N PHE 15.A O no hydrogen 2.921 N/A ARG 19.A NH2 GLU 93.A OE1 no hydrogen 2.807 N/A ARG 19.A NH2 GLU 93.A OE2 no hydrogen 3.522 N/A ILE 21.A N ARG 17.A O no hydrogen 3.257 N/A TYR 22.A N TRP 18.A O no hydrogen 2.811 N/A GLY 23.A N ARG 20.A O no hydrogen 3.330 N/A GLN 31.A N ASN 28.A OD1 no hydrogen 3.096 N/A LYS 32.A N ASN 28.A O no hydrogen 2.819 N/A ASP 33.A N PHE 29.A O no hydrogen 3.013 N/A ILE 34.A N VAL 30.A O no hydrogen 3.159 N/A ARG 35.A N GLN 31.A O no hydrogen 2.842 N/A ARG 35.A NE ILE 21.A O no hydrogen 2.825 N/A ARG 35.A NH1 GLY 25.A O no hydrogen 3.001 N/A ARG 35.A NH2 ARG 20.A O no hydrogen 2.741 N/A ARG 35.A NH2 GLY 25.A O no hydrogen 2.854 N/A VAL 36.A N LYS 32.A O no hydrogen 2.906 N/A GLY 37.A N ASP 33.A O no hydrogen 2.912 N/A HIS 38.A N ILE 34.A O no hydrogen 2.885 N/A GLN 39.A N ARG 35.A O no hydrogen 2.858 N/A GLN 40.A N VAL 36.A O no hydrogen 2.973 N/A THR 41.A N GLY 37.A O no hydrogen 3.132 N/A THR 41.A OG1 GLY 37.A O no hydrogen 3.478 N/A THR 41.A OG1 THR 204.A OG1 no hydrogen 3.077 N/A THR 41.A OG1 TYR 209.A OH no hydrogen 2.786 N/A VAL 42.A N HIS 38.A O no hydrogen 2.981 N/A ASP 43.A N GLN 39.A O no hydrogen 2.857 N/A SER 44.A N GLN 40.A O no hydrogen 2.874 N/A SER 44.A OG GLN 40.A O no hydrogen 2.817 N/A VAL 45.A N THR 41.A O no hydrogen 3.112 N/A VAL 46.A N VAL 42.A O no hydrogen 3.002 N/A ALA 47.A N ASP 43.A O no hydrogen 2.925 N/A TRP 48.A N SER 44.A O no hydrogen 3.068 N/A LEU 49.A N VAL 45.A O no hydrogen 3.203 N/A VAL 50.A N VAL 46.A O no hydrogen 2.861 N/A ALA 51.A N ALA 47.A O no hydrogen 2.958 N/A ASP 52.A N TRP 48.A O no hydrogen 3.294 N/A GLY 53.A N VAL 50.A O no hydrogen 3.083 N/A GLY 57.A N GLY 78.A O no hydrogen 2.879 N/A LEU 58.A N LEU 55.A O no hydrogen 2.923 N/A VAL 60.A N LEU 80.A O no hydrogen 2.953 N/A CYS 61.A N THR 124.A O no hydrogen 2.867 N/A ASP 62.A N TYR 82.A O no hydrogen 2.925 N/A ALA 63.A N ILE 126.A O no hydrogen 2.811 N/A GLY 64.A N SER 84.A O no hydrogen 2.694 N/A CYS 65.A N SER 84.A O no hydrogen 2.835 N/A CYS 65.A SG GLY 66.A O no hydrogen 3.757 N/A GLY 66.A N ASP 85.A OD2 no hydrogen 2.874 N/A GLY 68.A N CYS 65.A O no hydrogen 2.968 N/A SER 71.A OG ASP 62.A OD2 no hydrogen 2.599 N/A ILE 72.A N GLY 68.A O no hydrogen 2.995 N/A LEU 74.A N LEU 70.A O no hydrogen 3.185 N/A ALA 75.A N SER 71.A O no hydrogen 3.012 N/A GLN 76.A N ILE 72.A O no hydrogen 2.887 N/A ALA 77.A N PRO 73.A O no hydrogen 3.179 N/A ALA 77.A N LEU 74.A O no hydrogen 3.160 N/A GLY 78.A N ALA 75.A O no hydrogen 2.954 N/A ALA 79.A N LEU 74.A O no hydrogen 2.979 N/A LEU 80.A N LEU 58.A O no hydrogen 2.854 N/A TYR 82.A N VAL 60.A O no hydrogen 2.784 N/A GLY 83.A N THR 109.A O no hydrogen 2.886 N/A SER 84.A N ASP 62.A O no hydrogen 3.002 N/A ASP 85.A N MET 111.A O no hydrogen 3.176 N/A SER 87.A N ASP 85.A OD1 no hydrogen 2.813 N/A SER 87.A OG PHE 10.A O no hydrogen 2.995 N/A SER 87.A OG ASN 11.A OD1 no hydrogen 2.671 N/A LYS 89.A N ASN 11.A OD1 no hydrogen 3.233 N/A LYS 89.A NZ ASN 11.A O no hydrogen 3.073 N/A MET 90.A N SER 87.A OG no hydrogen 3.128 N/A VAL 91.A N SER 87.A O no hydrogen 3.025 N/A GLY 92.A N GLU 88.A O no hydrogen 2.945 N/A GLU 93.A N LYS 89.A O no hydrogen 3.123 N/A ALA 94.A N MET 90.A O no hydrogen 2.932 N/A GLN 95.A N VAL 91.A O no hydrogen 2.962 N/A GLN 95.A NE2 PHE 110.A O no hydrogen 3.619 N/A GLN 96.A N GLY 92.A O no hydrogen 3.089 N/A LYS 97.A N GLU 93.A O no hydrogen 2.822 N/A LYS 97.A NZ GLU 93.A OE2 no hydrogen 2.333 N/A ALA 98.A N ALA 94.A O no hydrogen 2.873 N/A GLN 99.A N GLN 95.A O no hydrogen 3.029 N/A GLU 100.A N GLN 96.A O no hydrogen 3.079 N/A VAL 101.A N LYS 97.A O no hydrogen 3.011 N/A LEU 102.A N ALA 98.A O no hydrogen 2.719 N/A ALA 103.A N GLN 99.A O no hydrogen 3.010 N/A GLY 105.A N LEU 102.A O no hydrogen 3.026 N/A ASN 106.A ND2 ALA 75.A O no hydrogen 2.798 N/A ASN 106.A ND2 ALA 79.A O no hydrogen 2.856 N/A THR 109.A N VAL 81.A O no hydrogen 2.946 N/A MET 111.A N GLY 83.A O no hydrogen 3.025 N/A GLN 113.A N ASP 85.A O no hydrogen 2.804 N/A ALA 116.A N ASP 114.A OD1 no hydrogen 3.308 N/A GLN 117.A N ASP 114.A O no hydrogen 2.828 N/A LEU 118.A N LEU 115.A O no hydrogen 3.183 N/A LYS 121.A NZ SER 148.A O no hydrogen 2.435 N/A TYR 122.A N LEU 149.A O no hydrogen 2.924 N/A TYR 122.A OH GLY 119.A O no hydrogen 2.849 N/A ASP 123.A N LEU 59.A O no hydrogen 3.096 N/A THR 124.A N LEU 59.A O no hydrogen 3.264 N/A THR 124.A OG1 ASP 123.A OD1 no hydrogen 2.668 N/A VAL 125.A N ARG 153.A O no hydrogen 2.797 N/A ILE 126.A N CYS 61.A O no hydrogen 2.689 N/A CYS 127.A N ILE 155.A O no hydrogen 2.845 N/A CYS 127.A SG ALA 63.A O no hydrogen 3.672 N/A ASP 129.A N SER 157.A OG no hydrogen 2.637 N/A HIS 133.A N VAL 130.A O no hydrogen 3.112 N/A TYR 134.A N LEU 131.A O no hydrogen 3.038 N/A THR 136.A OG1 HIS 182.A ND1 no hydrogen 3.337 N/A GLU 138.A N PRO 135.A O no hydrogen 2.936 N/A ALA 139.A N PRO 135.A O no hydrogen 2.987 N/A SER 140.A N THR 136.A O no hydrogen 3.106 N/A MET 142.A N GLU 138.A O no hydrogen 3.178 N/A ILE 143.A N ALA 139.A O no hydrogen 2.806 N/A SER 144.A N SER 140.A O no hydrogen 2.942 N/A SER 144.A OG SER 140.A O no hydrogen 3.058 N/A HIS 145.A N ALA 141.A O no hydrogen 3.147 N/A HIS 145.A NE2 LEU 118.A O no hydrogen 2.721 N/A LEU 146.A N MET 142.A O no hydrogen 3.036 N/A ALA 147.A N ILE 143.A O no hydrogen 2.862 N/A SER 148.A N SER 144.A O no hydrogen 3.269 N/A SER 148.A N HIS 145.A O no hydrogen 3.069 N/A SER 148.A OG HIS 145.A O no hydrogen 2.499 N/A LEU 149.A N LEU 146.A O no hydrogen 2.981 N/A ALA 150.A N ALA 147.A O no hydrogen 3.187 N/A ASP 151.A N TYR 122.A O no hydrogen 2.694 N/A ARG 152.A N ASP 123.A O no hydrogen 3.153 N/A ARG 152.A NE ASP 123.A OD2 no hydrogen 2.917 N/A ARG 152.A NH2 ASP 123.A OD1 no hydrogen 2.801 N/A ARG 152.A NH2 ASP 123.A OD2 no hydrogen 3.556 N/A ARG 153.A N ASP 123.A O no hydrogen 2.913 N/A ARG 153.A NE THR 124.A OG1 no hydrogen 2.880 N/A ARG 153.A NH1 ASP 52.A OD2 no hydrogen 2.657 N/A ARG 153.A NH1 GLU 215.A OE2 no hydrogen 3.009 N/A ARG 153.A NH2 THR 124.A OG1 no hydrogen 3.077 N/A LEU 154.A N ALA 216.A O no hydrogen 2.817 N/A ILE 155.A N VAL 125.A O no hydrogen 2.848 N/A LEU 156.A N LEU 214.A O no hydrogen 3.026 N/A SER 157.A N CYS 127.A O no hydrogen 3.140 N/A SER 157.A OG ASP 129.A OD1 no hydrogen 2.763 N/A PHE 158.A N ARG 212.A O no hydrogen 2.957 N/A THR 162.A N GLN 181.A OE1 no hydrogen 2.840 N/A THR 162.A OG1 GLN 181.A OE1 no hydrogen 3.367 N/A THR 166.A N THR 162.A O no hydrogen 2.759 N/A THR 166.A OG1 THR 162.A O no hydrogen 2.792 N/A THR 166.A OG1 GLN 181.A OE1 no hydrogen 2.983 N/A VAL 167.A N LEU 163.A O no hydrogen 2.768 N/A LEU 168.A N GLY 164.A O no hydrogen 3.022 N/A LYS 169.A N LEU 165.A O no hydrogen 3.017 N/A LYS 170.A N THR 166.A O no hydrogen 3.051 N/A ILE 171.A N VAL 167.A O no hydrogen 2.873 N/A GLY 172.A N LEU 168.A O no hydrogen 2.846 N/A LEU 174.A N ILE 171.A O no hydrogen 2.883 N/A PHE 175.A N GLY 172.A O no hydrogen 3.388 N/A TYR 180.A N ILE 132.A O no hydrogen 2.769 N/A HIS 182.A N ALA 159.A O no hydrogen 3.003 N/A HIS 182.A NE2 LEU 131.A O no hydrogen 2.798 N/A ILE 187.A N LYS 183.A O no hydrogen 3.056 N/A ARG 188.A N GLU 184.A O no hydrogen 2.826 N/A ARG 188.A NE GLU 184.A OE2 no hydrogen 2.800 N/A ARG 188.A NH2 GLU 184.A OE2 no hydrogen 2.937 N/A LYS 189.A N ALA 185.A O no hydrogen 3.016 N/A LYS 189.A NZ ASP 193.A OD1 no hydrogen 3.267 N/A ILE 190.A N ASP 186.A O no hydrogen 3.066 N/A LEU 191.A N ILE 187.A O no hydrogen 2.983 N/A GLY 192.A N ARG 188.A O no hydrogen 2.919 N/A ASP 193.A N LYS 189.A O no hydrogen 2.870 N/A ASN 194.A N ILE 190.A O no hydrogen 3.197 N/A ASN 194.A N LEU 191.A O no hydrogen 3.168 N/A ASN 194.A ND2 SER 144.A OG no hydrogen 2.930 N/A ASN 194.A ND2 ILE 190.A O no hydrogen 2.788 N/A GLY 195.A N GLY 192.A O no hydrogen 2.949 N/A PHE 196.A N LEU 191.A O no hydrogen 2.918 N/A SER 197.A N VAL 217.A O no hydrogen 2.821 N/A SER 197.A OG VAL 217.A O no hydrogen 3.450 N/A ALA 199.A N GLU 215.A O no hydrogen 2.728 N/A ARG 200.A N GLU 215.A OE1 no hydrogen 3.077 N/A ARG 200.A NE GLU 215.A OE1 no hydrogen 2.863 N/A ARG 200.A NH1 TRP 48.A O no hydrogen 3.109 N/A ARG 200.A NH2 TRP 48.A O no hydrogen 3.402 N/A ARG 200.A NH2 ASP 52.A OD2 no hydrogen 3.114 N/A ARG 200.A NH2 GLU 215.A OE2 no hydrogen 2.828 N/A GLY 202.A N ILE 213.A O no hydrogen 2.888 N/A THR 204.A N SER 211.A O no hydrogen 2.856 N/A THR 204.A OG1 THR 41.A OG1 no hydrogen 3.077 N/A THR 206.A N TYR 209.A O no hydrogen 2.875 N/A THR 206.A OG1 ASP 33.A OD2 no hydrogen 2.626 N/A THR 206.A OG1 TYR 209.A O no hydrogen 3.474 N/A ARG 207.A N ASP 33.A OD1 no hydrogen 3.099 N/A PHE 208.A N ASP 33.A OD2 no hydrogen 2.785 N/A TYR 209.A OH THR 41.A OG1 no hydrogen 2.786 N/A TYR 209.A OH ASP 129.A OD1 no hydrogen 3.412 N/A TYR 209.A OH ASP 129.A OD2 no hydrogen 2.634 N/A SER 211.A N THR 204.A O no hydrogen 2.918 N/A SER 211.A OG ASP 129.A OD1 no hydrogen 3.038 N/A ARG 212.A N PHE 158.A O no hydrogen 2.701 N/A ARG 212.A NE GLU 184.A OE1 no hydrogen 2.704 N/A ARG 212.A NH1 THR 201.A OG1 no hydrogen 3.128 N/A ARG 212.A NH1 GLY 202.A O no hydrogen 2.985 N/A ARG 212.A NH2 GLU 184.A OE1 no hydrogen 3.379 N/A ARG 212.A NH2 GLU 184.A OE2 no hydrogen 3.025 N/A ILE 213.A N GLY 202.A O no hydrogen 2.995 N/A LEU 214.A N LEU 156.A O no hydrogen 2.851 N/A GLU 215.A N ARG 200.A O no hydrogen 2.870 N/A ALA 216.A N LEU 154.A O no hydrogen 2.781 N/A VAL 217.A N SER 197.A O no hydrogen 2.767 N/A ARG 218.A N ARG 152.A O no hydrogen 2.818 N/A ARG 218.A NE ALA 150.A O no hydrogen 3.169 N/A ARG 218.A NH2 ALA 150.A O no hydrogen 2.864 N/A SER 219.A N GLY 195.A O no hydrogen 2.972 N/A