Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8cjj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 7.A N ASP 11.A OD2 no hydrogen 2.952 N/A ASP 11.A N LYS 8.A O no hydrogen 2.964 N/A LEU 12.A N ILE 9.A O no hydrogen 3.221 N/A ASP 13.A N SER 10.A O no hydrogen 3.037 N/A HIS 14.A N ASP 11.A O no hydrogen 3.004 N/A CYS 15.A N LEU 12.A O no hydrogen 3.237 N/A CYS 15.A SG LEU 12.A O no hydrogen 3.883 N/A ALA 16.A N LEU 12.A O no hydrogen 2.756 N/A ASN 17.A ND2 MET 50.A O no hydrogen 3.001 N/A ARG 18.A N CYS 15.A O no hydrogen 3.198 N/A ARG 18.A NH1 ASP 137.A OD1 no hydrogen 2.935 N/A ARG 18.A NH1 ASP 137.A OD2 no hydrogen 3.442 N/A VAL 19.A N ASN 17.A O no hydrogen 2.493 N/A LEU 20.A N TYR 132.A O no hydrogen 3.023 N/A TYR 22.A OH ASP 47.A OD1 no hydrogen 2.956 N/A GLU 25.A N TYR 22.A O no hydrogen 2.962 N/A ASP 29.A N ASP 27.A OD2 no hydrogen 3.182 N/A HIS 30.A N ASP 27.A O no hydrogen 2.879 N/A HIS 30.A NE2 GLU 164.A OE2 no hydrogen 2.721 N/A GLY 32.A N HIS 30.A ND1 no hydrogen 2.906 N/A PHE 33.A N HIS 30.A O no hydrogen 3.036 N/A ASP 35.A N GLY 32.A O no hydrogen 2.907 N/A TYR 38.A N ASP 35.A OD1 no hydrogen 3.069 N/A TYR 38.A OH VAL 153.A O no hydrogen 2.750 N/A ARG 39.A N ASP 35.A O no hydrogen 2.922 N/A ARG 39.A NE PHE 33.A O no hydrogen 2.952 N/A ARG 39.A NH2 PHE 33.A O no hydrogen 3.105 N/A LYS 40.A N ASN 36.A O no hydrogen 2.955 N/A ARG 41.A N VAL 37.A O no hydrogen 2.966 N/A ARG 41.A NE GLU 67.A OE2 no hydrogen 2.901 N/A ARG 41.A NH2 GLU 62.A O no hydrogen 3.115 N/A ARG 41.A NH2 GLU 67.A OE1 no hydrogen 2.912 N/A ARG 42.A N TYR 38.A O no hydrogen 2.796 N/A ARG 42.A NH1 HIS 30.A NE2 no hydrogen 3.532 N/A ARG 42.A NH1 TYR 38.A OH no hydrogen 3.019 N/A ARG 42.A NH1 GLU 164.A OE2 no hydrogen 2.733 N/A ARG 42.A NH2 GLU 164.A OE1 no hydrogen 3.226 N/A ARG 42.A NH2 GLU 164.A OE2 no hydrogen 3.531 N/A LYS 43.A N ARG 39.A O no hydrogen 2.967 N/A LYS 43.A NZ ASP 47.A OD1 no hydrogen 3.391 N/A LYS 43.A NZ ASP 47.A OD2 no hydrogen 2.771 N/A TYR 44.A N LYS 40.A O no hydrogen 3.040 N/A PHE 45.A N ARG 41.A O no hydrogen 3.120 N/A ALA 46.A N ARG 42.A O no hydrogen 2.968 N/A ASP 47.A N LYS 43.A O no hydrogen 2.917 N/A LEU 48.A N TYR 44.A O no hydrogen 3.069 N/A ALA 49.A N PHE 45.A O no hydrogen 3.184 N/A MET 50.A N ALA 46.A O no hydrogen 2.908 N/A ASN 51.A N ASP 47.A O no hydrogen 3.036 N/A TYR 52.A N ALA 49.A O no hydrogen 3.186 N/A LYS 53.A N ASP 56.A OD2 no hydrogen 2.972 N/A HIS 54.A N ASP 13.A OD1 no hydrogen 2.860 N/A ASP 56.A N LYS 53.A O no hydrogen 2.927 N/A ILE 58.A N GLU 112.A OE1 no hydrogen 2.795 N/A LYS 60.A NZ ASP 113.A OD1 no hydrogen 2.790 N/A LYS 60.A NZ ASP 113.A OD2 no hydrogen 3.223 N/A VAL 61.A N GLN 110.A OE1 no hydrogen 2.962 N/A THR 64.A N GLU 67.A OE1 no hydrogen 2.901 N/A GLU 67.A N THR 64.A OG1 no hydrogen 3.060 N/A ILE 68.A N THR 64.A O no hydrogen 3.022 N/A LYS 69.A N GLU 65.A O no hydrogen 2.941 N/A THR 70.A N GLU 66.A O no hydrogen 3.059 N/A THR 70.A OG1 GLU 66.A O no hydrogen 3.063 N/A TRP 71.A N GLU 67.A O no hydrogen 3.016 N/A TRP 71.A NE1 ARG 104.A O no hydrogen 2.847 N/A GLY 72.A N ILE 68.A O no hydrogen 2.913 N/A THR 73.A N LYS 69.A O no hydrogen 3.001 N/A THR 73.A OG1 LYS 69.A O no hydrogen 3.084 N/A VAL 74.A N THR 70.A O no hydrogen 3.183 N/A PHE 75.A N TRP 71.A O no hydrogen 2.688 N/A GLN 76.A N GLY 72.A O no hydrogen 2.925 N/A GLU 77.A N THR 73.A O no hydrogen 3.319 N/A LEU 78.A N VAL 74.A O no hydrogen 3.034 N/A ASN 79.A N PHE 75.A O no hydrogen 3.049 N/A ASN 79.A ND2 PHE 75.A O no hydrogen 2.878 N/A LEU 81.A N LEU 78.A O no hydrogen 2.892 N/A TYR 82.A N LEU 78.A O no hydrogen 3.080 N/A TYR 82.A OH LEU 232.A O no hydrogen 2.667 N/A THR 84.A N LEU 81.A O no hydrogen 3.178 N/A THR 84.A OG1 LEU 81.A O no hydrogen 3.208 N/A THR 84.A OG1 HIS 85.A ND1 no hydrogen 2.802 N/A HIS 85.A N TYR 82.A O no hydrogen 3.193 N/A HIS 85.A ND1 LEU 81.A O no hydrogen 3.030 N/A HIS 85.A ND1 THR 84.A OG1 no hydrogen 2.802 N/A ALA 86.A N TYR 82.A O no hydrogen 2.882 N/A CYS 87.A N VAL 226.A O no hydrogen 3.007 N/A CYS 87.A SG GLU 89.A OE1 no hydrogen 3.447 N/A CYS 87.A SG VAL 226.A O no hydrogen 3.828 N/A ARG 88.A N GLN 220.A OE1 no hydrogen 2.874 N/A ARG 88.A NH2 ASP 221.A OD2 no hydrogen 2.905 N/A GLU 89.A N GLU 89.A OE1 no hydrogen 2.690 N/A TYR 90.A OH LEU 172.A O no hydrogen 2.529 N/A LEU 91.A N CYS 87.A O no hydrogen 3.140 N/A LYS 92.A N ARG 88.A O no hydrogen 2.946 N/A ASN 93.A N GLU 89.A O no hydrogen 3.210 N/A ASN 93.A N TYR 90.A O no hydrogen 3.267 N/A ASN 93.A ND2 PRO 176.A O no hydrogen 2.976 N/A ASN 93.A ND2 GLU 180.A OE1 no hydrogen 3.231 N/A LEU 94.A N TYR 90.A O no hydrogen 3.034 N/A LEU 97.A N ASN 93.A O no hydrogen 3.278 N/A SER 98.A N LEU 94.A O no hydrogen 3.226 N/A SER 98.A OG TYR 103.A O no hydrogen 3.216 N/A LYS 99.A N PRO 95.A O no hydrogen 3.059 N/A TYR 100.A N LEU 96.A O no hydrogen 2.959 N/A CYS 101.A N LEU 97.A O no hydrogen 2.877 N/A CYS 101.A SG ASP 113.A O no hydrogen 3.754 N/A TYR 103.A N LEU 97.A O no hydrogen 3.479 N/A TYR 103.A OH LEU 171.A O no hydrogen 2.728 N/A ASN 107.A N ARG 104.A O no hydrogen 3.226 N/A ASN 107.A ND2 GLY 102.A O no hydrogen 2.829 N/A GLN 110.A NE2 VAL 61.A O no hydrogen 2.723 N/A VAL 114.A N GLN 110.A O no hydrogen 3.122 N/A SER 115.A N LEU 111.A O no hydrogen 2.788 N/A ASN 116.A N GLU 112.A O no hydrogen 2.993 N/A PHE 117.A N ASP 113.A O no hydrogen 3.050 N/A LEU 118.A N VAL 114.A O no hydrogen 2.930 N/A LYS 119.A N SER 115.A O no hydrogen 2.957 N/A GLU 120.A N ASN 116.A O no hydrogen 3.295 N/A ARG 121.A N PHE 117.A O no hydrogen 3.085 N/A THR 122.A N LEU 118.A O no hydrogen 2.880 N/A THR 122.A OG1 LEU 118.A O no hydrogen 3.465 N/A THR 122.A OG1 LEU 178.A O no hydrogen 2.753 N/A GLY 123.A N LYS 119.A O no hydrogen 3.081 N/A PHE 124.A N THR 122.A OG1 no hydrogen 3.399 N/A SER 125.A N ARG 145.A O no hydrogen 2.900 N/A ILE 126.A N SER 115.A OG no hydrogen 2.967 N/A ARG 127.A N PHE 147.A O no hydrogen 3.018 N/A ARG 127.A NH1 ASP 13.A OD1 no hydrogen 2.858 N/A ARG 127.A NH2 ASP 13.A OD1 no hydrogen 2.979 N/A VAL 129.A N CYS 149.A O no hydrogen 3.029 N/A TYR 132.A N MET 21.A O no hydrogen 3.046 N/A ARG 136.A NH1 ALA 197.A O no hydrogen 2.935 N/A ARG 136.A NH2 ALA 197.A O no hydrogen 2.781 N/A ASP 137.A N SER 134.A OG no hydrogen 3.079 N/A PHE 138.A N SER 134.A O no hydrogen 2.918 N/A LEU 139.A N PRO 135.A O no hydrogen 2.884 N/A SER 140.A N ARG 136.A O no hydrogen 3.035 N/A SER 140.A OG ASP 137.A O no hydrogen 2.781 N/A GLY 141.A N PHE 138.A O no hydrogen 3.259 N/A LEU 142.A N LEU 139.A O no hydrogen 3.039 N/A ALA 143.A N SER 140.A O no hydrogen 3.131 N/A PHE 144.A N GLY 141.A O no hydrogen 2.954 N/A ARG 145.A N LEU 142.A O no hydrogen 2.866 N/A ARG 145.A NE GLN 188.A OE1 no hydrogen 2.933 N/A ARG 145.A NH1 THR 122.A O no hydrogen 2.821 N/A ARG 145.A NH2 GLN 188.A OE1 no hydrogen 2.960 N/A VAL 146.A N GLY 141.A O no hydrogen 2.890 N/A PHE 147.A N SER 125.A O no hydrogen 2.875 N/A CYS 149.A N ARG 127.A O no hydrogen 2.772 N/A CYS 149.A SG.A THR 150.A O no hydrogen 3.648 N/A CYS 149.A SG.B PHE 147.A O no hydrogen 3.891 N/A THR 150.A N GLU 170.A OE1 no hydrogen 2.946 N/A THR 150.A OG1 GLU 170.A OE1 no hydrogen 2.895 N/A GLN 151.A NE2 PRO 59.A O no hydrogen 2.957 N/A TYR 152.A OH PRO 165.A O no hydrogen 2.553 N/A ARG 154.A N ASP 166.A OD2 no hydrogen 2.843 N/A ARG 154.A NE ASP 166.A OD2 no hydrogen 2.916 N/A ARG 154.A NH1 PRO 159.A O no hydrogen 2.788 N/A ARG 154.A NH2 ASP 166.A OD1 no hydrogen 2.875 N/A HIS 155.A ND1 SER 157.A OG no hydrogen 2.746 N/A HIS 155.A NE2 ASP 35.A OD2 no hydrogen 2.806 N/A SER 156.A OG GLU 66.A OE2 no hydrogen 2.816 N/A SER 157.A N HIS 155.A ND1 no hydrogen 3.235 N/A SER 157.A OG HIS 155.A ND1 no hydrogen 2.746 N/A ASP 158.A N HIS 155.A O no hydrogen 3.413 N/A PHE 160.A N ASP 158.A OD1 no hydrogen 3.311 N/A TYR 161.A N ASP 158.A O no hydrogen 3.016 N/A THR 167.A N TYR 152.A O no hydrogen 2.809 N/A THR 167.A OG1 THR 150.A O no hydrogen 3.053 N/A CYS 168.A SG ASP 166.A OD2 no hydrogen 3.435 N/A HIS 169.A N ASP 166.A OD1 no hydrogen 3.131 N/A HIS 169.A ND1 SER 233.A OG no hydrogen 2.807 N/A HIS 169.A NE2 HIS 174.A NE2 no hydrogen 2.906 N/A GLU 170.A N ASP 166.A O no hydrogen 3.103 N/A LEU 171.A N THR 167.A O no hydrogen 2.811 N/A LEU 172.A N CYS 168.A O no hydrogen 2.985 N/A GLY 173.A N HIS 169.A O no hydrogen 2.834 N/A HIS 174.A N GLU 170.A O no hydrogen 3.111 N/A VAL 175.A N GLU 170.A O no hydrogen 3.089 N/A LEU 177.A N HIS 174.A O no hydrogen 3.180 N/A LEU 178.A N HIS 174.A O no hydrogen 3.166 N/A ALA 179.A N VAL 175.A O no hydrogen 3.305 N/A GLU 180.A N LEU 177.A O no hydrogen 2.953 N/A ALA 184.A N GLU 180.A O no hydrogen 2.884 N/A GLN 185.A N PRO 181.A O no hydrogen 3.002 N/A GLN 185.A NE2 GLU 189.A OE2 no hydrogen 2.844 N/A PHE 186.A N SER 182.A O no hydrogen 3.151 N/A SER 187.A N PHE 183.A O no hydrogen 2.870 N/A SER 187.A OG PHE 183.A O no hydrogen 3.094 N/A GLN 188.A N ALA 184.A O no hydrogen 2.896 N/A GLN 188.A NE2 ALA 143.A O no hydrogen 2.923 N/A GLU 189.A N GLN 185.A O no hydrogen 2.980 N/A ILE 190.A N PHE 186.A O no hydrogen 3.274 N/A GLY 191.A N SER 187.A O no hydrogen 3.314 N/A LEU 192.A N GLN 188.A O no hydrogen 2.816 N/A ALA 193.A N GLU 189.A O no hydrogen 3.054 N/A SER 194.A N ILE 190.A O no hydrogen 3.125 N/A SER 194.A N GLY 191.A O no hydrogen 3.122 N/A SER 194.A OG GLY 191.A O no hydrogen 2.769 N/A LEU 195.A N LEU 192.A O no hydrogen 3.292 N/A ALA 197.A N SER 194.A O no hydrogen 2.948 N/A SER 198.A OG GLU 200.A OE1 no hydrogen 3.313 N/A ALA 201.A N SER 198.A OG no hydrogen 2.873 N/A VAL 202.A N SER 198.A O no hydrogen 2.927 N/A GLN 203.A N GLU 199.A O no hydrogen 3.056 N/A LYS 204.A N GLU 200.A O no hydrogen 3.199 N/A LEU 205.A N ALA 201.A O no hydrogen 2.904 N/A ALA 206.A N VAL 202.A O no hydrogen 2.872 N/A THR 207.A N GLN 203.A O no hydrogen 3.006 N/A THR 207.A OG1 GLN 203.A O no hydrogen 3.286 N/A CYS 208.A N LYS 204.A O no hydrogen 3.007 N/A CYS 208.A SG LYS 204.A O no hydrogen 3.455 N/A TYR 209.A N LEU 205.A O no hydrogen 2.849 N/A TYR 209.A OH GLU 214.A OE2 no hydrogen 2.817 N/A PHE 210.A N ALA 206.A O no hydrogen 2.917 N/A PHE 211.A N THR 207.A O no hydrogen 3.095 N/A THR 212.A N TYR 209.A O no hydrogen 3.268 N/A THR 212.A OG1 CYS 208.A O no hydrogen 2.852 N/A THR 212.A OG1 TYR 209.A O no hydrogen 3.353 N/A VAL 213.A N THR 212.A OG1 no hydrogen 2.702 N/A GLU 214.A N TYR 209.A O no hydrogen 3.329 N/A PHE 215.A N PHE 210.A O no hydrogen 2.814 N/A GLY 216.A N THR 212.A O no hydrogen 2.886 N/A LEU 217.A N PHE 271.A O no hydrogen 3.098 N/A CYS 218.A N ARG 225.A O no hydrogen 2.763 N/A LYS 219.A N SER 273.A O no hydrogen 3.082 N/A GLN 220.A N GLN 223.A O no hydrogen 2.858 N/A GLN 220.A NE2 GLU 89.A OE1 no hydrogen 2.834 N/A GLN 223.A N GLN 220.A O no hydrogen 2.919 N/A ARG 225.A N CYS 218.A O no hydrogen 2.769 N/A ARG 225.A NH1 PRO 83.A O no hydrogen 3.019 N/A ARG 225.A NH2 GLN 223.A OE1 no hydrogen 3.556 N/A VAL 226.A N HIS 85.A O no hydrogen 2.894 N/A PHE 227.A N GLY 216.A O no hydrogen 3.088 N/A GLY 228.A N GLY 216.A O no hydrogen 2.987 N/A ALA 229.A N VAL 213.A O no hydrogen 2.853 N/A GLY 230.A N GLU 214.A O no hydrogen 2.756 N/A LEU 231.A N GLY 228.A O no hydrogen 3.126 N/A LEU 232.A N GLY 228.A O no hydrogen 2.970 N/A SER 233.A N ALA 229.A O no hydrogen 3.120 N/A SER 233.A OG HIS 169.A ND1 no hydrogen 2.807 N/A SER 233.A OG ALA 229.A O no hydrogen 3.170 N/A SER 234.A N LEU 231.A O no hydrogen 3.115 N/A GLU 237.A N SER 234.A OG no hydrogen 3.376 N/A LEU 238.A N SER 234.A O no hydrogen 2.929 N/A LYS 239.A N ILE 235.A O no hydrogen 3.462 N/A HIS 240.A N SER 236.A O no hydrogen 2.995 N/A ALA 241.A N GLU 237.A O no hydrogen 2.842 N/A SER 243.A N HIS 240.A O no hydrogen 3.017 N/A SER 243.A OG HIS 240.A O no hydrogen 2.754 N/A HIS 245.A N SER 243.A OG no hydrogen 3.189 N/A ALA 246.A N SER 243.A O no hydrogen 3.500 N/A LYS 249.A N TYR 270.A O no hydrogen 2.899 N/A PHE 251.A N VAL 272.A O no hydrogen 2.905 N/A ASP 252.A N THR 256.A OG1 no hydrogen 3.245 N/A LYS 254.A NZ ASP 252.A OD1 no hydrogen 3.192 N/A ILE 255.A N ASP 252.A O no hydrogen 2.712 N/A THR 256.A N ASP 252.A O no hydrogen 2.781 N/A THR 256.A OG1 ASP 252.A O no hydrogen 3.244 N/A CYS 257.A N PRO 253.A O no hydrogen 2.977 N/A CYS 257.A SG PRO 253.A O no hydrogen 3.407 N/A CYS 257.A SG LYS 254.A O no hydrogen 3.751 N/A LYS 258.A N ILE 255.A O no hydrogen 3.095 N/A GLN 259.A N THR 256.A O no hydrogen 3.054 N/A LEU 262.A N GLN 267.A OE1 no hydrogen 3.311 N/A THR 265.A OG1 PHE 266.A O no hydrogen 3.067 N/A GLN 267.A N GLU 237.A OE1 no hydrogen 2.937 N/A GLN 267.A NE2 LEU 262.A O no hydrogen 2.956 N/A TYR 270.A N LYS 247.A O no hydrogen 2.909 N/A TYR 270.A OH GLU 237.A OE1 no hydrogen 2.595 N/A VAL 272.A N LYS 249.A O no hydrogen 2.856 N/A SER 273.A N LEU 217.A O no hydrogen 2.763 N/A ASP 278.A N SER 275.A OG no hydrogen 2.914 N/A ALA 279.A N SER 275.A O no hydrogen 3.053 N/A LYS 280.A N PHE 276.A O no hydrogen 3.013 N/A LYS 280.A NZ GLU 277.A OE1 no hydrogen 2.497 N/A LYS 280.A NZ GLU 277.A OE2 no hydrogen 3.036 N/A GLU 281.A N GLU 277.A O no hydrogen 2.981 N/A LYS 282.A N ASP 278.A O no hydrogen 2.895 N/A LYS 282.A NZ ASP 278.A OD2 no hydrogen 3.218 N/A MET 283.A N ALA 279.A O no hydrogen 2.932 N/A ARG 284.A N LYS 280.A O no hydrogen 2.992 N/A ARG 284.A NE GLU 189.A OE1 no hydrogen 2.917 N/A ARG 284.A NH2 GLU 189.A OE2 no hydrogen 2.786 N/A GLU 285.A N GLU 281.A O no hydrogen 3.174 N/A PHE 286.A N LYS 282.A O no hydrogen 3.038 N/A THR 287.A N MET 283.A O no hydrogen 2.840 N/A THR 287.A OG1 MET 283.A O no hydrogen 3.285 N/A THR 287.A OG1 ARG 284.A O no hydrogen 3.194 N/A LYS 288.A N ARG 284.A O no hydrogen 3.430 N/A THR 289.A N PHE 286.A O no hydrogen 2.942 N/A THR 289.A OG1 PHE 286.A O no hydrogen 2.659 N/A ILE 290.A N THR 287.A O no hydrogen 3.178 N/A LYS 291.A NZ ALA 193.A O no hydrogen 2.629 N/A LYS 291.A NZ LEU 195.A O no hydrogen 2.651 N/A