Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8ao3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N GLN 7.A O no hydrogen 3.146 N/A GLN 7.A NE2 ARG 5.A O no hydrogen 3.549 N/A PHE 9.A N GLU 2.A O no hydrogen 2.928 N/A ASP 10.A N TYR 92.A OH no hydrogen 3.008 N/A ARG 14.A NE ASP 34.A OD1 no hydrogen 2.853 N/A ARG 14.A NH2 ASP 34.A OD1 no hydrogen 3.467 N/A ARG 14.A NH2 ASP 34.A OD2 no hydrogen 2.987 N/A TYR 15.A OH ASP 78.A OD2 no hydrogen 2.703 N/A THR 16.A N TYR 33.A O no hydrogen 3.017 N/A SER 19.A N SER 31.A O no hydrogen 2.923 N/A TYR 20.A OH GLU 23.A OE2 no hydrogen 2.817 N/A ILE 21.A N VAL 29.A O no hydrogen 2.855 N/A GLY 22.A N VAL 29.A O no hydrogen 3.210 N/A GLY 24.A N GLY 27.A O no hydrogen 2.767 N/A VAL 29.A N GLY 22.A O no hydrogen 2.862 N/A CYS 30.A N ILE 43.A O no hydrogen 2.856 N/A SER 31.A N SER 19.A O no hydrogen 2.908 N/A ALA 32.A N VAL 41.A O no hydrogen 3.039 N/A TYR 33.A N THR 16.A O no hydrogen 2.721 N/A ASP 34.A N VAL 39.A O no hydrogen 2.861 N/A ASN 35.A N ARG 14.A O no hydrogen 2.939 N/A ASN 35.A ND2 ARG 14.A O no hydrogen 2.848 N/A ASN 35.A ND2 THR 16.A OG1 no hydrogen 2.923 N/A VAL 36.A N ASP 34.A OD1 no hydrogen 2.902 N/A ASN 37.A N ASP 34.A OD1 no hydrogen 3.279 N/A LYS 38.A N ASP 34.A O no hydrogen 2.801 N/A LYS 38.A NZ ASN 35.A O no hydrogen 2.808 N/A ARG 40.A NH1 ASN 17.A O no hydrogen 3.055 N/A ARG 40.A NH2 ASN 17.A O no hydrogen 2.843 N/A ARG 40.A NH2 SER 31.A OG no hydrogen 2.875 N/A VAL 41.A N ALA 32.A O no hydrogen 2.822 N/A ALA 42.A N GLN 95.A O no hydrogen 2.846 N/A ILE 43.A N CYS 30.A O no hydrogen 2.741 N/A LYS 44.A N ILE 93.A O no hydrogen 3.024 N/A LYS 44.A NZ GLU 61.A OE2 no hydrogen 2.811 N/A LYS 45.A N MET 28.A O no hydrogen 2.877 N/A LYS 45.A NZ VAL 8.A O no hydrogen 2.772 N/A ILE 46.A N VAL 91.A O no hydrogen 2.783 N/A SER 47.A N TYR 26.A O no hydrogen 2.995 N/A SER 47.A OG ASP 90.A OD1 no hydrogen 2.740 N/A HIS 51.A N PRO 48.A O no hydrogen 3.467 N/A CYS 55.A N HIS 51.A O no hydrogen 2.956 N/A CYS 55.A SG PRO 48.A O no hydrogen 3.110 N/A CYS 55.A SG HIS 51.A O no hydrogen 3.292 N/A GLN 56.A N GLN 52.A O no hydrogen 2.849 N/A ARG 57.A N THR 53.A O no hydrogen 3.192 N/A THR 58.A N TYR 54.A O no hydrogen 2.998 N/A THR 58.A OG1 TYR 54.A O no hydrogen 3.014 N/A LEU 59.A N CYS 55.A O no hydrogen 2.937 N/A ARG 60.A N GLN 56.A O no hydrogen 2.860 N/A GLU 61.A N ARG 57.A O no hydrogen 3.155 N/A ILE 62.A N THR 58.A O no hydrogen 3.104 N/A LYS 63.A N LEU 59.A O no hydrogen 2.973 N/A ILE 64.A N ARG 60.A O no hydrogen 2.958 N/A LEU 65.A N GLU 61.A O no hydrogen 2.854 N/A LEU 66.A N ILE 62.A O no hydrogen 3.036 N/A ARG 67.A N LYS 63.A O no hydrogen 3.278 N/A ARG 67.A N ILE 64.A O no hydrogen 3.066 N/A PHE 68.A N ILE 64.A O no hydrogen 2.884 N/A ARG 69.A N TYR 128.A OH no hydrogen 3.077 N/A ASN 72.A N HIS 70.A ND1 no hydrogen 2.923 N/A ASN 72.A ND2 GLN 121.A OE1 no hydrogen 3.217 N/A ASN 72.A ND2 LEU 151.A O no hydrogen 2.993 N/A ILE 73.A N HIS 70.A O no hydrogen 3.087 N/A ILE 74.A N ILE 153.A O no hydrogen 2.943 N/A ASN 77.A N VAL 94.A O no hydrogen 2.812 N/A ASN 77.A ND2 ASP 96.A OD1 no hydrogen 2.922 N/A ASP 78.A N VAL 94.A O no hydrogen 3.469 N/A ILE 80.A N TYR 92.A O no hydrogen 2.802 N/A ARG 81.A NE THR 331.A OG1 no hydrogen 2.786 N/A ARG 81.A NH1 ALA 82.A O no hydrogen 2.905 N/A ARG 81.A NH2 PHE 328.A O no hydrogen 2.941 N/A THR 84.A OG1 GLN 87.A OE1 no hydrogen 2.774 N/A GLU 86.A N GLU 86.A OE2 no hydrogen 2.834 N/A GLN 87.A N THR 84.A O no hydrogen 3.235 N/A GLN 87.A N THR 84.A OG1 no hydrogen 3.191 N/A MET 88.A N ILE 85.A O no hydrogen 3.251 N/A VAL 91.A N ILE 46.A O no hydrogen 2.845 N/A TYR 92.A N ILE 80.A O no hydrogen 2.851 N/A ILE 93.A N LYS 44.A O no hydrogen 2.937 N/A VAL 94.A N ASP 78.A O no hydrogen 2.871 N/A GLN 95.A N ALA 42.A O no hydrogen 2.831 N/A GLN 95.A NE2 GLY 75.A O no hydrogen 3.052 N/A THR 100.A N LEU 146.A O no hydrogen 2.924 N/A THR 100.A OG1 ASP 101.A O no hydrogen 3.547 N/A ASP 101.A N THR 100.A OG1 no hydrogen 2.833 N/A LEU 102.A N LEU 144.A O no hydrogen 2.882 N/A LYS 104.A N ASP 101.A OD1 no hydrogen 2.821 N/A LEU 105.A N ASP 101.A O no hydrogen 2.958 N/A LEU 106.A N LEU 102.A O no hydrogen 2.909 N/A LYS 107.A N TYR 103.A O no hydrogen 3.256 N/A THR 108.A N LEU 105.A O no hydrogen 3.179 N/A THR 108.A OG1 LYS 104.A O no hydrogen 3.153 N/A THR 108.A OG1 LEU 105.A O no hydrogen 3.308 N/A GLN 109.A N LEU 105.A O no hydrogen 2.795 N/A SER 112.A OG HIS 115.A ND1 no hydrogen 2.723 N/A HIS 115.A N SER 112.A OG no hydrogen 2.975 N/A HIS 115.A ND1 SER 112.A OG no hydrogen 2.723 N/A ILE 116.A N SER 112.A O no hydrogen 2.981 N/A TYR 117.A OH ASP 150.A OD1 no hydrogen 3.326 N/A PHE 118.A N HIS 115.A O no hydrogen 2.850 N/A LEU 119.A N ILE 116.A O no hydrogen 2.910 N/A TYR 120.A OH GLU 310.A OE1 no hydrogen 2.647 N/A GLN 121.A N TYR 117.A O no hydrogen 3.071 N/A GLN 121.A NE2 TYR 117.A O no hydrogen 3.505 N/A ILE 122.A N PHE 118.A O no hydrogen 2.951 N/A LEU 123.A N LEU 119.A O no hydrogen 3.019 N/A ARG 124.A N TYR 120.A O no hydrogen 2.837 N/A ARG 124.A NE ASP 309.A O no hydrogen 2.815 N/A ARG 124.A NH1 GLU 71.A OE2 no hydrogen 3.435 N/A ARG 124.A NH1 ASP 309.A O no hydrogen 2.903 N/A ARG 124.A NH1 ASP 309.A OD1 no hydrogen 3.432 N/A ARG 124.A NH2 GLU 71.A OE2 no hydrogen 3.018 N/A ARG 124.A NH2 ASN 72.A OD1 no hydrogen 2.902 N/A GLY 125.A N GLN 121.A O no hydrogen 3.022 N/A LEU 126.A N ILE 122.A O no hydrogen 2.854 N/A LYS 127.A N LEU 123.A O no hydrogen 2.783 N/A LYS 127.A NZ GLU 310.A O no hydrogen 2.779 N/A TYR 128.A N ARG 124.A O no hydrogen 3.446 N/A ILE 129.A N GLY 125.A O no hydrogen 3.097 N/A HIS 130.A N LEU 126.A O no hydrogen 2.940 N/A HIS 130.A NE2 ASP 198.A OD2 no hydrogen 2.768 N/A SER 131.A N LYS 127.A O no hydrogen 2.854 N/A SER 131.A OG TYR 128.A O no hydrogen 2.624 N/A ALA 132.A N TYR 128.A O no hydrogen 3.167 N/A ALA 132.A N ILE 129.A O no hydrogen 3.066 N/A ASN 133.A N HIS 130.A O no hydrogen 2.915 N/A VAL 134.A N ILE 129.A O no hydrogen 3.309 N/A LEU 135.A N ARG 160.A O no hydrogen 2.819 N/A HIS 136.A N ASP 198.A OD2 no hydrogen 2.939 N/A HIS 136.A NE2 CYS 154.A O no hydrogen 2.967 N/A ARG 137.A N ASP 198.A OD1 no hydrogen 2.863 N/A ARG 137.A NE GLY 192.A O no hydrogen 2.841 N/A ARG 137.A NH1 LYS 191.A O no hydrogen 3.206 N/A ARG 137.A NH2 LEU 158.A O no hydrogen 3.015 N/A ASP 138.A N HIS 136.A ND1 no hydrogen 2.950 N/A LYS 140.A NZ THR 178.A OG1 no hydrogen 2.824 N/A ASN 143.A N LYS 140.A O no hydrogen 2.918 N/A ASN 143.A ND2 ASP 138.A O no hydrogen 2.878 N/A LEU 144.A N PRO 141.A O no hydrogen 3.101 N/A LEU 145.A N LYS 152.A O no hydrogen 2.872 N/A LEU 146.A N THR 100.A O no hydrogen 2.909 N/A ASN 147.A N ASP 150.A O no hydrogen 3.096 N/A ASN 147.A ND2 ASP 150.A OD2 no hydrogen 3.046 N/A THR 149.A N ASN 147.A OD1 no hydrogen 3.099 N/A THR 149.A OG1 ASN 147.A OD1 no hydrogen 3.105 N/A THR 149.A OG1 ASP 150.A OD2 no hydrogen 3.140 N/A LEU 151.A N GLN 121.A OE1 no hydrogen 2.884 N/A LYS 152.A N LEU 145.A O no hydrogen 2.962 N/A LYS 152.A NZ GLU 71.A O no hydrogen 2.759 N/A ILE 153.A N ASN 72.A O no hydrogen 2.845 N/A CYS 154.A N ASN 143.A O no hydrogen 2.957 N/A PHE 156.A N GLU 61.A OE1 no hydrogen 3.060 N/A GLY 157.A N ASP 155.A OD1 no hydrogen 2.977 N/A ALA 159.A N PHE 156.A O no hydrogen 3.219 N/A ARG 160.A N LEU 135.A O no hydrogen 3.076 N/A ARG 160.A NH1.B ALA 159.A O no hydrogen 3.359 N/A ALA 162.A N ASN 133.A O no hydrogen 2.846 N/A ASP 163.A N TYR 193.A O no hydrogen 2.858 N/A HIS 166.A N ASP 163.A O no hydrogen 3.014 N/A HIS 166.A ND1 ASP 163.A OD1 no hydrogen 2.850 N/A ASP 167.A N PRO 164.A O no hydrogen 3.280 N/A THR 169.A N ASN 189.A O no hydrogen 2.985 N/A THR 169.A OG1 THR 173.A OG1 no hydrogen 3.227 N/A LEU 172.A N MET 187.A O no hydrogen 3.081 N/A THR 173.A OG1 THR 169.A OG1 no hydrogen 3.227 N/A THR 173.A OG1 GLY 170.A O no hydrogen 2.831 N/A THR 178.A N ASP 138.A OD1 no hydrogen 3.006 N/A THR 178.A OG1 ASP 138.A OD1 no hydrogen 2.690 N/A THR 178.A OG1 ASP 138.A OD2 no hydrogen 3.498 N/A ARG 179.A NH1 GLY 218.A O no hydrogen 3.133 N/A TRP 180.A NE1 GLY 218.A O no hydrogen 2.868 N/A TYR 181.A N THR 178.A O no hydrogen 3.068 N/A TYR 181.A OH GLU 208.A OE1 no hydrogen 2.617 N/A ARG 182.A N ARG 179.A O no hydrogen 3.094 N/A ARG 182.A NE ALA 177.A O no hydrogen 2.962 N/A ARG 182.A NH2 ALA 177.A O no hydrogen 2.899 N/A GLU 185.A N GLU 185.A OE1 no hydrogen 2.846 N/A ILE 186.A N ALA 183.A O no hydrogen 3.060 N/A MET 187.A N PRO 184.A O no hydrogen 3.096 N/A LEU 188.A N GLU 185.A O no hydrogen 3.059 N/A ASN 189.A N GLU 185.A O no hydrogen 2.845 N/A SER 190.A OG ASP 167.A OD1 no hydrogen 3.196 N/A SER 190.A OG ASP 167.A OD2 no hydrogen 2.848 N/A LYS 191.A N ASP 167.A O no hydrogen 2.819 N/A GLY 192.A N SER 190.A OG no hydrogen 3.084 N/A TYR 193.A N ASP 167.A OD1 no hydrogen 2.818 N/A THR 194.A OG1 SER 196.A OG no hydrogen 2.887 N/A LYS 195.A NZ HIS 130.A O no hydrogen 3.043 N/A SER 196.A OG THR 194.A OG1 no hydrogen 2.887 N/A ILE 197.A N THR 194.A O no hydrogen 3.065 N/A ASP 198.A N LYS 195.A O no hydrogen 3.061 N/A ILE 199.A N LYS 195.A O no hydrogen 3.445 N/A TRP 200.A N SER 196.A O no hydrogen 3.192 N/A SER 201.A N ILE 197.A O no hydrogen 3.449 N/A SER 201.A OG TYR 181.A O no hydrogen 2.846 N/A SER 201.A OG ILE 197.A O no hydrogen 3.395 N/A VAL 202.A N ASP 198.A O no hydrogen 2.962 N/A GLY 203.A N ILE 199.A O no hydrogen 2.958 N/A CYS 204.A N TRP 200.A O no hydrogen 2.993 N/A CYS 204.A SG TRP 180.A O no hydrogen 3.852 N/A CYS 204.A SG TRP 200.A O no hydrogen 3.576 N/A ILE 205.A N SER 201.A O no hydrogen 2.935 N/A LEU 206.A N VAL 202.A O no hydrogen 2.830 N/A ALA 207.A N GLY 203.A O no hydrogen 2.932 N/A GLU 208.A N CYS 204.A O no hydrogen 2.998 N/A MET 209.A N ILE 205.A O no hydrogen 2.879 N/A LEU 210.A N LEU 206.A O no hydrogen 3.103 N/A LEU 210.A N ALA 207.A O no hydrogen 3.083 N/A SER 211.A OG ALA 207.A O no hydrogen 3.452 N/A SER 211.A OG ARG 213.A O no hydrogen 3.362 N/A ASN 212.A N GLU 208.A O no hydrogen 2.844 N/A ASN 212.A ND2 LEU 106.A O no hydrogen 2.868 N/A ASN 212.A ND2 GLN 109.A O no hydrogen 2.816 N/A ARG 213.A N SER 211.A OG no hydrogen 3.346 N/A GLY 218.A N PHE 216.A O no hydrogen 2.941 N/A GLY 218.A N GLN 224.A OE1 no hydrogen 3.065 N/A LYS 219.A N ASP 223.A OD2 no hydrogen 2.825 N/A TYR 221.A OH THR 173.A O no hydrogen 2.690 N/A GLN 224.A N HIS 220.A O no hydrogen 3.067 N/A GLN 224.A NE2 PHE 216.A O no hydrogen 2.827 N/A ASN 226.A N LEU 222.A O no hydrogen 3.353 N/A HIS 227.A N ASP 223.A O no hydrogen 3.094 N/A ILE 228.A N GLN 224.A O no hydrogen 3.200 N/A LEU 229.A N LEU 225.A O no hydrogen 2.948 N/A GLY 230.A N ASN 226.A O no hydrogen 2.930 N/A ILE 231.A N ILE 228.A O no hydrogen 3.136 N/A LEU 232.A N ILE 228.A O no hydrogen 2.942 N/A GLY 233.A N LEU 229.A O no hydrogen 2.802 N/A SER 234.A N LYS 258.A O no hydrogen 2.944 N/A SER 234.A OG LYS 258.A O no hydrogen 3.409 N/A ASP 239.A N SER 236.A OG no hydrogen 3.132 N/A LEU 240.A N SER 236.A O no hydrogen 2.912 N/A ASN 241.A N GLN 237.A O no hydrogen 2.818 N/A ASN 241.A ND2 GLN 237.A OE1 no hydrogen 2.945 N/A CYS 242.A N GLU 238.A O no hydrogen 3.201 N/A CYS 242.A SG GLU 238.A O no hydrogen 3.317 N/A ILE 243.A N LEU 240.A O no hydrogen 2.921 N/A ALA 248.A N ASN 245.A OD1 no hydrogen 3.326 N/A ARG 249.A N ASN 245.A O no hydrogen 2.928 N/A ASN 250.A N LEU 246.A O no hydrogen 2.840 N/A TYR 251.A N LYS 247.A O no hydrogen 3.028 N/A TYR 251.A OH ASN 226.A OD1 no hydrogen 2.806 N/A LEU 252.A N ALA 248.A O no hydrogen 3.208 N/A LEU 253.A N ARG 249.A O no hydrogen 3.005 N/A SER 254.A N ASN 250.A O no hydrogen 2.959 N/A SER 254.A N TYR 251.A O no hydrogen 3.106 N/A SER 254.A OG TYR 251.A O no hydrogen 2.612 N/A LEU 255.A N LEU 252.A O no hydrogen 3.276 N/A HIS 257.A NE2 ASN 259.A OD1 no hydrogen 3.006 N/A LYS 258.A N SER 234.A OG no hydrogen 2.857 N/A LYS 260.A NZ ASP 279.A OD1 no hydrogen 3.432 N/A VAL 261.A N ILE 231.A O no hydrogen 2.774 N/A TRP 263.A NE1 ASP 279.A OD1 no hydrogen 2.770 N/A ARG 265.A N PRO 262.A O no hydrogen 2.940 N/A LEU 266.A N PRO 262.A O no hydrogen 3.212 N/A PHE 267.A N TRP 263.A O no hydrogen 2.786 N/A ALA 270.A N PHE 267.A O no hydrogen 3.150 N/A LYS 273.A N ASP 271.A OD1 no hydrogen 2.771 N/A ALA 274.A N ASP 271.A OD1 no hydrogen 3.252 N/A LEU 275.A N ASP 271.A O no hydrogen 3.173 N/A ASP 276.A N SER 272.A O no hydrogen 3.060 N/A LEU 277.A N LYS 273.A O no hydrogen 3.058 N/A LEU 278.A N ALA 274.A O no hydrogen 2.830 N/A ASP 279.A N LEU 275.A O no hydrogen 3.023 N/A LYS 280.A N ASP 276.A O no hydrogen 3.263 N/A LYS 280.A NZ ASP 276.A OD1 no hydrogen 3.322 N/A LYS 280.A NZ ASP 276.A OD2 no hydrogen 3.049 N/A MET 281.A N LEU 277.A O no hydrogen 2.942 N/A LEU 282.A N LEU 278.A O no hydrogen 2.802 N/A THR 283.A OG1 ASP 279.A O no hydrogen 3.029 N/A THR 283.A OG1 LYS 280.A O no hydrogen 3.109 N/A ASN 285.A ND2 ASP 239.A OD1 no hydrogen 3.004 N/A HIS 287.A N ASN 285.A OD1 no hydrogen 3.021 N/A HIS 287.A ND1 ASN 285.A OD1 no hydrogen 3.190 N/A LYS 288.A N ASN 285.A O no hydrogen 2.943 N/A LYS 288.A NZ GLU 238.A OE2 no hydrogen 2.678 N/A LYS 288.A NZ ASP 239.A OD1 no hydrogen 2.745 N/A ARG 289.A NE THR 283.A O no hydrogen 2.950 N/A ARG 289.A NH1 GLU 185.A OE2 no hydrogen 2.750 N/A ARG 289.A NH1 SER 196.A O no hydrogen 2.920 N/A ARG 289.A NH2 GLU 185.A OE1 no hydrogen 2.858 N/A ARG 289.A NH2 GLU 185.A OE2 no hydrogen 3.468 N/A ARG 289.A NH2 THR 283.A O no hydrogen 2.970 N/A ARG 289.A NH2 PHE 284.A O no hydrogen 3.165 N/A ILE 290.A N LYS 280.A O no hydrogen 3.196 N/A GLU 291.A N GLN 294.A OE1 no hydrogen 2.920 N/A ALA 295.A N GLU 291.A O no hydrogen 2.913 N/A LEU 296.A N VAL 292.A O no hydrogen 3.077 N/A ALA 297.A N GLU 293.A O no hydrogen 3.318 N/A HIS 298.A N ALA 295.A O no hydrogen 3.073 N/A HIS 298.A NE2 ASP 276.A OD2 no hydrogen 2.723 N/A TYR 300.A N HIS 298.A ND1 no hydrogen 2.979 N/A TYR 300.A OH ASN 113.A OD1 no hydrogen 2.875 N/A LEU 301.A N HIS 298.A O no hydrogen 2.924 N/A GLU 302.A N PRO 299.A O no hydrogen 3.215 N/A TYR 304.A N LEU 301.A O no hydrogen 3.009 N/A TYR 305.A N LEU 301.A O no hydrogen 2.976 N/A ASP 306.A N GLU 310.A OE1 no hydrogen 2.846 N/A SER 308.A OG ASP 306.A OD1 no hydrogen 2.792 N/A ASP 309.A N ASP 306.A O no hydrogen 2.786 N/A GLU 310.A N PRO 307.A O no hydrogen 3.200 N/A ALA 313.A N SER 131.A OG no hydrogen 2.819 N/A PHE 317.A N ALA 132.A O no hydrogen 2.793 N/A LYS 320.A NZ GLU 50.A O no hydrogen 3.490 N/A GLU 321.A N GLU 321.A OE1 no hydrogen 2.860 N/A LEU 323.A N PRO 319.A O no hydrogen 2.892 N/A LYS 324.A N LYS 320.A O no hydrogen 2.826 N/A LYS 324.A NZ ILE 85.A O no hydrogen 2.789 N/A LYS 324.A NZ MET 88.A O no hydrogen 2.954 N/A GLU 325.A N GLU 321.A O no hydrogen 3.172 N/A LEU 326.A N LYS 322.A O no hydrogen 2.894 N/A ILE 327.A N LEU 323.A O no hydrogen 2.865 N/A PHE 328.A N LYS 324.A O no hydrogen 2.878 N/A GLU 329.A N GLU 325.A O no hydrogen 2.964 N/A GLU 330.A N LEU 326.A O no hydrogen 2.956 N/A THR 331.A N ILE 327.A O no hydrogen 3.154 N/A THR 331.A OG1 ILE 327.A O no hydrogen 2.954 N/A THR 331.A OG1 PHE 328.A O no hydrogen 3.114 N/A ALA 332.A N GLU 329.A O no hydrogen 3.288 N/A ARG 333.A NH2 GLU 330.A O no hydrogen 3.449 N/A PHE 334.A N THR 331.A O no hydrogen 3.263 N/A GLN 335.A N ALA 332.A O no hydrogen 3.139 N/A