Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ur8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 3.A N ASN 315.A OD1 no hydrogen 3.068 N/A GLY 4.A N THR 279.A O no hydrogen 2.838 N/A VAL 5.A N LYS 31.A O no hydrogen 3.023 N/A CYS 6.A N LEU 281.A O no hydrogen 2.784 N/A CYS 6.A SG TYR 35.A OH no hydrogen 3.412 N/A CYS 6.A SG SER 235.A O no hydrogen 3.364 N/A CYS 6.A SG TYR 280.A O no hydrogen 3.970 N/A CYS 6.A SG LEU 281.A O no hydrogen 3.450 N/A TYR 7.A N ARG 33.A O no hydrogen 2.797 N/A TYR 7.A OH ASP 17.A OD1 no hydrogen 2.582 N/A LYS 9.A NZ ASP 17.A OD1 no hydrogen 2.816 N/A ILE 10.A N GLU 287.A OE1 no hydrogen 2.919 N/A ALA 11.A N LYS 9.A O no hydrogen 2.957 N/A ASN 12.A N ASN 288.A OD1 no hydrogen 2.995 N/A ASP 19.A N SER 16.A OG no hydrogen 3.046 N/A VAL 20.A N SER 16.A O no hydrogen 2.951 N/A ILE 21.A N ASP 17.A O no hydrogen 2.972 N/A LYS 22.A N GLN 18.A O no hydrogen 3.039 N/A LYS 22.A NZ ASP 19.A OD1 no hydrogen 3.508 N/A LEU 23.A N ASP 19.A O no hydrogen 2.950 N/A TYR 24.A N VAL 20.A O no hydrogen 2.902 N/A TYR 24.A OH VAL 5.A O no hydrogen 2.782 N/A ASN 25.A N ILE 21.A O no hydrogen 2.964 N/A ALA 26.A N LYS 22.A O no hydrogen 2.809 N/A ASN 27.A N LEU 23.A O no hydrogen 3.135 N/A ASN 27.A N TYR 24.A O no hydrogen 3.130 N/A ASN 27.A ND2 LEU 23.A O no hydrogen 2.960 N/A ASN 28.A N ASN 25.A O no hydrogen 3.012 N/A ASN 28.A ND2 ASN 315.A O no hydrogen 2.987 N/A ASN 28.A ND2 LEU 316.A O no hydrogen 3.141 N/A ILE 29.A N TYR 24.A O no hydrogen 2.967 N/A LYS 30.A NZ ASN 25.A OD1 no hydrogen 3.084 N/A LYS 30.A NZ SER 48.A O no hydrogen 2.687 N/A LYS 31.A NZ GLN 1.A O no hydrogen 2.799 N/A LYS 31.A NZ GLU 51.A OE1 no hydrogen 3.135 N/A MET 32.A N GLU 51.A O no hydrogen 2.807 N/A ARG 33.A N VAL 5.A O no hydrogen 3.277 N/A ARG 33.A NE ASP 55.A OD1 no hydrogen 2.821 N/A ARG 33.A NH1 ASN 176.A OD1 no hydrogen 3.040 N/A ARG 33.A NH1 SER 235.A O no hydrogen 3.121 N/A ARG 33.A NH2 ASP 55.A OD1 no hydrogen 3.304 N/A ARG 33.A NH2 ASP 55.A OD2 no hydrogen 2.865 N/A ARG 33.A NH2 ASN 94.A OD1 no hydrogen 2.961 N/A ARG 33.A NH2 SER 134.A OG no hydrogen 3.299 N/A ILE 34.A N ILE 53.A O no hydrogen 2.891 N/A TYR 35.A OH GLU 236.A OE2 no hydrogen 2.618 N/A HIS 38.A N TYR 36.A O no hydrogen 2.767 N/A ASN 40.A ND2 ASP 17.A OD2 no hydrogen 2.833 N/A ASN 40.A ND2 GLN 18.A OE1 no hydrogen 3.270 N/A PHE 42.A N HIS 38.A O no hydrogen 3.040 N/A ASN 43.A N THR 39.A O no hydrogen 2.968 N/A ALA 44.A N ASN 40.A O no hydrogen 2.946 N/A LEU 45.A N VAL 41.A O no hydrogen 2.882 N/A LEU 45.A N PHE 42.A O no hydrogen 3.203 N/A LYS 46.A N ASN 43.A O no hydrogen 3.267 N/A GLY 47.A N ASP 84.A O no hydrogen 2.893 N/A SER 48.A N LEU 45.A O no hydrogen 2.903 N/A SER 48.A OG LEU 45.A O no hydrogen 2.842 N/A ILE 50.A N SER 48.A OG no hydrogen 3.186 N/A GLU 51.A N LYS 30.A O no hydrogen 2.815 N/A ILE 52.A N LYS 86.A O no hydrogen 2.958 N/A ILE 53.A N MET 32.A O no hydrogen 2.878 N/A LEU 54.A N TYR 89.A O no hydrogen 2.956 N/A ASP 55.A N ILE 34.A O no hydrogen 3.001 N/A VAL 56.A N ALA 91.A O no hydrogen 2.858 N/A ASN 58.A ND2 ASN 94.A O no hydrogen 3.044 N/A GLN 59.A N GLN 59.A OE1 no hydrogen 2.789 N/A ASP 60.A N PRO 57.A O no hydrogen 2.865 N/A LEU 61.A N ASN 58.A O no hydrogen 3.211 N/A LEU 64.A N LEU 61.A O no hydrogen 2.968 N/A ALA 65.A N GLU 62.A O no hydrogen 3.058 N/A ASN 66.A N ALA 63.A O no hydrogen 3.375 N/A SER 68.A N ASN 66.A OD1 no hydrogen 2.947 N/A ASN 69.A ND2 ALA 63.A O no hydrogen 2.923 N/A ALA 70.A N ASN 66.A O no hydrogen 3.080 N/A ASN 71.A N PRO 67.A O no hydrogen 2.761 N/A GLY 72.A N SER 68.A O no hydrogen 2.925 N/A TRP 73.A N ASN 69.A O no hydrogen 2.874 N/A TRP 73.A NE1 ASP 60.A OD2 no hydrogen 3.152 N/A VAL 74.A N ALA 70.A O no hydrogen 2.998 N/A GLN 75.A N ASN 71.A O no hydrogen 2.868 N/A GLN 75.A NE2 ASN 80.A OD1 no hydrogen 2.710 N/A ASP 76.A N GLY 72.A O no hydrogen 2.805 N/A ASN 77.A N TRP 73.A O no hydrogen 2.960 N/A ASN 77.A ND2 TRP 73.A O no hydrogen 3.292 N/A ILE 78.A N VAL 74.A O no hydrogen 2.912 N/A ARG 79.A N VAL 74.A O no hydrogen 2.848 N/A ASN 80.A N GLN 75.A O no hydrogen 2.886 N/A HIS 81.A N ILE 78.A O no hydrogen 2.936 N/A HIS 81.A ND1 ASN 77.A O no hydrogen 3.050 N/A PHE 82.A N ARG 79.A O no hydrogen 3.358 N/A VAL 85.A N HIS 81.A O no hydrogen 2.704 N/A LYS 86.A NZ ASN 49.A OD1 no hydrogen 3.172 N/A PHE 87.A N VAL 85.A O no hydrogen 2.966 N/A LYS 88.A N ILE 52.A O no hydrogen 2.875 N/A LYS 88.A NZ.B GLU 51.A OE1 no hydrogen 2.926 N/A LYS 88.A NZ.B GLU 278.A OE1 no hydrogen 3.236 N/A LYS 88.A NZ.B GLU 278.A OE2 no hydrogen 2.901 N/A TYR 89.A N ILE 52.A O no hydrogen 3.114 N/A TYR 89.A OH GLU 278.A OE1 no hydrogen 2.683 N/A ILE 90.A N LYS 130.A O no hydrogen 2.891 N/A ALA 91.A N LEU 54.A O no hydrogen 2.889 N/A VAL 92.A N SER 132.A O no hydrogen 2.831 N/A GLY 93.A N VAL 56.A O no hydrogen 3.409 N/A ASN 94.A N ASN 58.A OD1 no hydrogen 2.874 N/A GLU 95.A N SER 134.A O no hydrogen 2.821 N/A ASP 97.A N SER 102.A OG no hydrogen 2.985 N/A GLY 99.A N ASP 97.A OD1 no hydrogen 2.870 N/A ARG 100.A N ASP 97.A O no hydrogen 2.940 N/A SER 102.A OG GLU 95.A O no hydrogen 3.020 N/A GLY 103.A N ARG 100.A O no hydrogen 2.884 N/A LYS 104.A N GLU 101.A O no hydrogen 3.173 N/A LYS 104.A NZ GLU 101.A OE2 no hydrogen 2.776 N/A TYR 105.A N SER 102.A O no hydrogen 2.942 N/A ALA 106.A N GLY 103.A O no hydrogen 3.032 N/A PHE 108.A N TYR 105.A O no hydrogen 2.939 N/A VAL 109.A N ALA 106.A O no hydrogen 3.305 N/A ALA 112.A N PHE 108.A O no hydrogen 3.188 N/A MET 113.A N VAL 109.A O no hydrogen 2.886 N/A GLU 114.A N GLY 110.A O no hydrogen 2.928 N/A ASN 115.A N PRO 111.A O no hydrogen 2.938 N/A ASN 115.A ND2 LEU 64.A O no hydrogen 2.795 N/A ASN 115.A ND2 ALA 65.A O no hydrogen 2.939 N/A ILE 116.A N ALA 112.A O no hydrogen 2.849 N/A TYR 117.A N MET 113.A O no hydrogen 2.932 N/A ASN 118.A N GLU 114.A O no hydrogen 2.914 N/A ALA 119.A N ASN 115.A O no hydrogen 2.938 N/A LEU 120.A N ILE 116.A O no hydrogen 2.877 N/A SER 121.A N TYR 117.A O no hydrogen 2.824 N/A SER 121.A OG TYR 117.A O no hydrogen 2.851 N/A SER 122.A N ASN 118.A O no hydrogen 2.956 N/A SER 122.A OG.A ASN 118.A O no hydrogen 3.312 N/A ALA 123.A N ALA 119.A O no hydrogen 3.278 N/A GLY 124.A N SER 121.A O no hydrogen 2.964 N/A LEU 125.A N LEU 120.A O no hydrogen 2.840 N/A GLN 126.A N GLN 126.A OE1 no hydrogen 2.762 N/A GLN 128.A NE2 GLY 124.A O no hydrogen 3.461 N/A ILE 129.A N LEU 125.A O no hydrogen 2.883 N/A LYS 130.A N LYS 88.A O no hydrogen 2.952 N/A LYS 130.A NZ ASN 127.A O no hydrogen 2.847 N/A SER 132.A N ILE 90.A O no hydrogen 2.861 N/A SER 132.A OG THR 133.A O no hydrogen 3.259 N/A SER 132.A OG PRO 172.A O no hydrogen 2.618 N/A THR 133.A OG1 VAL 92.A O no hydrogen 2.723 N/A THR 133.A OG1 GLY 93.A O no hydrogen 3.346 N/A SER 134.A N GLY 93.A O no hydrogen 3.003 N/A SER 134.A OG ASN 94.A OD1 no hydrogen 3.155 N/A SER 134.A OG SER 235.A OG no hydrogen 3.010 N/A THR 135.A N LEU 174.A O no hydrogen 2.828 N/A TYR 136.A OH ASP 97.A OD2 no hydrogen 2.503 N/A LEU 139.A N TYR 136.A O no hydrogen 3.207 N/A LEU 140.A N SER 137.A O no hydrogen 2.935 N/A THR 141.A N ILE 150.A O no hydrogen 2.885 N/A ASP 148.A N PRO 145.A O no hydrogen 2.949 N/A SER 149.A N PRO 146.A O no hydrogen 2.949 N/A SER 149.A OG PRO 146.A O no hydrogen 2.688 N/A SER 149.A OG SER 217.A OG.A no hydrogen 2.498 N/A SER 149.A OG SER 217.A OG.B no hydrogen 3.006 N/A ILE 150.A N THR 141.A O no hydrogen 2.994 N/A ARG 152.A N LEU 139.A O no hydrogen 2.901 N/A ARG 152.A NE LEU 140.A O no hydrogen 2.985 N/A ARG 152.A NH2 LEU 140.A O no hydrogen 3.265 N/A GLU 154.A N GLU 154.A OE1 no hydrogen 2.717 N/A TYR 155.A N ARG 152.A O no hydrogen 2.963 N/A LYS 156.A N GLU 153.A O no hydrogen 3.076 N/A PHE 158.A N TYR 155.A O no hydrogen 2.908 N/A ILE 159.A N TYR 155.A O no hydrogen 2.898 N/A ILE 163.A N ILE 159.A O no hydrogen 3.019 N/A GLY 164.A N ASN 160.A O no hydrogen 2.932 N/A PHE 165.A N PRO 161.A O no hydrogen 2.917 N/A LEU 166.A N ILE 162.A O no hydrogen 3.018 N/A ALA 167.A N ILE 163.A O no hydrogen 2.836 N/A ARG 168.A N GLY 164.A O no hydrogen 2.985 N/A HIS 169.A N PHE 165.A O no hydrogen 3.157 N/A HIS 169.A N LEU 166.A O no hydrogen 3.245 N/A HIS 169.A ND1 PHE 165.A O no hydrogen 2.740 N/A ASN 170.A N ALA 167.A O no hydrogen 3.337 N/A LEU 171.A N LEU 166.A O no hydrogen 2.986 N/A LEU 173.A N GLU 231.A O no hydrogen 2.892 N/A LEU 174.A N SER 132.A OG no hydrogen 3.286 N/A LEU 174.A N THR 133.A O no hydrogen 3.246 N/A ALA 175.A N ILE 233.A O no hydrogen 2.879 N/A ASN 176.A N THR 135.A O no hydrogen 2.854 N/A ASN 176.A ND2 ASN 94.A OD1 no hydrogen 3.053 N/A ASN 176.A ND2 GLU 95.A OE2 no hydrogen 2.877 N/A ILE 177.A N GLU 236.A O no hydrogen 2.887 N/A TYR 178.A OH GLU 236.A OE1 no hydrogen 2.676 N/A GLY 182.A N TYR 178.A O no hydrogen 3.170 N/A HIS 183.A N PRO 179.A O no hydrogen 2.877 N/A HIS 183.A ND1 VAL 190.A O no hydrogen 2.747 N/A ILE 184.A N TYR 180.A O no hydrogen 2.960 N/A ASP 185.A N PHE 181.A O no hydrogen 2.881 N/A ASN 186.A N GLY 182.A O no hydrogen 3.207 N/A ASN 186.A N HIS 183.A O no hydrogen 3.226 N/A ALA 189.A N ASN 186.A OD1 no hydrogen 2.825 N/A VAL 190.A N ASN 186.A O no hydrogen 2.851 N/A ALA 195.A N PRO 191.A O no hydrogen 3.337 N/A LEU 196.A N LEU 192.A O no hydrogen 2.980 N/A LEU 196.A N SER 193.A O no hydrogen 3.240 N/A ASN 198.A N SER 193.A O no hydrogen 3.112 N/A GLN 199.A NE2 ARG 201.A O no hydrogen 2.793 N/A GLN 199.A NE2 TYR 207.A O no hydrogen 3.413 N/A GLN 200.A NE2 ASN 198.A O no hydrogen 2.863 N/A ARG 202.A NH1 GLY 206.A O no hydrogen 2.923 N/A ASN 203.A N TYR 207.A O no hydrogen 2.850 N/A ASN 203.A ND2 TYR 194.A OH no hydrogen 3.296 N/A THR 205.A N ASN 203.A OD1 no hydrogen 2.964 N/A THR 205.A OG1 ASN 203.A OD1 no hydrogen 2.988 N/A GLY 206.A N ASN 203.A O no hydrogen 2.980 N/A TYR 207.A N ASN 203.A OD1 no hydrogen 3.108 N/A TYR 207.A OH ASP 216.A OD2 no hydrogen 2.596 N/A GLN 208.A NE2 PHE 197.A O no hydrogen 2.989 N/A GLN 208.A NE2 GLN 199.A O no hydrogen 2.846 N/A ASN 209.A ND2 GLN 208.A OE1 no hydrogen 2.927 N/A ASN 209.A ND2 ASP 212.A OD2 no hydrogen 2.944 N/A LEU 210.A N TYR 194.A O no hydrogen 3.014 N/A ASP 212.A N ASN 209.A OD1 no hydrogen 2.823 N/A LEU 214.A N LEU 210.A O no hydrogen 2.809 N/A VAL 215.A N PHE 211.A O no hydrogen 2.976 N/A ASP 216.A N ASP 212.A O no hydrogen 2.900 N/A SER 217.A N ALA 213.A O no hydrogen 2.816 N/A SER 217.A OG.A SER 149.A OG no hydrogen 2.498 N/A SER 217.A OG.B SER 149.A OG no hydrogen 3.006 N/A SER 217.A OG.B ALA 213.A O no hydrogen 2.964 N/A MET 218.A N LEU 214.A O no hydrogen 3.289 N/A TYR 219.A N VAL 215.A O no hydrogen 3.031 N/A PHE 220.A N ASP 216.A O no hydrogen 2.797 N/A ALA 221.A N SER 217.A O no hydrogen 3.027 N/A THR 222.A N MET 218.A O no hydrogen 2.908 N/A THR 222.A OG1 MET 218.A O no hydrogen 3.207 N/A THR 222.A OG1 TYR 219.A O no hydrogen 3.135 N/A GLU 223.A N TYR 219.A O no hydrogen 2.968 N/A LYS 224.A N PHE 220.A O no hydrogen 3.236 N/A LYS 224.A NZ ARG 147.A O no hydrogen 2.790 N/A LYS 224.A NZ SER 149.A O no hydrogen 2.785 N/A LEU 225.A N THR 222.A O no hydrogen 2.998 N/A GLY 226.A N GLU 223.A O no hydrogen 2.981 N/A GLY 227.A N THR 222.A O no hydrogen 2.870 N/A ILE 230.A N GLY 227.A O no hydrogen 2.966 N/A ILE 232.A N TYR 219.A OH no hydrogen 3.007 N/A ILE 233.A N LEU 173.A O no hydrogen 2.955 N/A VAL 234.A N GLU 278.A O no hydrogen 2.890 N/A SER 235.A N ALA 175.A O no hydrogen 2.866 N/A SER 235.A OG SER 134.A OG no hydrogen 3.010 N/A SER 235.A OG ASN 176.A OD1 no hydrogen 2.692 N/A SER 237.A OG ILE 177.A O no hydrogen 2.703 N/A SER 237.A OG TYR 255.A OH no hydrogen 2.645 N/A TRP 239.A N TYR 256.A OH no hydrogen 3.016 N/A TRP 239.A NE1 ALA 246.A O no hydrogen 2.926 N/A SER 241.A N HIS 298.A O no hydrogen 2.996 N/A SER 241.A OG HIS 298.A O no hydrogen 3.416 N/A ALA 246.A N HIS 244.A ND1 no hydrogen 2.928 N/A ALA 247.A N HIS 244.A O no hydrogen 2.875 N/A ASN 251.A N THR 248.A OG1 no hydrogen 2.895 N/A ASN 251.A ND2 ALA 246.A O no hydrogen 2.941 N/A ALA 252.A N THR 248.A O no hydrogen 2.894 N/A ARG 253.A N LEU 249.A O no hydrogen 2.897 N/A THR 254.A N LYS 250.A O no hydrogen 2.969 N/A THR 254.A OG1 LYS 250.A O no hydrogen 2.838 N/A TYR 255.A N ASN 251.A O no hydrogen 2.883 N/A TYR 255.A OH SER 237.A OG no hydrogen 2.645 N/A TYR 256.A N ALA 252.A O no hydrogen 2.957 N/A TYR 256.A OH TRP 239.A O no hydrogen 3.236 N/A TYR 256.A OH PHE 282.A O no hydrogen 2.649 N/A THR 257.A N ARG 253.A O no hydrogen 2.968 N/A THR 257.A OG1 ARG 253.A O no hydrogen 2.713 N/A ASN 258.A N THR 254.A O no hydrogen 2.898 N/A ASN 258.A ND2 LEU 196.A O no hydrogen 2.887 N/A LEU 259.A N TYR 255.A O no hydrogen 2.805 N/A ILE 260.A N TYR 256.A O no hydrogen 2.916 N/A ASN 261.A N THR 257.A O no hydrogen 3.034 N/A HIS 262.A N ASN 258.A O no hydrogen 2.899 N/A HIS 262.A NE2 ASP 212.A OD1 no hydrogen 2.666 N/A VAL 263.A N LEU 259.A O no hydrogen 2.891 N/A LYS 264.A N ILE 260.A O no hydrogen 2.899 N/A LYS 264.A NZ ASN 313.A O no hydrogen 3.183 N/A LYS 264.A NZ ASN 313.A OD1 no hydrogen 2.793 N/A ARG 265.A N ASN 261.A O no hydrogen 3.029 N/A ARG 265.A N HIS 262.A O no hydrogen 3.267 N/A GLY 266.A N VAL 263.A O no hydrogen 3.083 N/A THR 269.A N LYS 272.A O no hydrogen 3.115 N/A THR 269.A OG1 ASP 216.A OD1 no hydrogen 2.569 N/A THR 269.A OG1 ASP 216.A OD2 no hydrogen 3.406 N/A LYS 271.A N ASP 216.A OD2 no hydrogen 2.907 N/A LYS 271.A NZ GLU 223.A OE1 no hydrogen 2.975 N/A LYS 272.A N THR 269.A OG1 no hydrogen 2.967 N/A LYS 272.A NZ GLN 228.A O no hydrogen 3.385 N/A GLY 274.A N ALA 267.A O no hydrogen 2.925 N/A THR 279.A N PRO 2.A O no hydrogen 3.056 N/A THR 279.A OG1 ILE 277.A O no hydrogen 2.908 N/A TYR 280.A N VAL 234.A O no hydrogen 2.855 N/A TYR 280.A OH GLU 278.A OE2 no hydrogen 2.802 N/A LEU 281.A N GLY 4.A O no hydrogen 2.824 N/A PHE 282.A N SER 237.A O no hydrogen 2.856 N/A ALA 283.A N PHE 299.A O no hydrogen 3.006 N/A MET 284.A N CYS 6.A O no hydrogen 2.836 N/A ASP 286.A N PHE 302.A O no hydrogen 3.348 N/A ASN 288.A ND2 ASN 12.A OD1 no hydrogen 2.905 N/A GLU 289.A N ILE 10.A O no hydrogen 3.025 N/A LYS 290.A N GLU 287.A O no hydrogen 3.213 N/A GLU 296.A N GLU 293.A O no hydrogen 2.978 N/A LYS 297.A N ALA 294.A O no hydrogen 3.168 N/A LYS 297.A NZ LYS 290.A O no hydrogen 3.158 N/A HIS 298.A N SER 295.A O no hydrogen 3.020 N/A GLY 300.A N ASP 286.A OD1 no hydrogen 2.830 N/A LEU 301.A N ALA 283.A O no hydrogen 2.863 N/A LEU 301.A N MET 284.A O no hydrogen 3.110 N/A PHE 302.A N MET 284.A O no hydrogen 2.868 N/A ASN 303.A N ARG 307.A O no hydrogen 2.870 N/A GLN 306.A N ASN 303.A O no hydrogen 2.857 N/A ARG 307.A N ASP 305.A OD1 no hydrogen 3.220 N/A ARG 307.A NH1 ASP 305.A OD1 no hydrogen 3.380 N/A ARG 307.A NH1 ASP 305.A OD2 no hydrogen 2.983 N/A LYS 309.A N LEU 301.A O no hydrogen 2.849 N/A LYS 309.A NZ SER 241.A OG no hydrogen 2.857 N/A LYS 309.A NZ ASP 286.A OD1 no hydrogen 2.765 N/A LYS 309.A NZ GLY 300.A O no hydrogen 2.853 N/A ASN 315.A ND2 ILE 3.A O no hydrogen 2.995 N/A ASN 315.A ND2 ASN 28.A O no hydrogen 3.055 N/A