Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3u4g_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A NZ GLU 129.A O.A no hydrogen 2.682 N/A LYS 2.A NZ GLU 129.A O.B no hydrogen 2.872 N/A VAL 3.A N ILE 131.A O no hydrogen 2.946 N/A SER 5.A OG GLU 134.A OE1 no hydrogen 2.721 N/A LEU 6.A N GLU 134.A O no hydrogen 2.925 N/A PHE 7.A N PRO 78.A O no hydrogen 2.952 N/A LEU 8.A N VAL 136.A O no hydrogen 2.809 N/A LEU 9.A N LEU 80.A O no hydrogen 3.096 N/A VAL 10.A N GLY 138.A O no hydrogen 2.804 N/A LEU 11.A N VAL 82.A O no hydrogen 2.874 N/A GLY 12.A N SER 140.A O no hydrogen 3.027 N/A ASN 13.A N GLY 85.A O no hydrogen 2.864 N/A ASN 13.A ND2 THR 32.A O no hydrogen 3.304 N/A GLU 15.A N GLY 102.A O no hydrogen 2.815 N/A ILE 16.A N THR 14.A OG1 no hydrogen 3.101 N/A SER 17.A N THR 14.A O no hydrogen 3.023 N/A SER 17.A OG THR 14.A O no hydrogen 3.166 N/A SER 17.A OG THR 32.A OG1 no hydrogen 2.744 N/A THR 18.A N GLU 15.A O no hydrogen 2.990 N/A THR 18.A OG1 GLU 15.A O no hydrogen 3.408 N/A ILE 19.A N ILE 16.A O no hydrogen 3.159 N/A ILE 22.A N ILE 19.A O no hydrogen 3.117 N/A ALA 25.A N SER 23.A OG no hydrogen 3.056 N/A GLY 26.A N VAL 24.A O no hydrogen 2.851 N/A LEU 31.A N THR 28.A OG1 no hydrogen 3.217 N/A THR 32.A N THR 28.A O no hydrogen 3.196 N/A THR 32.A N PRO 29.A O no hydrogen 3.222 N/A THR 32.A OG1 SER 17.A OG no hydrogen 2.744 N/A THR 32.A OG1 PRO 29.A O no hydrogen 2.691 N/A LYS 33.A N GLU 30.A O no hydrogen 3.020 N/A ILE 34.A N LEU 31.A O no hydrogen 2.948 N/A THR 35.A N LEU 31.A O no hydrogen 3.205 N/A THR 35.A OG1 ALA 25.A O no hydrogen 2.599 N/A THR 35.A OG1 LEU 31.A O no hydrogen 3.251 N/A ALA 38.A N ILE 34.A O no hydrogen 3.109 N/A ASP 39.A N THR 35.A O no hydrogen 2.867 N/A ALA 40.A N PRO 36.A O no hydrogen 3.224 N/A GLU 41.A N VAL 37.A O no hydrogen 2.944 N/A TYR 42.A N ALA 38.A O no hydrogen 2.981 N/A LEU 43.A N ALA 40.A O no hydrogen 3.175 N/A PHE 44.A N GLU 41.A O no hydrogen 2.997 N/A TYR 45.A N GLU 41.A O no hydrogen 3.134 N/A LEU 49.A N GLU 41.A OE1 no hydrogen 2.782 N/A THR 50.A N GLU 41.A OE1 no hydrogen 2.817 N/A THR 50.A OG1 GLU 41.A OE1 no hydrogen 3.474 N/A THR 50.A OG1 GLU 41.A OE2 no hydrogen 2.594 N/A THR 57.A N HIS 61.A O no hydrogen 2.932 N/A THR 57.A OG1 GLU 59.A OE1.A no hydrogen 2.952 N/A THR 57.A OG1 HIS 61.A ND1 no hydrogen 3.137 N/A GLY 60.A N THR 57.A O no hydrogen 2.729 N/A HIS 61.A N THR 57.A OG1 no hydrogen 2.961 N/A HIS 61.A ND1 GLU 59.A OE1.A no hydrogen 3.039 N/A HIS 61.A NE2 ASP 278.A OD2 no hydrogen 2.831 N/A THR 63.A N PRO 55.A O no hydrogen 2.965 N/A THR 63.A OG1 ASP 39.A OD1 no hydrogen 2.577 N/A ALA 65.A N THR 63.A OG1 no hydrogen 2.975 N/A ILE 66.A N THR 63.A O no hydrogen 3.247 N/A ILE 67.A N PRO 64.A O no hydrogen 2.872 N/A THR 68.A N PRO 64.A O no hydrogen 3.419 N/A THR 68.A OG1 VAL 288.A O no hydrogen 2.581 N/A LYS 69.A N ALA 65.A O no hydrogen 2.873 N/A LYS 69.A NZ TYR 42.A O no hydrogen 2.720 N/A LYS 69.A NZ TYR 45.A O no hydrogen 2.933 N/A ALA 70.A N ILE 66.A O no hydrogen 3.064 N/A ALA 71.A N ILE 67.A O no hydrogen 2.931 N/A ARG 72.A N THR 68.A O no hydrogen 2.907 N/A GLU 73.A N LYS 69.A O no hydrogen 2.819 N/A LEU 74.A N ALA 70.A O no hydrogen 3.017 N/A SER 75.A N ALA 71.A O no hydrogen 3.051 N/A SER 75.A OG ALA 71.A O no hydrogen 2.796 N/A ASN 76.A N.A ARG 72.A O no hydrogen 2.748 N/A ASN 76.A N.B ARG 72.A O no hydrogen 2.713 N/A LEU 80.A N PHE 7.A O no hydrogen 3.024 N/A VAL 82.A N LEU 9.A O no hydrogen 2.738 N/A ARG 83.A N VAL 95.A O no hydrogen 2.695 N/A ARG 83.A NE THR 86.A OG1 no hydrogen 2.838 N/A ARG 83.A NH2 THR 86.A O no hydrogen 2.869 N/A GLY 84.A N LEU 11.A O no hydrogen 2.860 N/A GLY 85.A N LEU 11.A O no hydrogen 3.301 N/A THR 86.A OG1 LEU 88.A O no hydrogen 2.630 N/A TYR 87.A N ASN 13.A OD1 no hydrogen 3.028 N/A LEU 91.A N GLU 41.A OE2 no hydrogen 2.872 N/A HIS 94.A ND1 ILE 92.A O no hydrogen 2.789 N/A VAL 95.A N VAL 81.A O no hydrogen 2.743 N/A ILE 97.A N ARG 83.A O no hydrogen 3.040 N/A SER 98.A N ARG 83.A O no hydrogen 3.423 N/A SER 98.A OG GLY 84.A O no hydrogen 2.655 N/A VAL 100.A N SER 98.A OG no hydrogen 3.082 N/A GLY 102.A N ASN 13.A O no hydrogen 3.037 N/A ARG 103.A N ALA 110.A O no hydrogen 2.755 N/A ARG 103.A NH1 VAL 101.A O no hydrogen 3.143 N/A ARG 103.A NH1 GLU 113.A OE1 no hydrogen 2.825 N/A ARG 103.A NH1 GLU 113.A OE2 no hydrogen 3.280 N/A ARG 103.A NH2 GLU 113.A OE2 no hydrogen 2.738 N/A ASP 104.A N GLU 15.A OE1 no hydrogen 2.995 N/A ARG 106.A N ASP 104.A OD1 no hydrogen 2.973 N/A ARG 106.A NE ASP 104.A OD1 no hydrogen 3.077 N/A ARG 106.A NE ASP 104.A OD2 no hydrogen 3.374 N/A ARG 106.A NH2 ASP 104.A OD2 no hydrogen 2.815 N/A ARG 107.A N ASP 104.A O no hydrogen 2.940 N/A ARG 107.A NE GLU 108.A OE2 no hydrogen 2.977 N/A ARG 107.A NH2 GLU 15.A OE1 no hydrogen 2.699 N/A ARG 107.A NH2 GLU 108.A OE2 no hydrogen 2.697 N/A GLU 108.A N ASP 104.A O no hydrogen 3.239 N/A ALA 110.A N GLU 192.A O no hydrogen 3.017 N/A LEU 111.A N LYS 191.A O no hydrogen 2.875 N/A VAL 114.A N LEU 111.A O no hydrogen 3.044 N/A GLU 115.A N GLU 115.A OE1 no hydrogen 2.836 N/A ILE 117.A N GLU 113.A O no hydrogen 3.129 N/A ILE 118.A N VAL 114.A O no hydrogen 2.942 N/A GLU 119.A N GLU 115.A O no hydrogen 2.899 N/A ARG 120.A N VAL 116.A O no hydrogen 2.996 N/A ARG 120.A NH2 ILE 97.A O no hydrogen 2.915 N/A ALA 121.A N ILE 117.A O no hydrogen 2.975 N/A LYS 122.A N.A ILE 118.A O no hydrogen 2.760 N/A LYS 122.A N.B ILE 118.A O no hydrogen 2.797 N/A LEU 123.A N GLU 119.A O no hydrogen 3.068 N/A LEU 124.A N ARG 120.A O no hydrogen 3.026 N/A GLY 125.A N ALA 121.A O no hydrogen 2.926 N/A LYS 126.A N LYS 122.A O.A no hydrogen 2.925 N/A LYS 126.A N LYS 122.A O.B no hydrogen 2.900 N/A GLU 127.A N.A LEU 123.A O no hydrogen 3.143 N/A GLU 127.A N.B LEU 123.A O no hydrogen 3.046 N/A LEU 128.A N LEU 124.A O no hydrogen 2.847 N/A GLU 129.A N.A GLY 125.A O no hydrogen 2.921 N/A GLU 129.A N.B GLY 125.A O no hydrogen 2.873 N/A LYS 130.A N GLU 127.A O.A no hydrogen 3.008 N/A LYS 130.A N GLU 127.A O.B no hydrogen 3.155 N/A LYS 130.A NZ GLU 127.A OE2.A no hydrogen 3.052 N/A ILE 131.A N LEU 128.A O no hydrogen 2.853 N/A ALA 132.A N LEU 128.A O no hydrogen 2.983 N/A ASN 133.A N VAL 3.A O no hydrogen 2.959 N/A ILE 135.A N ASP 210.A O.A no hydrogen 3.057 N/A ILE 135.A N ASP 210.A O.B no hydrogen 3.025 N/A VAL 136.A N LEU 6.A O no hydrogen 2.929 N/A ILE 137.A N VAL 212.A O no hydrogen 2.775 N/A GLY 138.A N LEU 8.A O no hydrogen 2.757 N/A SER 140.A N VAL 10.A O no hydrogen 2.948 N/A SER 140.A OG ASP 39.A OD2 no hydrogen 2.698 N/A THR 141.A OG1 GLU 139.A OE2 no hydrogen 3.036 N/A GLY 144.A N THR 141.A O no hydrogen 2.874 N/A THR 146.A N GLY 143.A O no hydrogen 3.108 N/A THR 147.A N GLY 143.A O no hydrogen 3.353 N/A THR 147.A OG1 GLY 144.A O no hydrogen 3.079 N/A THR 147.A OG1 ASP 195.A OD2 no hydrogen 2.603 N/A ALA 148.A N GLY 144.A O no hydrogen 2.956 N/A GLN 149.A N THR 145.A O no hydrogen 2.902 N/A GLN 149.A NE2 GLN 161.A OE1 no hydrogen 3.591 N/A ALA 150.A N THR 146.A O no hydrogen 2.893 N/A ILE 151.A N THR 147.A O no hydrogen 3.007 N/A LEU 152.A N ALA 148.A O no hydrogen 2.873 N/A TRP 153.A N GLN 149.A O no hydrogen 2.851 N/A ALA 154.A N ALA 150.A O no hydrogen 2.831 N/A LEU 155.A N ILE 151.A O no hydrogen 2.819 N/A GLY 156.A N TRP 153.A O no hydrogen 3.098 N/A TYR 157.A N LEU 152.A O no hydrogen 2.887 N/A GLN 161.A NE2 GLN 149.A OE1 no hydrogen 2.946 N/A GLN 161.A NE2 GLU 165.A OE2 no hydrogen 2.855 N/A LYS 164.A N PRO 160.A O no hydrogen 3.228 N/A LYS 164.A NZ THR 145.A OG1 no hydrogen 3.028 N/A GLU 165.A N GLN 161.A O no hydrogen 3.012 N/A LYS 166.A N GLU 162.A O no hydrogen 3.079 N/A VAL 167.A N LEU 163.A O no hydrogen 2.943 N/A ILE 168.A N LYS 164.A O no hydrogen 2.826 N/A LYS 169.A N GLU 165.A O no hydrogen 2.728 N/A GLU 170.A N LYS 166.A O no hydrogen 2.994 N/A GLY 171.A N VAL 167.A O no hydrogen 3.140 N/A PHE 172.A N ILE 168.A O no hydrogen 2.879 N/A LYS 173.A N LYS 169.A O no hydrogen 2.933 N/A ARG 174.A N GLU 170.A O no hydrogen 3.030 N/A ARG 174.A NE PHE 105.A O no hydrogen 2.790 N/A ARG 174.A NH1 GLU 192.A OE1 no hydrogen 2.810 N/A ARG 174.A NH2 PHE 105.A O no hydrogen 2.945 N/A ARG 174.A NH2 GLU 192.A OE1 no hydrogen 2.878 N/A VAL 175.A N GLY 171.A O no hydrogen 3.102 N/A GLY 176.A N PHE 172.A O no hydrogen 2.762 N/A ILE 177.A N PHE 172.A O no hydrogen 3.055 N/A GLY 180.A N TRP 153.A O no hydrogen 2.884 N/A GLY 181.A N GLU 178.A O no hydrogen 2.791 N/A LEU 182.A N ALA 154.A O no hydrogen 2.937 N/A LYS 183.A N GLY 180.A O no hydrogen 3.253 N/A LYS 183.A NZ ASP 184.A OD2 no hydrogen 3.556 N/A LYS 185.A N LEU 182.A O no hydrogen 2.787 N/A ALA 189.A N LYS 185.A O no hydrogen 3.107 N/A LEU 190.A N PRO 186.A O no hydrogen 3.001 N/A LYS 191.A N LEU 187.A O no hydrogen 2.909 N/A LYS 191.A NZ GLU 115.A OE2 no hydrogen 3.386 N/A GLU 192.A N GLU 188.A O no hydrogen 2.875 N/A PHE 193.A N ALA 189.A O no hydrogen 2.921 N/A GLY 194.A N LEU 190.A O no hydrogen 2.909 N/A ALA 198.A N ASP 195.A O no hydrogen 3.149 N/A THR 199.A N PRO 196.A O no hydrogen 2.899 N/A THR 199.A OG1 PRO 196.A O no hydrogen 2.754 N/A LEU 201.A N ILE 197.A O no hydrogen 2.994 N/A GLY 202.A N ALA 198.A O no hydrogen 2.997 N/A LEU 203.A N THR 199.A O no hydrogen 2.896 N/A SER 204.A N VAL 200.A O no hydrogen 2.941 N/A SER 204.A OG VAL 200.A O no hydrogen 2.835 N/A LEU 205.A N LEU 201.A O no hydrogen 2.969 N/A GLY 206.A N GLY 202.A O no hydrogen 2.868 N/A PHE 207.A N LEU 203.A O no hydrogen 2.796 N/A GLY 208.A N GLU 129.A OE1.A no hydrogen 3.245 N/A VAL 211.A N ARG 234.A O no hydrogen 2.930 N/A VAL 212.A N ILE 135.A O no hydrogen 2.860 N/A ALA 214.A N ILE 137.A O no hydrogen 2.799 N/A GLY 216.A N GLN 218.A OE1 no hydrogen 3.301 N/A GLN 218.A N GLN 218.A OE1 no hydrogen 2.770 N/A GLN 218.A NE2 GLU 286.A OE1 no hydrogen 3.443 N/A ALA 220.A N THR 217.A O no hydrogen 2.981 N/A VAL 221.A N GLN 218.A O no hydrogen 3.155 N/A ALA 223.A N LEU 219.A O no hydrogen 2.850 N/A LEU 224.A N ALA 220.A O no hydrogen 2.936 N/A LEU 225.A N VAL 221.A O no hydrogen 2.974 N/A LYS 226.A N SER 222.A O no hydrogen 3.030 N/A LYS 226.A NZ GLU 256.A O no hydrogen 3.298 N/A LYS 226.A NZ ILE 257.A O no hydrogen 2.939 N/A SER 227.A N ALA 223.A O no hydrogen 2.985 N/A SER 227.A OG LYS 183.A O no hydrogen 3.065 N/A LEU 228.A N LEU 224.A O no hydrogen 2.790 N/A GLY 229.A N LYS 226.A O no hydrogen 2.794 N/A GLU 230.A N LEU 225.A O no hydrogen 2.855 N/A SER 233.A N ASP 231.A OD1 no hydrogen 3.050 N/A SER 233.A OG ASP 231.A OD1 no hydrogen 3.332 N/A ARG 234.A NH1 PHE 207.A O no hydrogen 2.731 N/A ARG 234.A NH1 GLY 209.A O no hydrogen 2.825 N/A ARG 234.A NH2 SER 204.A O no hydrogen 2.838 N/A ARG 234.A NH2 PHE 207.A O no hydrogen 3.211 N/A ARG 234.A NH2 GLU 230.A OE1 no hydrogen 3.272 N/A PHE 235.A N LEU 232.A O no hydrogen 3.159 N/A ILE 236.A N ILE 260.A O no hydrogen 2.879 N/A ALA 237.A N LEU 213.A O no hydrogen 2.778 N/A THR 238.A N TYR 262.A O no hydrogen 2.854 N/A THR 239.A N THR 238.A OG1 no hydrogen 2.772 N/A THR 239.A OG1 LYS 285.A O no hydrogen 2.663 N/A ARG 240.A N ALA 264.A O no hydrogen 2.858 N/A ARG 240.A NE GLU 244.A OE2 no hydrogen 3.243 N/A ARG 240.A NH1 GLU 244.A OE1 no hydrogen 2.973 N/A ARG 240.A NH1 GLU 280.A OE1 no hydrogen 3.308 N/A ARG 240.A NH2 LEU 266.A O no hydrogen 2.652 N/A ARG 240.A NH2 GLU 280.A OE1 no hydrogen 3.070 N/A TRP 241.A NE1 GLU 280.A OE2 no hydrogen 3.234 N/A VAL 242.A N THR 239.A O no hydrogen 3.119 N/A VAL 242.A N THR 239.A OG1 no hydrogen 3.286 N/A VAL 243.A N THR 239.A O no hydrogen 3.257 N/A GLU 244.A N ARG 240.A O no hydrogen 2.786 N/A ASP 245.A N TRP 241.A O no hydrogen 3.211 N/A SER 247.A N ASP 245.A OD1 no hydrogen 2.894 N/A SER 247.A OG ASP 245.A OD1 no hydrogen 2.849 N/A ALA 248.A N ASP 245.A O no hydrogen 3.063 N/A GLU 252.A N.A GLU 252.A OE1.A no hydrogen 2.608 N/A THR 253.A N THR 249.A O no hydrogen 2.866 N/A THR 253.A OG1 THR 249.A O no hydrogen 2.921 N/A ALA 254.A N PHE 250.A O no hydrogen 2.765 N/A ARG 255.A N ILE 251.A O no hydrogen 2.802 N/A GLU 256.A N GLU 252.A O.A no hydrogen 2.859 N/A GLU 256.A N GLU 252.A O.B no hydrogen 2.714 N/A ILE 257.A N THR 253.A O no hydrogen 2.790 N/A GLY 258.A N ALA 254.A O no hydrogen 2.844 N/A ILE 259.A N ALA 254.A O no hydrogen 3.074 N/A TYR 262.A N ILE 236.A O no hydrogen 2.734 N/A ALA 264.A N THR 238.A O no hydrogen 3.008 N/A PHE 268.A N GLU 280.A OE2 no hydrogen 2.696 N/A SER 269.A N ASP 267.A OD1 no hydrogen 2.969 N/A SER 269.A OG ASP 267.A OD1 no hydrogen 3.374 N/A SER 271.A N PHE 268.A O no hydrogen 3.087 N/A SER 271.A OG PHE 273.A O no hydrogen 3.352 N/A LYS 272.A N GLU 312.A OE2 no hydrogen 2.859 N/A PHE 273.A N SER 271.A OG no hydrogen 2.978 N/A LYS 274.A NZ ASP 278.A OD1 no hydrogen 2.861 N/A LYS 274.A NZ ASP 278.A OD2 no hydrogen 2.678 N/A ARG 277.A N PHE 273.A O no hydrogen 2.765 N/A ARG 277.A NH2 SER 271.A O no hydrogen 3.102 N/A ASP 278.A N LYS 274.A O no hydrogen 2.783 N/A TYR 279.A N LEU 276.A O no hydrogen 2.880 N/A TYR 279.A OH PRO 62.A O no hydrogen 2.800 N/A GLU 280.A N ARG 277.A O no hydrogen 3.112 N/A ARG 281.A N ASP 278.A O no hydrogen 2.973 N/A LYS 285.A N TYR 283.A O no hydrogen 2.857 N/A LYS 285.A NZ GLY 282.A O no hydrogen 3.415 N/A GLU 286.A N VAL 284.A O no hydrogen 2.811 N/A VAL 288.A N GLU 139.A O no hydrogen 2.851 N/A ALA 290.A N GLY 287.A O no hydrogen 2.989 N/A ALA 293.A N GLY 289.A O no hydrogen 2.772 N/A THR 294.A N ALA 290.A O no hydrogen 3.031 N/A THR 294.A OG1 ALA 290.A O no hydrogen 2.823 N/A TRP 295.A N GLY 291.A O no hydrogen 2.942 N/A LEU 296.A N GLY 292.A O no hydrogen 2.981 N/A ALA 297.A N ALA 293.A O no hydrogen 2.968 N/A VAL 298.A N THR 294.A O no hydrogen 2.882 N/A LYS 299.A N TRP 295.A O no hydrogen 2.901 N/A ALA 300.A N LEU 296.A O no hydrogen 2.957 N/A GLY 301.A N VAL 298.A O no hydrogen 2.906 N/A TYR 302.A N ALA 297.A O no hydrogen 3.006 N/A SER 303.A N ASP 306.A OD2 no hydrogen 3.001 N/A ASP 306.A N SER 303.A OG no hydrogen 2.874 N/A VAL 307.A N SER 303.A O no hydrogen 3.195 N/A SER 308.A N PRO 304.A O no hydrogen 3.061 N/A SER 308.A OG PRO 304.A O no hydrogen 3.044 N/A LYS 309.A N GLU 305.A O no hydrogen 2.942 N/A LYS 310.A N ASP 306.A O no hydrogen 3.066 N/A VAL 311.A N VAL 307.A O no hydrogen 2.861 N/A GLU 312.A N SER 308.A O no hydrogen 3.084 N/A GLU 313.A N LYS 309.A O no hydrogen 3.181 N/A LEU 314.A N LYS 310.A O no hydrogen 2.914 N/A TYR 315.A N VAL 311.A O no hydrogen 2.893 N/A GLU 316.A N GLU 312.A O no hydrogen 3.180 N/A ARG 317.A N LEU 314.A O no hydrogen 3.073 N/A LEU 318.A N TYR 315.A O no hydrogen 3.044 N/A