Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1k5c_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N THR 19.A O no hydrogen 2.787 N/A LYS 4.A N ASP 8.A OD2 no hydrogen 2.761 N/A ASP 8.A N SER 5.A OG no hydrogen 3.004 N/A ALA 9.A N VAL 6.A O no hydrogen 3.305 N/A LYS 10.A N ASP 7.A O no hydrogen 3.396 N/A LYS 10.A NZ ASP 7.A O no hydrogen 3.163 N/A LYS 10.A NZ ASP 11.A OD2 no hydrogen 2.619 N/A ASP 11.A N ASP 8.A O no hydrogen 2.944 N/A GLY 14.A N ASP 36.A OD1 no hydrogen 2.982 N/A GLY 14.A N ASP 36.A OD2 no hydrogen 3.018 N/A CYS 15.A N ILE 12.A O no hydrogen 3.022 N/A CYS 15.A SG ILE 12.A O no hydrogen 3.287 N/A VAL 18.A N THR 40.A O no hydrogen 2.814 N/A THR 19.A N CYS 1.A O no hydrogen 2.909 N/A LEU 20.A N THR 42.A O no hydrogen 2.807 N/A ASN 21.A N VAL 3.A O no hydrogen 2.936 N/A PHE 23.A N ASP 46.A O no hydrogen 3.206 N/A VAL 25.A N THR 48.A O no hydrogen 2.813 N/A GLY 28.A N THR 52.A OG1 no hydrogen 3.154 N/A ASN 29.A N PRO 26.A O no hydrogen 3.102 N/A ASN 29.A ND2 PRO 26.A O no hydrogen 3.569 N/A ASN 29.A ND2 ALA 27.A O no hydrogen 3.085 N/A LEU 31.A N LEU 58.A O no hydrogen 2.906 N/A LEU 33.A N THR 60.A O no hydrogen 2.857 N/A GLY 38.A N THR 64.A O no hydrogen 2.863 N/A ALA 39.A N ASP 36.A O no hydrogen 2.993 N/A THR 40.A N SER 16.A O no hydrogen 2.863 N/A VAL 41.A N ASN 67.A O no hydrogen 2.858 N/A THR 42.A N VAL 18.A O no hydrogen 2.878 N/A MET 43.A N VAL 69.A O no hydrogen 2.900 N/A ALA 44.A N LEU 20.A O no hydrogen 2.783 N/A ILE 47.A N ILE 74.A O no hydrogen 2.815 N/A THR 48.A N PHE 23.A O no hydrogen 3.058 N/A PHE 49.A N ASP 76.A O no hydrogen 2.904 N/A ALA 50.A N VAL 25.A O no hydrogen 3.094 N/A LYS 51.A NZ LEU 81.A O no hydrogen 2.856 N/A THR 52.A N TYR 82.A OH no hydrogen 2.976 N/A LEU 54.A N THR 52.A OG1 no hydrogen 3.306 N/A LEU 58.A N PHE 98.A O no hydrogen 2.916 N/A PHE 59.A N PHE 98.A O no hydrogen 3.141 N/A THR 60.A N LEU 31.A O no hydrogen 2.963 N/A ILE 61.A N LYS 100.A O no hydrogen 2.984 N/A ASP 62.A N LEU 33.A O no hydrogen 3.083 N/A GLY 63.A N LYS 102.A O no hydrogen 3.360 N/A THR 64.A OG1 ASP 126.A OD2 no hydrogen 2.623 N/A GLY 65.A N SER 104.A OG no hydrogen 3.003 N/A ILE 66.A N SER 104.A O no hydrogen 3.057 N/A ASN 67.A N ALA 39.A O no hydrogen 2.909 N/A ASN 67.A ND2 THR 40.A OG1 no hydrogen 3.178 N/A PHE 68.A N THR 106.A O no hydrogen 2.838 N/A VAL 69.A N VAL 41.A O no hydrogen 2.789 N/A GLY 70.A N LYS 108.A O no hydrogen 2.838 N/A ASP 72.A N LYS 109.A O no hydrogen 2.789 N/A HIS 73.A N GLY 70.A O no hydrogen 2.984 N/A HIS 73.A ND1 ASP 46.A OD1 no hydrogen 3.149 N/A ILE 74.A N ASP 46.A OD1 no hydrogen 2.915 N/A PHE 75.A N GLU 111.A O no hydrogen 2.817 N/A ASP 76.A N ILE 47.A O no hydrogen 2.828 N/A GLY 77.A N LEU 113.A O no hydrogen 2.894 N/A ASN 78.A N ASP 76.A OD1 no hydrogen 2.994 N/A ASN 78.A ND2 PHE 49.A O no hydrogen 2.963 N/A LEU 81.A N ASN 78.A O no hydrogen 2.942 N/A TYR 82.A N GLY 79.A O no hydrogen 2.855 N/A TRP 83.A N GLY 79.A O no hydrogen 2.984 N/A TRP 83.A NE1 SER 115.A O no hydrogen 3.004 N/A GLY 85.A N LEU 146.A O no hydrogen 2.917 N/A LYS 86.A N ASP 84.A OD1 no hydrogen 2.974 N/A THR 88.A N ASN 149.A OD1 no hydrogen 2.833 N/A ASN 89.A N LYS 86.A O no hydrogen 2.957 N/A GLY 91.A N ASN 90.A OD1 no hydrogen 2.815 N/A THR 92.A N ASP 84.A OD2 no hydrogen 2.807 N/A THR 92.A OG1 TYR 82.A O no hydrogen 2.778 N/A HIS 93.A NE2 ASP 55.A OD1 no hydrogen 2.962 N/A LYS 94.A NZ ASP 84.A OD1 no hydrogen 2.826 N/A LYS 94.A NZ ASP 84.A OD2 no hydrogen 3.561 N/A LYS 94.A NZ GLY 87.A O no hydrogen 2.793 N/A LYS 94.A NZ THR 92.A O no hydrogen 2.816 N/A LYS 94.A NZ THR 92.A OG1 no hydrogen 2.946 N/A PHE 98.A N GLN 118.A O no hydrogen 2.924 N/A LEU 99.A N ALA 119.A O no hydrogen 2.905 N/A LYS 100.A N PHE 59.A O no hydrogen 2.827 N/A LYS 100.A NZ SER 121.A OG no hydrogen 2.834 N/A LYS 100.A NZ GLY 123.A O no hydrogen 2.785 N/A ILE 101.A N SER 121.A O no hydrogen 2.941 N/A LYS 102.A N ILE 61.A O no hydrogen 2.940 N/A GLY 103.A N PRO 124.A O no hydrogen 2.932 N/A SER 104.A N GLY 63.A O no hydrogen 2.916 N/A SER 104.A OG ASP 126.A OD1 no hydrogen 2.642 N/A GLY 105.A N HIS 128.A O no hydrogen 3.061 N/A THR 106.A N ILE 66.A O no hydrogen 2.802 N/A TYR 107.A N THR 130.A O no hydrogen 2.818 N/A LYS 108.A N PHE 68.A O no hydrogen 2.912 N/A LYS 108.A NZ.A ASN 67.A OD1 no hydrogen 2.622 N/A LYS 109.A N ASP 132.A O no hydrogen 3.102 N/A GLU 111.A N HIS 73.A O no hydrogen 2.873 N/A VAL 112.A N THR 135.A O no hydrogen 2.773 N/A LEU 113.A N PHE 75.A O no hydrogen 2.842 N/A ASN 114.A N ASP 137.A O no hydrogen 2.911 N/A SER 115.A N ASP 138.A OD1 no hydrogen 2.855 N/A SER 115.A OG ALA 117.A O no hydrogen 2.649 N/A SER 115.A OG ASP 138.A OD1 no hydrogen 3.437 N/A SER 115.A OG ASP 138.A OD2 no hydrogen 2.680 N/A GLN 118.A N GLN 118.A OE1 no hydrogen 2.730 N/A GLN 118.A NE2 THR 88.A OG1 no hydrogen 3.218 N/A ALA 119.A N ASP 151.A O no hydrogen 2.820 N/A ILE 120.A N GLY 152.A O no hydrogen 3.032 N/A SER 121.A N LEU 99.A O no hydrogen 2.857 N/A VAL 122.A N ASP 154.A O no hydrogen 2.841 N/A GLY 123.A N ILE 101.A O no hydrogen 2.894 N/A THR 125.A OG1 ASN 158.A O no hydrogen 2.681 N/A ASP 126.A N GLY 103.A O no hydrogen 3.147 N/A HIS 128.A NE2 THR 161.A OG1 no hydrogen 2.816 N/A LEU 129.A N ASN 159.A O no hydrogen 2.984 N/A THR 130.A N GLY 105.A O no hydrogen 2.898 N/A LEU 131.A N THR 161.A O no hydrogen 2.823 N/A ASP 132.A N TYR 107.A O no hydrogen 2.804 N/A GLY 133.A N GLN 163.A O no hydrogen 3.022 N/A THR 135.A N PHE 110.A O no hydrogen 2.998 N/A VAL 136.A N ILE 166.A O no hydrogen 2.779 N/A ASP 137.A N VAL 112.A O no hydrogen 2.795 N/A ASP 138.A N LYS 168.A O no hydrogen 2.763 N/A PHE 139.A N ASP 137.A OD1 no hydrogen 2.980 N/A GLY 141.A N ASP 138.A O no hydrogen 2.836 N/A ASP 142.A N PHE 139.A O no hydrogen 2.921 N/A THR 143.A N ALA 140.A O no hydrogen 3.230 N/A THR 143.A OG1 ALA 140.A O no hydrogen 3.457 N/A ASN 145.A N ASP 142.A O no hydrogen 2.867 N/A LEU 146.A N THR 143.A O no hydrogen 3.108 N/A GLY 147.A N GLY 141.A O no hydrogen 2.838 N/A GLY 152.A N ASP 172.A O no hydrogen 3.021 N/A PHE 153.A N CYS 173.A O no hydrogen 3.114 N/A ASP 154.A N ILE 120.A O no hydrogen 2.855 N/A VAL 155.A N ALA 175.A O no hydrogen 2.895 N/A SER 156.A N VAL 122.A O no hydrogen 3.075 N/A ALA 157.A N ASP 178.A O no hydrogen 2.990 N/A ASN 159.A N ASN 180.A O no hydrogen 2.906 N/A VAL 160.A N ASN 181.A O no hydrogen 3.099 N/A THR 161.A N LEU 129.A O no hydrogen 2.883 N/A THR 161.A OG1 HIS 128.A NE2 no hydrogen 2.816 N/A ILE 162.A N ARG 183.A O no hydrogen 2.867 N/A GLN 163.A N LEU 131.A O no hydrogen 2.869 N/A GLN 163.A NE2 ASP 132.A OD2 no hydrogen 2.838 N/A ASN 164.A N GLU 185.A O no hydrogen 3.166 N/A ASN 164.A ND2 ASP 132.A OD1 no hydrogen 2.911 N/A CYS 165.A N ASN 187.A OD1 no hydrogen 2.778 N/A CYS 165.A SG LEU 131.A O no hydrogen 3.957 N/A CYS 165.A SG GLN 163.A O no hydrogen 3.417 N/A ILE 166.A N ILE 134.A O no hydrogen 2.949 N/A VAL 167.A N GLN 188.A O no hydrogen 2.839 N/A LYS 168.A N VAL 136.A O no hydrogen 2.899 N/A ASN 169.A N SER 190.A O no hydrogen 3.136 N/A ASN 169.A ND2 THR 150.A O no hydrogen 2.807 N/A ASN 169.A ND2 ASP 171.A O no hydrogen 3.081 N/A ASN 169.A ND2 ASP 172.A O no hydrogen 3.034 N/A GLN 170.A N THR 150.A OG1 no hydrogen 2.974 N/A ASP 172.A N ASP 171.A OD1 no hydrogen 2.691 N/A CYS 173.A N GLY 194.A O no hydrogen 2.808 N/A ALA 175.A N PHE 153.A O no hydrogen 2.830 N/A ILE 176.A N SER 196.A O no hydrogen 2.929 N/A ASN 177.A N VAL 155.A O no hydrogen 2.783 N/A ASP 178.A N VAL 155.A O no hydrogen 3.421 N/A GLY 179.A N HIS 205.A O no hydrogen 2.926 N/A ASN 180.A N ASN 158.A OD1 no hydrogen 2.877 N/A ASN 181.A N SER 207.A O no hydrogen 2.981 N/A ASN 181.A ND2 ASN 159.A OD1.A no hydrogen 2.962 N/A ILE 182.A N ASN 208.A O no hydrogen 3.114 N/A ARG 183.A N VAL 160.A O no hydrogen 2.856 N/A ARG 183.A NH1 GLU 185.A OE1 no hydrogen 3.173 N/A PHE 184.A N VAL 210.A O no hydrogen 2.860 N/A GLU 185.A N ILE 162.A O no hydrogen 2.936 N/A ASN 186.A N LYS 212.A O no hydrogen 2.938 N/A ASN 187.A ND2 ILE 162.A O no hydrogen 3.104 N/A GLN 188.A N CYS 165.A O no hydrogen 2.844 N/A CYS 189.A N THR 215.A O no hydrogen 2.833 N/A SER 190.A N VAL 167.A O no hydrogen 2.876 N/A GLY 191.A N THR 217.A O no hydrogen 3.429 N/A GLY 191.A N ARG 218.A O no hydrogen 2.853 N/A HIS 193.A N ASP 171.A O no hydrogen 2.849 N/A ILE 195.A N GLY 222.A O no hydrogen 3.035 N/A SER 196.A N ILE 174.A O no hydrogen 2.923 N/A SER 196.A OG.A ASP 172.A OD1 no hydrogen 2.833 N/A SER 196.A OG.B GLY 198.A O no hydrogen 3.104 N/A ILE 197.A N ARG 224.A O no hydrogen 2.906 N/A GLY 198.A N ILE 176.A O no hydrogen 2.808 N/A ILE 200.A N LYS 226.A O no hydrogen 2.850 N/A GLY 203.A N THR 232.A O no hydrogen 2.989 N/A LYS 204.A N ALA 201.A O no hydrogen 3.083 N/A HIS 205.A N ASP 178.A OD1 no hydrogen 2.887 N/A HIS 205.A ND1 SER 235.A OG no hydrogen 2.793 N/A VAL 206.A N SER 235.A O no hydrogen 2.926 N/A SER 207.A N GLY 179.A O no hydrogen 2.885 N/A SER 207.A OG ASN 180.A OD1 no hydrogen 2.624 N/A ASN 208.A N SER 237.A O no hydrogen 3.082 N/A VAL 209.A N GLY 238.A O no hydrogen 2.890 N/A VAL 210.A N ILE 182.A O no hydrogen 2.946 N/A ILE 211.A N THR 240.A O no hydrogen 2.855 N/A LYS 212.A N PHE 184.A O no hydrogen 2.938 N/A LYS 212.A NZ ASP 242.A OD1 no hydrogen 2.983 N/A GLY 213.A N ASP 242.A O no hydrogen 2.882 N/A ASN 214.A N ASN 244.A OD1 no hydrogen 3.010 N/A ASN 214.A ND2 PHE 184.A O no hydrogen 3.673 N/A ASN 214.A ND2 ASN 187.A O no hydrogen 3.696 N/A THR 215.A N ASN 187.A O no hydrogen 2.886 N/A VAL 216.A N THR 245.A O no hydrogen 3.006 N/A THR 217.A N CYS 189.A O no hydrogen 2.921 N/A ARG 218.A N SER 247.A O no hydrogen 3.243 N/A ARG 218.A NH1 ASP 142.A OD2 no hydrogen 3.372 N/A ARG 218.A NH2 ASP 142.A OD2 no hydrogen 2.828 N/A SER 219.A N GLY 248.A O no hydrogen 3.206 N/A SER 219.A OG THR 217.A O no hydrogen 2.736 N/A MET 220.A N GLY 192.A O no hydrogen 2.833 N/A GLY 222.A N TYR 252.A O no hydrogen 3.057 N/A VAL 223.A N GLY 253.A O no hydrogen 3.031 N/A ARG 224.A N ILE 195.A O no hydrogen 3.001 N/A ARG 224.A NH2.A ASP 172.A OD1 no hydrogen 2.706 N/A ILE 225.A N LEU 255.A O no hydrogen 2.994 N/A LYS 226.A N ILE 197.A O no hydrogen 2.862 N/A LYS 226.A NZ ASP 172.A OD2 no hydrogen 2.745 N/A LYS 226.A NZ GLY 198.A O no hydrogen 3.550 N/A ALA 227.A N SER 257.A O no hydrogen 2.990 N/A GLN 228.A N ILE 200.A O no hydrogen 2.989 N/A ARG 229.A N TYR 260.A O no hydrogen 2.830 N/A ARG 229.A NE GLY 265.A O no hydrogen 3.360 N/A ARG 229.A NE ASN 266.A O no hydrogen 2.921 N/A ARG 229.A NH1 ASP 262.A OD2 no hydrogen 2.968 N/A ARG 229.A NH2 ASP 262.A OD2 no hydrogen 2.877 N/A ARG 229.A NH2 GLY 265.A O no hydrogen 2.851 N/A ALA 231.A N GLN 228.A O no hydrogen 3.011 N/A THR 232.A N THR 202.A OG1 no hydrogen 2.975 N/A ALA 234.A N GLY 270.A O no hydrogen 3.331 N/A SER 235.A N LYS 204.A O no hydrogen 2.994 N/A SER 235.A OG HIS 205.A ND1 no hydrogen 2.793 N/A VAL 236.A N PRO 272.A O no hydrogen 2.974 N/A SER 237.A N VAL 206.A O no hydrogen 2.890 N/A SER 237.A OG.A SER 274.A OG no hydrogen 2.777 N/A GLY 238.A N SER 274.A O no hydrogen 2.991 N/A VAL 239.A N ASP 275.A O no hydrogen 2.953 N/A THR 240.A N VAL 209.A O no hydrogen 2.903 N/A TYR 241.A N ASN 277.A O no hydrogen 2.841 N/A ASP 242.A N ILE 211.A O no hydrogen 2.895 N/A ALA 243.A N GLY 281.A O no hydrogen 2.874 N/A ASN 244.A N THR 283.A OG1 no hydrogen 3.174 N/A ASN 244.A ND2 ILE 211.A O no hydrogen 3.022 N/A ASN 244.A ND2 THR 283.A OG1 no hydrogen 3.375 N/A THR 245.A N ASN 214.A O no hydrogen 2.851 N/A ILE 246.A N THR 284.A O no hydrogen 2.841 N/A SER 247.A N VAL 216.A O no hydrogen 2.918 N/A ALA 250.A N SER 219.A O no hydrogen 2.941 N/A LYS 251.A N MET 220.A O no hydrogen 2.861 N/A LYS 251.A NZ.A ASP 263.A OD2 no hydrogen 3.036 N/A TYR 252.A N MET 220.A O no hydrogen 3.296 N/A GLY 253.A N THR 292.A O no hydrogen 2.953 N/A VAL 254.A N ARG 293.A O no hydrogen 2.961 N/A LEU 255.A N VAL 223.A O no hydrogen 3.066 N/A ILE 256.A N THR 295.A O no hydrogen 2.998 N/A SER 257.A N ILE 225.A O no hydrogen 2.823 N/A SER 257.A OG ASP 263.A O no hydrogen 2.643 N/A GLN 258.A N GLU 297.A O no hydrogen 2.990 N/A GLN 258.A NE2 ALA 271.A O no hydrogen 2.905 N/A GLN 258.A NE2 ASN 300.A O no hydrogen 2.914 N/A SER 259.A N SER 257.A OG no hydrogen 3.054 N/A SER 259.A OG GLY 265.A O no hydrogen 2.847 N/A TYR 260.A N ALA 227.A O no hydrogen 3.140 N/A GLY 265.A N GLU 297.A OE2 no hydrogen 2.850 N/A GLY 268.A N GLN 258.A O no hydrogen 2.872 N/A PHE 273.A N ASN 300.A O no hydrogen 3.163 N/A SER 274.A N VAL 236.A O no hydrogen 2.857 N/A SER 274.A OG SER 237.A OG.A no hydrogen 2.777 N/A ASP 275.A N SER 302.A O no hydrogen 3.293 N/A ASN 277.A N VAL 239.A O no hydrogen 2.884 N/A PHE 278.A N ASN 306.A O no hydrogen 2.809 N/A THR 279.A N TYR 241.A O no hydrogen 3.050 N/A GLY 281.A N ASP 242.A OD1 no hydrogen 2.889 N/A THR 283.A N GLN 309.A O no hydrogen 2.906 N/A THR 284.A N ASN 244.A O no hydrogen 2.996 N/A ILE 285.A N THR 311.A O no hydrogen 2.817 N/A LYS 286.A N ILE 246.A O no hydrogen 2.888 N/A VAL 287.A N THR 313.A O no hydrogen 2.907 N/A ASN 288.A N ILE 249.A O no hydrogen 2.818 N/A ALA 291.A N ASN 288.A O no hydrogen 2.984 N/A THR 292.A N LYS 251.A O no hydrogen 2.863 N/A ARG 293.A N LYS 316.A O no hydrogen 2.861 N/A ARG 293.A NE TYR 332.A O no hydrogen 2.886 N/A ARG 293.A NH1 GLY 314.A O no hydrogen 2.928 N/A ARG 293.A NH2 LEU 333.A O no hydrogen 3.495 N/A ARG 293.A NH2 LEU 333.A OXT no hydrogen 2.975 N/A THR 295.A N VAL 254.A O no hydrogen 3.002 N/A VAL 296.A N THR 319.A O no hydrogen 2.920 N/A GLU 297.A N ILE 256.A O no hydrogen 2.746 N/A CYS 298.A N LYS 321.A O no hydrogen 2.840 N/A GLY 299.A N GLN 258.A OE1 no hydrogen 2.680 N/A ASN 300.A N GLN 258.A OE1 no hydrogen 2.908 N/A ASN 300.A ND2 THR 269.A O no hydrogen 2.942 N/A CYS 301.A N ASP 323.A OD2 no hydrogen 2.990 N/A CYS 301.A SG GLN 258.A OE1 no hydrogen 3.851 N/A SER 302.A N PHE 273.A O no hydrogen 2.930 N/A TRP 305.A N LYS 326.A O no hydrogen 2.799 N/A TRP 305.A NE1 SER 302.A O no hydrogen 2.835 N/A ASN 306.A N ASN 277.A OD1 no hydrogen 2.861 N/A TRP 307.A N THR 328.A O.A no hydrogen 2.699 N/A TRP 307.A N THR 328.A O.B no hydrogen 2.754 N/A TRP 307.A NE1 VAL 276.A O no hydrogen 2.839 N/A SER 308.A N ASN 306.A OD1 no hydrogen 2.980 N/A SER 308.A OG.A ASN 306.A OD1 no hydrogen 2.788 N/A SER 308.A OG.B ASN 306.A OD1 no hydrogen 2.839 N/A GLN 309.A N PHE 278.A O no hydrogen 2.963 N/A GLN 309.A NE2 GLY 280.A O no hydrogen 2.849 N/A LEU 310.A N TRP 307.A O no hydrogen 3.029 N/A THR 311.A N THR 283.A O no hydrogen 2.920 N/A VAL 312.A N GLN 331.A O no hydrogen 2.809 N/A THR 313.A N ILE 285.A O no hydrogen 2.939 N/A LYS 316.A N ALA 291.A O no hydrogen 2.930 N/A THR 319.A N THR 295.A OG1 no hydrogen 3.097 N/A LYS 321.A N VAL 296.A O no hydrogen 2.832 N/A SER 322.A OG ALA 325.A O no hydrogen 2.710 N/A LYS 324.A NZ ASN 300.A OD1 no hydrogen 3.264 N/A LYS 324.A NZ ASP 323.A OD2 no hydrogen 2.754 N/A ALA 325.A N SER 322.A O no hydrogen 2.988 N/A LYS 326.A N GLY 303.A O no hydrogen 2.901 N/A LYS 326.A NZ ASN 304.A OD1 no hydrogen 2.717 N/A THR 328.A N.A TRP 305.A O no hydrogen 2.917 N/A THR 328.A N.B TRP 305.A O no hydrogen 2.888 N/A GLN 331.A N LEU 310.A O no hydrogen 2.892 N/A TYR 332.A OH.B GLY 329.A O.B no hydrogen 2.863 N/A