Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1hkh_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 1.A N TYR 17.A O no hydrogen 2.866 N/A ILE 3.A N LEU 15.A O no hydrogen 2.927 N/A VAL 5.A N ILE 13.A O no hydrogen 2.839 N/A ASN 7.A ND2.A ASN 9.A O no hydrogen 2.960 N/A GLU 8.A N THR 11.A O no hydrogen 2.786 N/A THR 11.A N GLU 8.A O no hydrogen 2.950 N/A THR 11.A OG1 GLU 8.A O no hydrogen 2.742 N/A ILE 13.A N GLY 6.A O no hydrogen 2.778 N/A GLU 14.A N SER 65.A OG no hydrogen 2.802 N/A LEU 15.A N ILE 3.A O no hydrogen 2.832 N/A TYR 16.A N SER 64.A OG no hydrogen 2.872 N/A TYR 16.A OH GLU 18.A OE2 no hydrogen 2.581 N/A TYR 17.A N GLY 1.A O no hydrogen 2.827 N/A GLU 18.A N THR 55.A O no hydrogen 2.872 N/A GLN 20.A N VAL 53.A O no hydrogen 2.983 N/A GLN 24.A NE2 ASP 91.A O no hydrogen 2.880 N/A VAL 26.A N ARG 52.A O no hydrogen 2.785 N/A VAL 27.A N VAL 93.A O no hydrogen 2.831 N/A LEU 28.A N ILE 54.A O no hydrogen 2.880 N/A ILE 29.A N VAL 95.A O no hydrogen 2.829 N/A HIS 30.A ND1 GLY 31.A O no hydrogen 2.814 N/A TYR 32.A OH ALA 197.A O no hydrogen 2.646 N/A LEU 34.A N GLY 31.A O no hydrogen 2.993 N/A GLY 36.A N ASP 57.A OD1 no hydrogen 2.781 N/A HIS 37.A N ASP 35.A OD1 no hydrogen 2.955 N/A HIS 37.A NE2 GLU 18.A OE2 no hydrogen 2.725 N/A SER 38.A N ASP 35.A O no hydrogen 3.002 N/A SER 38.A OG ASP 35.A O no hydrogen 2.688 N/A TRP 39.A N GLY 36.A O no hydrogen 3.289 N/A GLU 40.A N HIS 37.A O no hydrogen 2.975 N/A ARG 41.A NH1.A TRP 263.A O no hydrogen 2.806 N/A ARG 41.A NH1.B TRP 263.A O no hydrogen 2.786 N/A GLN 42.A N TRP 39.A O no hydrogen 2.731 N/A GLN 42.A NE2 LEU 262.A O no hydrogen 2.949 N/A GLN 42.A NE2 ASN 270.A OD1 no hydrogen 3.527 N/A THR 43.A N TRP 39.A O no hydrogen 2.796 N/A THR 43.A OG1 TRP 39.A O no hydrogen 3.178 N/A ARG 44.A N GLU 40.A O no hydrogen 3.259 N/A LEU 46.A N GLN 42.A O no hydrogen 2.976 N/A LEU 47.A N THR 43.A O no hydrogen 2.885 N/A ALA 48.A N ARG 44.A O no hydrogen 3.121 N/A GLN 49.A N GLU 45.A O no hydrogen 2.988 N/A GLN 49.A N LEU 46.A O no hydrogen 3.203 N/A GLY 50.A N LEU 47.A O no hydrogen 2.995 N/A TYR 51.A N LEU 46.A O no hydrogen 3.152 N/A TYR 51.A OH LEU 277.A O no hydrogen 3.190 N/A ARG 52.A N GLN 24.A O no hydrogen 2.970 N/A ARG 52.A NE ASP 19.A OD1 no hydrogen 2.803 N/A ARG 52.A NH2 ASP 19.A OD1 no hydrogen 3.458 N/A ARG 52.A NH2 ASP 19.A OD2 no hydrogen 2.833 N/A VAL 53.A N GLN 20.A O no hydrogen 2.789 N/A ILE 54.A N VAL 26.A O no hydrogen 2.838 N/A THR 55.A N GLU 18.A O no hydrogen 3.089 N/A ASP 57.A N TYR 16.A O no hydrogen 2.835 N/A ARG 58.A N HIS 30.A NE2 no hydrogen 2.954 N/A ARG 58.A NE GLU 103.A OE2 no hydrogen 2.825 N/A ARG 58.A NH1 HIS 30.A O no hydrogen 2.956 N/A ARG 58.A NH2 HIS 30.A O no hydrogen 2.928 N/A ARG 58.A NH2 GLU 103.A OE1 no hydrogen 2.868 N/A ARG 58.A NH2 GLU 103.A OE2 no hydrogen 3.279 N/A ARG 59.A NE ASP 79.A OD2 no hydrogen 2.754 N/A ARG 59.A NH1 THR 69.A O no hydrogen 2.991 N/A ARG 59.A NH2 ASP 79.A OD1 no hydrogen 2.930 N/A ARG 59.A NH2 ASP 79.A OD2 no hydrogen 3.449 N/A GLY 60.A N SER 65.A O no hydrogen 2.860 N/A PHE 61.A N ARG 58.A O no hydrogen 2.879 N/A GLY 63.A N ASP 57.A OD2 no hydrogen 2.806 N/A SER 64.A N PHE 61.A O no hydrogen 3.001 N/A SER 64.A OG ASP 57.A O no hydrogen 2.605 N/A SER 65.A N GLU 14.A O no hydrogen 2.878 N/A SER 65.A OG PRO 12.A O no hydrogen 3.407 N/A SER 65.A OG GLU 14.A O no hydrogen 3.363 N/A LYS 66.A NZ GLY 62.A O no hydrogen 2.859 N/A LYS 66.A NZ SER 64.A O no hydrogen 2.743 N/A ASN 68.A N GLU 8.A OE2 no hydrogen 2.732 N/A TYR 71.A OH VAL 67.A O no hydrogen 2.667 N/A TYR 73.A N GLU 206.A OE2 no hydrogen 2.921 N/A TYR 73.A OH MET 99.A O no hydrogen 2.621 N/A THR 75.A N ASP 72.A OD1 no hydrogen 2.892 N/A THR 75.A OG1 ASP 72.A OD1 no hydrogen 2.934 N/A THR 75.A OG1 ASP 72.A OD2 no hydrogen 3.192 N/A PHE 76.A N ASP 72.A O no hydrogen 2.885 N/A ALA 77.A N TYR 73.A O no hydrogen 2.811 N/A ALA 78.A N ASP 74.A O no hydrogen 3.004 N/A ASP 79.A N THR 75.A O no hydrogen 2.864 N/A LEU 80.A N PHE 76.A O no hydrogen 3.111 N/A HIS 81.A N ALA 77.A O no hydrogen 2.837 N/A THR 82.A N ALA 78.A O no hydrogen 2.986 N/A THR 82.A OG1 ALA 78.A O no hydrogen 3.247 N/A VAL 83.A N ASP 79.A O no hydrogen 2.948 N/A LEU 84.A N LEU 80.A O no hydrogen 2.892 N/A GLU 85.A N HIS 81.A O no hydrogen 2.871 N/A THR 86.A N THR 82.A O no hydrogen 2.811 N/A THR 86.A OG1 THR 82.A O no hydrogen 2.765 N/A LEU 87.A N VAL 83.A O no hydrogen 3.041 N/A ASP 88.A N GLU 85.A O no hydrogen 3.080 N/A LEU 89.A N LEU 84.A O no hydrogen 3.096 N/A VAL 92.A N ARG 115.A O no hydrogen 2.825 N/A VAL 93.A N PRO 25.A O no hydrogen 2.958 N/A LEU 94.A N LYS 118.A O no hydrogen 2.999 N/A VAL 95.A N VAL 27.A O no hydrogen 2.882 N/A GLY 96.A N ALA 120.A O no hydrogen 2.908 N/A PHE 97.A N ILE 29.A O no hydrogen 3.025 N/A SER 98.A N LEU 122.A O no hydrogen 2.950 N/A SER 98.A OG.A HIS 259.A NE2 no hydrogen 2.773 N/A SER 98.A OG.B PHE 97.A O no hydrogen 3.244 N/A MET 99.A N SER 98.A OG.B no hydrogen 2.498 N/A GLY 100.A N PHE 97.A O no hydrogen 2.860 N/A THR 101.A N SER 98.A O no hydrogen 2.902 N/A THR 101.A OG1 SER 98.A O no hydrogen 2.656 N/A THR 101.A OG1 GLU 126.A OE1 no hydrogen 3.303 N/A GLY 102.A N MET 99.A O no hydrogen 2.964 N/A GLU 103.A N GLU 103.A OE1 no hydrogen 3.013 N/A LEU 104.A N GLY 100.A O no hydrogen 3.374 N/A ALA 105.A N THR 101.A O no hydrogen 3.469 N/A ARG 106.A N GLY 102.A O no hydrogen 3.006 N/A ARG 106.A NE ASP 211.A OD1 no hydrogen 3.357 N/A ARG 106.A NE ASP 211.A OD2 no hydrogen 2.701 N/A ARG 106.A NH1 ASP 74.A OD1 no hydrogen 2.925 N/A ARG 106.A NH1 GLU 206.A OE1 no hydrogen 2.860 N/A ARG 106.A NH2 GLU 206.A OE1 no hydrogen 2.858 N/A ARG 106.A NH2 ASP 211.A OD2 no hydrogen 3.122 N/A TYR 107.A N GLU 103.A O no hydrogen 2.813 N/A VAL 108.A N LEU 104.A O no hydrogen 3.183 N/A ALA 109.A N ALA 105.A O no hydrogen 3.003 N/A ARG 110.A N ARG 106.A O no hydrogen 2.905 N/A TYR 111.A N TYR 107.A O no hydrogen 2.782 N/A GLY 112.A N VAL 108.A O no hydrogen 2.870 N/A ARG 115.A NE GLU 85.A OE1 no hydrogen 2.690 N/A ARG 115.A NH1 ASP 88.A OD1 no hydrogen 2.816 N/A ARG 115.A NH1 LEU 89.A O no hydrogen 2.858 N/A ARG 115.A NH2 GLU 85.A OE2 no hydrogen 2.694 N/A ARG 115.A NH2 ASP 88.A OD1 no hydrogen 3.298 N/A VAL 116.A N HIS 113.A O no hydrogen 2.940 N/A ALA 117.A N VAL 92.A O no hydrogen 2.712 N/A LYS 118.A NZ LYS 279.A O no hydrogen 2.929 N/A LEU 119.A N PRO 221.A O no hydrogen 2.989 N/A ALA 120.A N LEU 94.A O no hydrogen 2.821 N/A PHE 121.A N LEU 223.A O no hydrogen 2.761 N/A LEU 122.A N GLY 96.A O no hydrogen 2.860 N/A ALA 123.A N LEU 225.A O no hydrogen 2.884 N/A LEU 125.A N THR 101.A OG1 no hydrogen 3.030 N/A GLU 126.A N GLU 126.A OE1 no hydrogen 2.909 N/A GLN 131.A N VAL 139.A O no hydrogen 2.781 N/A GLN 131.A NE2 PRO 136.A O no hydrogen 2.915 N/A ARG 132.A N ASN 135.A O no hydrogen 3.186 N/A ARG 132.A NH1 GLN 131.A O no hydrogen 3.401 N/A ARG 132.A NH1 GLN 141.A OE1.A no hydrogen 3.016 N/A ARG 132.A NH1 GLN 141.A OE1.B no hydrogen 2.895 N/A ARG 132.A NH2 GLN 141.A OE1.A no hydrogen 2.536 N/A ARG 132.A NH2 GLN 141.A OE1.B no hydrogen 3.369 N/A ASN 135.A N ARG 132.A O no hydrogen 2.871 N/A ASN 135.A ND2 PHE 128.A O no hydrogen 2.858 N/A ASN 135.A ND2 VAL 130.A O no hydrogen 2.860 N/A GLU 137.A N GLU 137.A OE1.A no hydrogen 2.763 N/A GLY 138.A N ASN 135.A O no hydrogen 3.200 N/A VAL 139.A N LEU 129.A O no hydrogen 2.736 N/A GLN 141.A NE2.A ASP 145.A OD1 no hydrogen 3.079 N/A GLN 141.A NE2.B ASP 145.A OD1 no hydrogen 3.456 N/A GLN 141.A NE2.B ASP 145.A OD2 no hydrogen 3.236 N/A VAL 143.A N PRO 140.A O no hydrogen 3.059 N/A PHE 144.A N GLN 141.A O no hydrogen 2.836 N/A ASP 145.A N GLN 141.A O no hydrogen 2.931 N/A GLY 146.A N GLU 142.A O no hydrogen 2.924 N/A ILE 147.A N VAL 143.A O no hydrogen 3.043 N/A GLU 148.A N PHE 144.A O no hydrogen 2.838 N/A ALA 149.A N ASP 145.A O no hydrogen 2.978 N/A ALA 150.A N GLY 146.A O no hydrogen 2.964 N/A ALA 151.A N ILE 147.A O no hydrogen 2.877 N/A LYS 152.A N GLU 148.A O no hydrogen 2.941 N/A GLY 153.A N ALA 149.A O no hydrogen 2.771 N/A ASP 154.A N ALA 150.A O no hydrogen 3.120 N/A ARG 155.A NH1 ILE 190.A O no hydrogen 3.010 N/A ALA 157.A N ASP 154.A OD1 no hydrogen 3.156 N/A TRP 158.A N ASP 154.A O no hydrogen 2.908 N/A TRP 158.A NE1 TYR 32.A OH no hydrogen 2.867 N/A PHE 159.A N ARG 155.A O no hydrogen 2.878 N/A THR 160.A OG1 PHE 156.A O no hydrogen 3.558 N/A ASP 161.A N ALA 157.A O no hydrogen 3.163 N/A PHE 162.A N TRP 158.A O no hydrogen 2.781 N/A TYR 163.A N PHE 159.A O no hydrogen 2.946 N/A TYR 163.A OH SER 185.A O no hydrogen 2.769 N/A LYS 164.A N THR 160.A O no hydrogen 3.346 N/A PHE 166.A N PHE 162.A O no hydrogen 2.785 N/A TYR 167.A N TYR 163.A O no hydrogen 3.016 N/A TYR 167.A OH SER 185.A OG no hydrogen 2.696 N/A ASN 168.A ND2 LYS 229.A O no hydrogen 2.872 N/A LEU 169.A N LYS 164.A O no hydrogen 2.965 N/A GLU 171.A N ASN 168.A O no hydrogen 2.976 N/A ASN 172.A N ASN 168.A O no hydrogen 2.860 N/A ASN 172.A ND2 TYR 167.A O no hydrogen 2.861 N/A LEU 173.A N LEU 169.A O no hydrogen 2.945 N/A GLY 174.A N ILE 177.A O no hydrogen 2.849 N/A SER 175.A N ASN 172.A O no hydrogen 3.090 N/A SER 175.A OG GLU 171.A O no hydrogen 3.344 N/A SER 175.A OG ASN 172.A O no hydrogen 3.294 N/A ARG 176.A N ASN 172.A O no hydrogen 2.843 N/A ARG 176.A NH1 THR 264.A O no hydrogen 2.860 N/A ILE 177.A N ASN 172.A O no hydrogen 3.092 N/A ALA 181.A N SER 178.A OG no hydrogen 2.994 N/A VAL 182.A N SER 178.A O no hydrogen 3.095 N/A THR 183.A N GLU 179.A O no hydrogen 2.933 N/A THR 183.A OG1 GLU 179.A O no hydrogen 3.189 N/A GLY 184.A N GLN 180.A O no hydrogen 2.913 N/A SER 185.A N ALA 181.A O no hydrogen 2.989 N/A SER 185.A OG TYR 167.A OH no hydrogen 2.696 N/A TRP 186.A N VAL 182.A O no hydrogen 3.044 N/A TRP 186.A NE1 PHE 156.A O no hydrogen 2.994 N/A ASN 187.A N THR 183.A O no hydrogen 2.842 N/A VAL 188.A N GLY 184.A O no hydrogen 3.107 N/A ALA 189.A N SER 185.A O no hydrogen 3.013 N/A ILE 190.A N TRP 186.A O no hydrogen 2.984 N/A GLY 191.A N VAL 188.A O no hydrogen 3.152 N/A SER 192.A N ALA 189.A O no hydrogen 3.073 N/A SER 192.A OG ALA 189.A O no hydrogen 2.663 N/A ALA 193.A N GLY 60.A O no hydrogen 2.815 N/A ALA 196.A N ALA 193.A O no hydrogen 2.889 N/A ALA 197.A N PRO 194.A O no hydrogen 3.223 N/A TYR 198.A N VAL 195.A O no hydrogen 3.218 N/A ALA 199.A N VAL 195.A O no hydrogen 2.861 N/A VAL 201.A N TYR 198.A O no hydrogen 3.036 N/A TRP 204.A N VAL 200.A O no hydrogen 3.012 N/A GLU 206.A N ALA 203.A O no hydrogen 3.141 N/A PHE 208.A N PRO 127.A O no hydrogen 2.855 N/A ARG 209.A N ASP 207.A OD1 no hydrogen 2.953 N/A ARG 209.A NE ASP 207.A OD1 no hydrogen 2.880 N/A ARG 209.A NE ASP 207.A OD2 no hydrogen 3.418 N/A ARG 209.A NH1 ASP 134.A O no hydrogen 2.924 N/A ARG 209.A NH2 ASP 134.A OD2 no hydrogen 2.820 N/A ARG 209.A NH2 ASP 207.A OD2 no hydrogen 2.964 N/A VAL 212.A N PHE 208.A O no hydrogen 2.811 N/A GLU 213.A N ARG 209.A O no hydrogen 3.230 N/A ALA 214.A N SER 210.A O no hydrogen 3.213 N/A VAL 215.A N ASP 211.A O no hydrogen 2.942 N/A ARG 216.A N VAL 212.A O no hydrogen 2.897 N/A ARG 216.A NE GLU 248.A OE1 no hydrogen 3.053 N/A ARG 216.A NE GLU 248.A OE2 no hydrogen 3.400 N/A ARG 216.A NH2 GLU 248.A OE2 no hydrogen 3.088 N/A ALA 217.A N GLU 213.A O no hydrogen 2.949 N/A ALA 218.A N ALA 214.A O no hydrogen 3.053 N/A ALA 218.A N VAL 215.A O no hydrogen 3.207 N/A GLY 219.A N ARG 216.A O no hydrogen 3.198 N/A LYS 220.A NZ HIS 113.A ND1 no hydrogen 2.867 N/A LYS 220.A NZ VAL 116.A O no hydrogen 2.774 N/A THR 222.A OG1 LYS 220.A O no hydrogen 2.846 N/A LEU 223.A N LEU 119.A O no hydrogen 2.901 N/A ILE 224.A N ASP 250.A O no hydrogen 2.830 N/A LEU 225.A N PHE 121.A O no hydrogen 2.928 N/A HIS 226.A N VAL 252.A O no hydrogen 2.980 N/A HIS 226.A NE2 LEU 233.A O no hydrogen 2.812 N/A THR 228.A N VAL 254.A O no hydrogen 3.012 N/A LYS 229.A N ALA 257.A O no hydrogen 2.832 N/A LYS 229.A NZ GLU 171.A OE2 no hydrogen 3.341 N/A ASP 230.A N GLY 227.A O no hydrogen 3.410 N/A ASN 231.A ND2 ASN 168.A OD1 no hydrogen 2.955 N/A ILE 232.A N ASP 230.A OD1 no hydrogen 2.870 N/A LEU 233.A N ASP 230.A OD1 no hydrogen 2.759 N/A ALA 237.A N PRO 234.A O no hydrogen 2.962 N/A THR 238.A N ILE 235.A O no hydrogen 3.426 N/A THR 238.A OG1 PRO 234.A O no hydrogen 2.871 N/A ARG 240.A N ILE 235.A O no hydrogen 3.022 N/A ARG 240.A NE GLU 253.A OE2 no hydrogen 2.838 N/A ARG 240.A NH1 ASP 236.A OD1 no hydrogen 2.893 N/A ARG 240.A NH2 GLU 253.A OE1 no hydrogen 2.947 N/A ARG 241.A NH1 PHE 128.A O no hydrogen 2.973 N/A ARG 241.A NH1 ALA 237.A O no hydrogen 2.927 N/A ARG 241.A NH2 ASN 135.A OD1 no hydrogen 2.699 N/A PHE 242.A N THR 238.A O no hydrogen 2.874 N/A HIS 243.A N ALA 239.A O no hydrogen 2.825 N/A GLN 244.A N ARG 240.A O no hydrogen 3.081 N/A ALA 245.A N ARG 241.A O no hydrogen 2.942 N/A VAL 246.A N PHE 242.A O no hydrogen 2.845 N/A VAL 246.A N HIS 243.A O no hydrogen 3.293 N/A ALA 249.A N VAL 246.A O no hydrogen 3.087 N/A ASP 250.A N THR 222.A O no hydrogen 2.794 N/A TYR 251.A OH GLU 253.A OE2 no hydrogen 2.600 N/A VAL 252.A N ILE 224.A O no hydrogen 2.861 N/A VAL 254.A N HIS 226.A O no hydrogen 2.781 N/A GLY 256.A N THR 228.A OG1 no hydrogen 2.851 N/A ALA 257.A N VAL 254.A O no hydrogen 3.233 N/A HIS 259.A ND1 ASP 230.A OD2 no hydrogen 2.808 N/A HIS 259.A NE2 SER 98.A OG.A no hydrogen 2.773 N/A GLY 260.A N PHE 166.A O no hydrogen 2.813 N/A TRP 263.A N GLY 260.A O no hydrogen 3.333 N/A THR 264.A N GLY 260.A O no hydrogen 3.276 N/A THR 264.A OG1 GLY 260.A O no hydrogen 3.441 N/A THR 264.A OG1 HIS 265.A ND1 no hydrogen 2.870 N/A HIS 265.A N LEU 261.A O no hydrogen 3.006 N/A HIS 265.A ND1 THR 264.A OG1 no hydrogen 2.870 N/A ALA 266.A N TRP 263.A O no hydrogen 3.401 N/A GLU 268.A N GLU 268.A OE1 no hydrogen 2.831 N/A VAL 269.A N HIS 265.A O no hydrogen 3.033 N/A ASN 270.A N ALA 266.A O no hydrogen 2.786 N/A ASN 270.A ND2 ARG 41.A O no hydrogen 3.081 N/A ALA 271.A N ASP 267.A O no hydrogen 2.902 N/A ALA 272.A N GLU 268.A O no hydrogen 3.073 N/A LEU 273.A N VAL 269.A O no hydrogen 2.920 N/A LYS 274.A N ASN 270.A O no hydrogen 2.822 N/A THR 275.A N ALA 271.A O no hydrogen 3.103 N/A THR 275.A OG1 ALA 271.A O no hydrogen 3.181 N/A PHE 276.A N ALA 272.A O no hydrogen 2.994 N/A LEU 277.A N LEU 273.A O no hydrogen 2.861 N/A ALA 278.A N LYS 274.A O no hydrogen 3.138 N/A LYS 279.A N PHE 276.A O no hydrogen 3.279 N/A LYS 279.A NZ ASP 250.A OD1 no hydrogen 3.308 N/A LYS 279.A NZ ASP 250.A OD2 no hydrogen 2.818 N/A