Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1j8y_F.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 5.A N LEU 1.A O no hydrogen 2.868 N/A ARG 6.A N LEU 2.A O no hydrogen 2.985 N/A ASP 7.A N ASN 4.A O no hydrogen 3.218 N/A THR 8.A N ASN 4.A O no hydrogen 3.344 N/A THR 8.A OG1 ASN 4.A O no hydrogen 3.190 N/A VAL 9.A N LEU 5.A O no hydrogen 2.858 N/A ARG 10.A N ARG 6.A O no hydrogen 3.130 N/A LYS 11.A N ASP 7.A O no hydrogen 3.035 N/A LYS 11.A NZ ASP 7.A O no hydrogen 3.279 N/A PHE 12.A N THR 8.A O no hydrogen 3.018 N/A LEU 13.A N VAL 9.A O no hydrogen 2.841 N/A THR 14.A N ARG 10.A O no hydrogen 3.091 N/A THR 14.A OG1 ARG 10.A O no hydrogen 3.283 N/A THR 14.A OG1 LYS 11.A O no hydrogen 3.120 N/A GLY 15.A N LEU 13.A O no hydrogen 2.636 N/A SER 17.A OG SER 18.A O no hydrogen 3.506 N/A LYS 21.A N SER 18.A OG no hydrogen 3.179 N/A LYS 21.A NZ ASP 25.A OD1 no hydrogen 3.239 N/A LYS 21.A NZ ASP 25.A OD2 no hydrogen 3.334 N/A ALA 22.A N SER 18.A O no hydrogen 2.857 N/A VAL 23.A N TYR 19.A O no hydrogen 2.886 N/A GLU 24.A N ASP 20.A O no hydrogen 2.977 N/A ASP 25.A N LYS 21.A O no hydrogen 2.808 N/A PHE 26.A N ALA 22.A O no hydrogen 2.927 N/A ILE 27.A N VAL 23.A O no hydrogen 2.825 N/A LYS 28.A N GLU 24.A O no hydrogen 3.037 N/A GLU 29.A N ASP 25.A O no hydrogen 3.096 N/A LEU 30.A N PHE 26.A O no hydrogen 2.904 N/A GLN 31.A N ILE 27.A O no hydrogen 2.845 N/A LYS 32.A N LYS 28.A O no hydrogen 2.925 N/A LYS 32.A NZ GLU 29.A OE2 no hydrogen 2.916 N/A SER 33.A N GLU 29.A O no hydrogen 2.839 N/A SER 33.A OG GLU 29.A O no hydrogen 3.034 N/A LEU 34.A N LEU 30.A O no hydrogen 2.877 N/A ILE 35.A N GLN 31.A O no hydrogen 2.908 N/A SER 36.A N LYS 32.A O no hydrogen 2.911 N/A SER 36.A OG LYS 32.A O no hydrogen 2.936 N/A ALA 37.A N SER 33.A O no hydrogen 2.930 N/A ALA 37.A N LEU 34.A O no hydrogen 2.956 N/A ASP 38.A N ILE 35.A O no hydrogen 2.931 N/A VAL 39.A N LEU 34.A O no hydrogen 3.100 N/A VAL 44.A N ASN 40.A O no hydrogen 3.055 N/A PHE 45.A N VAL 41.A O no hydrogen 2.908 N/A SER 46.A N LYS 42.A O no hydrogen 3.011 N/A SER 46.A OG LYS 42.A O no hydrogen 3.085 N/A LEU 47.A N LEU 43.A O no hydrogen 2.928 N/A THR 48.A N VAL 44.A O no hydrogen 3.098 N/A THR 48.A OG1 GLN 31.A OE1 no hydrogen 3.297 N/A THR 48.A OG1 VAL 44.A O no hydrogen 3.146 N/A THR 48.A OG1 PHE 45.A O no hydrogen 3.185 N/A ASN 49.A N PHE 45.A O no hydrogen 3.015 N/A LYS 50.A N SER 46.A O no hydrogen 2.892 N/A LYS 50.A NZ GLU 77.A OE1 no hydrogen 2.837 N/A ILE 51.A N LEU 47.A O no hydrogen 2.976 N/A LYS 52.A N THR 48.A O no hydrogen 2.970 N/A GLU 53.A N ASN 49.A O no hydrogen 2.930 N/A ARG 54.A N LYS 50.A O no hydrogen 2.922 N/A ARG 54.A NE GLU 58.A OE1 no hydrogen 3.383 N/A ARG 54.A NE GLU 58.A OE2 no hydrogen 2.825 N/A ARG 54.A NH1 GLU 77.A OE2 no hydrogen 2.847 N/A ARG 54.A NH2 GLU 58.A OE1 no hydrogen 2.780 N/A LEU 55.A N ILE 51.A O no hydrogen 3.055 N/A LYS 56.A N GLU 53.A O no hydrogen 2.857 N/A LYS 56.A NZ LYS 52.A O no hydrogen 3.485 N/A LYS 56.A NZ GLU 53.A OE1 no hydrogen 2.694 N/A ASN 57.A N GLU 53.A O no hydrogen 3.117 N/A ASN 57.A N ARG 54.A O no hydrogen 3.266 N/A GLU 58.A N ARG 54.A O no hydrogen 2.787 N/A LYS 59.A NZ PRO 60.A O no hydrogen 3.492 N/A ILE 64.A N PRO 61.A O no hydrogen 3.045 N/A ARG 67.A NH1 PHE 12.A O no hydrogen 2.853 N/A ARG 67.A NH2 SER 17.A O no hydrogen 2.657 N/A TRP 69.A N GLU 65.A O no hydrogen 2.943 N/A TRP 69.A NE1 GLU 58.A O no hydrogen 2.830 N/A PHE 70.A N ARG 66.A O no hydrogen 3.034 N/A ILE 71.A N ARG 67.A O no hydrogen 3.210 N/A LYS 72.A N GLU 68.A O no hydrogen 3.004 N/A LYS 72.A NZ ASP 76.A OD2 no hydrogen 2.515 N/A ILE 73.A N TRP 69.A O no hydrogen 3.070 N/A VAL 74.A N PHE 70.A O no hydrogen 2.927 N/A TYR 75.A N ILE 71.A O no hydrogen 2.796 N/A TYR 75.A OH HIS 289.A ND1 no hydrogen 2.656 N/A ASP 76.A N LYS 72.A O no hydrogen 3.000 N/A GLU 77.A N ILE 73.A O no hydrogen 3.029 N/A LEU 78.A N VAL 74.A O no hydrogen 2.985 N/A SER 79.A N TYR 75.A O no hydrogen 3.023 N/A ASN 80.A N ASP 76.A O no hydrogen 3.137 N/A LEU 81.A N GLU 77.A O no hydrogen 2.835 N/A PHE 82.A N LEU 78.A O no hydrogen 3.154 N/A PHE 82.A N SER 79.A O no hydrogen 3.103 N/A GLY 83.A N ASN 80.A O no hydrogen 2.818 N/A GLY 84.A N SER 79.A O no hydrogen 2.707 N/A LYS 89.A NZ ILE 91.A O no hydrogen 3.141 N/A LYS 89.A NZ ASP 93.A OD2 no hydrogen 3.110 N/A LYS 94.A NZ ASP 208.A OD1 no hydrogen 2.796 N/A TYR 97.A N GLU 176.A O no hydrogen 2.734 N/A TYR 97.A OH GLU 209.A OE1 no hydrogen 2.574 N/A VAL 98.A N ASP 208.A OD2 no hydrogen 2.734 N/A ILE 99.A N ILE 178.A O no hydrogen 2.714 N/A MET 100.A N GLU 209.A O no hydrogen 2.862 N/A LEU 101.A N VAL 180.A O no hydrogen 2.843 N/A VAL 102.A N THR 211.A O no hydrogen 2.919 N/A GLN 105.A NE2 GLY 184.A O no hydrogen 2.747 N/A LYS 111.A N THR 107.A O no hydrogen 2.727 N/A LYS 111.A NZ GLY 269.A O no hydrogen 2.546 N/A LYS 111.A NZ GLU 274.A O no hydrogen 2.925 N/A LEU 112.A N THR 108.A O no hydrogen 2.832 N/A ALA 113.A N ALA 109.A O no hydrogen 3.031 N/A TYR 114.A N GLY 110.A O no hydrogen 2.910 N/A PHE 115.A N LYS 111.A O no hydrogen 2.914 N/A TYR 116.A N LEU 112.A O no hydrogen 3.084 N/A TYR 116.A OH VAL 90.A O no hydrogen 2.705 N/A LYS 117.A N ALA 113.A O no hydrogen 2.884 N/A LYS 118.A N TYR 114.A O no hydrogen 2.903 N/A LYS 118.A NZ TYR 114.A OH no hydrogen 3.398 N/A LYS 119.A N PHE 115.A O no hydrogen 3.304 N/A LYS 119.A N TYR 116.A O no hydrogen 3.046 N/A GLY 120.A N LYS 117.A O no hydrogen 2.834 N/A PHE 121.A N TYR 116.A O no hydrogen 3.108 N/A LYS 122.A N GLU 176.A OE2 no hydrogen 2.728 N/A GLY 124.A N ILE 177.A O no hydrogen 2.888 N/A LEU 125.A N PRO 149.A O no hydrogen 2.758 N/A VAL 126.A N ILE 179.A O no hydrogen 2.838 N/A GLY 127.A N TYR 151.A O no hydrogen 2.806 N/A ALA 128.A N ASP 181.A O no hydrogen 2.819 N/A TYR 131.A OH GLU 197.A OE2 no hydrogen 3.050 N/A ALA 135.A N ARG 132.A O no hydrogen 3.271 N/A GLN 138.A N ALA 134.A O no hydrogen 2.904 N/A LEU 139.A N ALA 135.A O no hydrogen 2.838 N/A GLN 140.A N LEU 136.A O no hydrogen 2.858 N/A GLN 141.A N GLU 137.A O no hydrogen 2.960 N/A LEU 142.A N GLN 138.A O no hydrogen 2.905 N/A GLY 143.A N LEU 139.A O no hydrogen 2.786 N/A GLN 144.A N GLN 140.A O no hydrogen 2.938 N/A GLN 144.A NE2 GLN 144.A O no hydrogen 3.685 N/A GLN 145.A N GLN 141.A O no hydrogen 2.928 N/A ILE 146.A N LEU 142.A O no hydrogen 2.929 N/A VAL 148.A N GLY 143.A O no hydrogen 2.929 N/A TYR 151.A N LEU 125.A O no hydrogen 2.637 N/A TYR 151.A OH GLU 153.A OE2 no hydrogen 2.600 N/A GLU 156.A N GLU 153.A O no hydrogen 2.958 N/A LYS 157.A N GLU 156.A OE2 no hydrogen 2.998 N/A ASP 158.A N GLU 156.A OE2 no hydrogen 2.778 N/A VAL 159.A N LYS 157.A O no hydrogen 2.904 N/A GLY 161.A N ASP 158.A OD1 no hydrogen 2.895 N/A ILE 162.A N ASP 158.A O no hydrogen 3.005 N/A ALA 163.A N VAL 159.A O no hydrogen 2.991 N/A LYS 164.A N VAL 160.A O no hydrogen 3.028 N/A ARG 165.A N GLY 161.A O no hydrogen 3.015 N/A ARG 165.A NE GLU 153.A OE1 no hydrogen 3.360 N/A ARG 165.A NE GLU 153.A OE2 no hydrogen 2.748 N/A ARG 165.A NH1 GLU 153.A OE1 no hydrogen 2.657 N/A ARG 165.A NH1 GLU 153.A OE2 no hydrogen 3.509 N/A GLY 166.A N ILE 162.A O no hydrogen 2.728 N/A VAL 167.A N ALA 163.A O no hydrogen 2.860 N/A GLU 168.A N LYS 164.A O no hydrogen 2.941 N/A LYS 169.A N ARG 165.A O no hydrogen 2.893 N/A LYS 169.A NZ GLU 173.A OE1 no hydrogen 2.626 N/A PHE 170.A N GLY 166.A O no hydrogen 3.051 N/A LEU 171.A N VAL 167.A O no hydrogen 2.820 N/A SER 172.A N GLU 168.A O no hydrogen 3.128 N/A SER 172.A OG GLU 168.A O no hydrogen 2.972 N/A GLU 173.A N LYS 169.A O no hydrogen 3.117 N/A LYS 174.A N LEU 171.A O no hydrogen 3.178 N/A MET 175.A N PHE 170.A O no hydrogen 2.986 N/A GLU 176.A N LYS 122.A O no hydrogen 2.802 N/A ILE 177.A N LYS 122.A O no hydrogen 3.026 N/A ILE 178.A N TYR 97.A O no hydrogen 2.815 N/A ILE 179.A N GLY 124.A O no hydrogen 2.959 N/A VAL 180.A N ILE 99.A O no hydrogen 2.751 N/A ASP 181.A N VAL 126.A O no hydrogen 2.863 N/A THR 182.A N LEU 101.A O no hydrogen 3.191 N/A THR 182.A OG1 LEU 101.A O no hydrogen 2.632 N/A ARG 185.A N GLU 197.A OE1 no hydrogen 2.698 N/A GLY 187.A N GLU 190.A OE1 no hydrogen 2.887 N/A GLY 189.A N GLU 191.A OE1 no hydrogen 2.617 N/A GLU 190.A N GLY 187.A O no hydrogen 3.181 N/A LEU 194.A N GLU 190.A O no hydrogen 3.015 N/A LEU 195.A N GLU 191.A O no hydrogen 2.853 N/A GLU 196.A N ALA 192.A O no hydrogen 3.073 N/A GLU 197.A N ALA 193.A O no hydrogen 3.003 N/A MET 198.A N LEU 194.A O no hydrogen 3.229 N/A MET 198.A N LEU 195.A O no hydrogen 2.895 N/A LYS 199.A N LEU 195.A O no hydrogen 3.381 N/A LYS 199.A N GLU 196.A O no hydrogen 3.183 N/A TYR 202.A N MET 198.A O no hydrogen 3.103 N/A GLU 203.A N LYS 199.A O no hydrogen 2.955 N/A ALA 204.A N ASN 200.A O no hydrogen 3.321 N/A ILE 205.A N ILE 201.A O no hydrogen 3.104 N/A LYS 206.A N TYR 202.A O no hydrogen 2.676 N/A ASP 208.A N VAL 98.A O no hydrogen 2.844 N/A GLU 209.A N VAL 98.A O no hydrogen 3.195 N/A VAL 210.A N ILE 235.A O no hydrogen 3.045 N/A THR 211.A N MET 100.A O no hydrogen 2.780 N/A THR 211.A OG1 THR 237.A OG1 no hydrogen 2.836 N/A LEU 212.A N THR 237.A O no hydrogen 2.885 N/A VAL 213.A N VAL 102.A O no hydrogen 2.906 N/A ILE 214.A N ILE 239.A O no hydrogen 2.860 N/A ALA 216.A N THR 241.A O no hydrogen 2.843 N/A SER 217.A N ASP 215.A OD2 no hydrogen 2.887 N/A SER 217.A OG ASP 215.A OD2 no hydrogen 3.033 N/A ILE 218.A N ASP 215.A O no hydrogen 3.052 N/A GLY 219.A N ALA 216.A O no hydrogen 3.100 N/A GLN 220.A N ASP 38.A OD2 no hydrogen 2.901 N/A GLN 220.A NE2 ASN 40.A OD1 no hydrogen 2.824 N/A LYS 221.A N ILE 218.A O no hydrogen 3.301 N/A ALA 222.A N GLY 219.A O no hydrogen 3.186 N/A TYR 223.A N GLN 220.A O no hydrogen 3.124 N/A ALA 226.A N ALA 222.A O no hydrogen 3.009 N/A SER 227.A N TYR 223.A O no hydrogen 2.804 N/A LYS 228.A N ASP 224.A O no hydrogen 3.108 N/A PHE 229.A N LEU 225.A O no hydrogen 2.799 N/A ASN 230.A N ALA 226.A O no hydrogen 2.928 N/A GLN 231.A N SER 227.A O no hydrogen 3.238 N/A ALA 232.A N LYS 228.A O no hydrogen 3.060 N/A THR 237.A N VAL 210.A O no hydrogen 2.860 N/A THR 237.A OG1 GLU 209.A OE2 no hydrogen 2.549 N/A ILE 238.A N THR 262.A O no hydrogen 2.846 N/A ILE 239.A N LEU 212.A O no hydrogen 2.982 N/A ILE 240.A N PHE 265.A O no hydrogen 3.258 N/A THR 241.A N ILE 214.A O no hydrogen 2.797 N/A THR 241.A OG1 ILE 214.A O no hydrogen 3.481 N/A MET 243.A N GLY 267.A O no hydrogen 3.044 N/A GLY 245.A N LYS 242.A O no hydrogen 3.239 N/A ALA 252.A N LYS 248.A O no hydrogen 3.060 N/A LEU 253.A N GLY 249.A O no hydrogen 2.915 N/A SER 254.A N GLY 250.A O no hydrogen 2.983 N/A SER 254.A OG GLY 250.A O no hydrogen 2.761 N/A SER 254.A OG GLY 251.A O no hydrogen 3.110 N/A ALA 255.A N GLY 251.A O no hydrogen 2.894 N/A VAL 256.A N ALA 252.A O no hydrogen 2.930 N/A ALA 257.A N LEU 253.A O no hydrogen 2.752 N/A ALA 258.A N SER 254.A O no hydrogen 2.984 N/A THR 259.A N VAL 256.A O no hydrogen 2.987 N/A THR 259.A OG1 VAL 256.A O no hydrogen 2.664 N/A GLY 260.A N ALA 257.A O no hydrogen 2.919 N/A ALA 261.A N THR 259.A OG1 no hydrogen 3.141 N/A LYS 264.A N ILE 238.A O no hydrogen 2.958 N/A LYS 264.A NZ LYS 89.A O no hydrogen 3.131 N/A LYS 264.A NZ GLU 209.A OE1 no hydrogen 3.073 N/A LYS 264.A NZ GLU 209.A OE2 no hydrogen 2.755 N/A ILE 266.A N GLU 276.A O no hydrogen 2.957 N/A GLY 267.A N ILE 240.A O no hydrogen 2.633 N/A THR 268.A N GLU 274.A O no hydrogen 3.220 N/A LYS 271.A N GLU 274.A OE1 no hydrogen 2.682 N/A GLU 274.A N LYS 271.A O no hydrogen 2.843 N/A GLU 276.A N ILE 266.A O no hydrogen 3.054 N/A PHE 278.A N LYS 264.A O no hydrogen 2.873 N/A ARG 281.A NE ASP 85.A OD2 no hydrogen 3.302 N/A ARG 282.A NE GLU 87.A OE2 no hydrogen 3.036 N/A ARG 282.A NH2 GLU 87.A OE1 no hydrogen 2.920 N/A ARG 282.A NH2 VAL 277.A O no hydrogen 3.013 N/A PHE 283.A N ASN 279.A O no hydrogen 2.804 N/A VAL 284.A N PRO 280.A O no hydrogen 2.915 N/A ALA 285.A N ARG 281.A O no hydrogen 2.902 N/A HIS 288.A N ALA 285.A O no hydrogen 3.005 N/A HIS 289.A N TYR 75.A OH no hydrogen 3.270 N/A HIS 289.A ND1 TYR 75.A OH no hydrogen 2.656 N/A HIS 289.A NE2 GLU 68.A OE1 no hydrogen 2.870 N/A HIS 290.A N HIS 288.A ND1 no hydrogen 2.692 N/A HIS 291.A NE2 ARG 286.A O no hydrogen 2.801 N/A