Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8hqi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A N GLN 297.A OE1 no hydrogen 2.790 N/A PHE 6.A N SER 111.A OG no hydrogen 2.754 N/A SER 8.A OG GLU 12.A OE1 no hydrogen 2.633 N/A VAL 11.A N SER 8.A O no hydrogen 2.949 N/A GLU 12.A N SER 8.A O no hydrogen 2.902 N/A GLY 13.A N GLY 9.A O no hydrogen 3.230 N/A CYS 14.A N VAL 11.A O no hydrogen 2.905 N/A CYS 14.A SG LYS 10.A O no hydrogen 3.497 N/A MET 15.A N GLU 12.A O no hydrogen 3.261 N/A VAL 16.A N GLY 27.A O no hydrogen 2.913 N/A GLN 17.A N GLN 67.A O no hydrogen 2.930 N/A GLN 17.A NE2 GLY 69.A O no hydrogen 3.188 N/A VAL 18.A N LEU 25.A O no hydrogen 2.804 N/A THR 19.A N LEU 65.A O no hydrogen 2.768 N/A THR 19.A OG1 THR 24.A OG1 no hydrogen 2.648 N/A CYS 20.A N THR 23.A O no hydrogen 3.013 N/A CYS 20.A SG ASN 63.A O no hydrogen 3.558 N/A THR 23.A N CYS 20.A O no hydrogen 3.091 N/A THR 24.A OG1 THR 19.A OG1 no hydrogen 2.648 N/A LEU 25.A N VAL 18.A O no hydrogen 2.858 N/A ASN 26.A N CYS 143.A O no hydrogen 3.097 N/A ASN 26.A ND2 CYS 115.A O no hydrogen 2.911 N/A ASN 26.A ND2 GLY 141.A O no hydrogen 3.362 N/A ASN 26.A ND2 SER 142.A O no hydrogen 3.305 N/A ASN 26.A ND2 CYS 143.A O no hydrogen 2.969 N/A GLY 27.A N VAL 16.A O no hydrogen 2.912 N/A LEU 28.A N TYR 35.A O no hydrogen 2.882 N/A TRP 29.A N CYS 14.A O no hydrogen 2.706 N/A TRP 29.A NE1 THR 91.A O no hydrogen 3.034 N/A LEU 30.A N VAL 33.A O no hydrogen 2.926 N/A ASP 31.A N THR 96.A OG1 no hydrogen 2.881 N/A VAL 33.A N LEU 30.A O no hydrogen 3.059 N/A VAL 34.A N LEU 87.A O no hydrogen 2.813 N/A TYR 35.A N LEU 28.A O no hydrogen 2.895 N/A CYS 36.A N LEU 85.A O no hydrogen 3.043 N/A CYS 36.A SG PRO 37.A O no hydrogen 3.700 N/A ARG 38.A N CYS 83.A O no hydrogen 3.028 N/A ARG 38.A NE ASP 185.A OD2 no hydrogen 2.791 N/A ARG 38.A NH2 ASP 185.A OD1 no hydrogen 2.993 N/A ARG 38.A NH2 ASP 185.A OD2 no hydrogen 3.534 N/A HIS 39.A NE2 HIS 162.A ND1 no hydrogen 3.003 N/A VAL 40.A N PRO 37.A O no hydrogen 3.304 N/A ILE 41.A N ARG 38.A O no hydrogen 3.240 N/A CYS 42.A N HIS 39.A O no hydrogen 3.057 N/A THR 43.A OG1 GLU 45.A OE1 no hydrogen 3.191 N/A SER 44.A OG GLU 45.A OE2 no hydrogen 2.440 N/A ASP 46.A N THR 43.A O no hydrogen 2.886 N/A TYR 52.A OH ASP 185.A O no hydrogen 2.641 N/A ASP 54.A N ASN 51.A OD1 no hydrogen 3.196 N/A LEU 55.A N ASN 51.A O no hydrogen 2.747 N/A LEU 56.A N TYR 52.A O no hydrogen 2.796 N/A ILE 57.A N GLU 53.A O no hydrogen 3.214 N/A ARG 58.A N LEU 55.A O no hydrogen 3.316 N/A LYS 59.A N LEU 56.A O no hydrogen 2.971 N/A SER 60.A N ASN 63.A OD1 no hydrogen 2.760 N/A ASN 63.A N SER 60.A O no hydrogen 2.980 N/A PHE 64.A N ASN 61.A O no hydrogen 3.218 N/A LEU 65.A N THR 19.A O no hydrogen 2.907 N/A GLN 67.A N GLN 17.A O no hydrogen 2.913 N/A ALA 68.A N VAL 71.A O no hydrogen 2.849 N/A VAL 71.A N ALA 68.A O no hydrogen 3.013 N/A LEU 73.A N VAL 66.A O no hydrogen 2.837 N/A ILE 76.A N LYS 88.A O no hydrogen 2.710 N/A GLY 77.A N LYS 88.A O no hydrogen 3.344 N/A HIS 78.A ND1 ASN 61.A OD1 no hydrogen 2.763 N/A SER 79.A N LYS 86.A O no hydrogen 3.050 N/A GLN 81.A N VAL 84.A O no hydrogen 2.952 N/A ASN 82.A ND2 GLU 176.A O no hydrogen 2.777 N/A CYS 83.A N GLY 177.A O no hydrogen 2.979 N/A CYS 83.A SG ASP 185.A OD1 no hydrogen 3.749 N/A CYS 83.A SG ASP 185.A OD2 no hydrogen 3.662 N/A VAL 84.A N GLN 81.A O no hydrogen 3.009 N/A LEU 85.A N CYS 36.A O no hydrogen 2.728 N/A LYS 86.A N SER 79.A O no hydrogen 2.848 N/A LYS 86.A NZ GLN 81.A OE1 no hydrogen 2.719 N/A LEU 87.A N VAL 34.A O no hydrogen 2.795 N/A LYS 88.A N GLY 77.A O no hydrogen 2.831 N/A VAL 89.A N ASP 32.A O no hydrogen 2.915 N/A ASP 90.A N ARG 74.A O no hydrogen 3.044 N/A THR 91.A OG1 ASP 90.A OD1 no hydrogen 2.867 N/A ASN 93.A N ASP 31.A O no hydrogen 2.858 N/A ASN 93.A ND2 GLY 13.A O no hydrogen 3.066 N/A ASN 93.A ND2 TRP 29.A O no hydrogen 3.005 N/A LYS 95.A N ASN 93.A OD1 no hydrogen 2.869 N/A THR 96.A N ASN 93.A O no hydrogen 3.125 N/A THR 96.A OG1 ASN 93.A O no hydrogen 2.718 N/A LYS 100.A N VAL 155.A O no hydrogen 2.885 N/A VAL 102.A N PHE 157.A O no hydrogen 2.929 N/A ARG 103.A NH1 ASP 174.A OD2 no hydrogen 2.981 N/A ARG 103.A NH1 ASN 178.A O no hydrogen 3.056 N/A ARG 103.A NH2 PHE 179.A O no hydrogen 2.885 N/A ILE 104.A N TYR 180.A OH no hydrogen 3.024 N/A GLN 105.A NE2 ASP 243.A OD2 no hydrogen 2.987 N/A GLY 107.A N MET 128.A O no hydrogen 2.683 N/A GLN 108.A N GLN 105.A O no hydrogen 3.117 N/A THR 109.A OG1 ASP 293.A OD2 no hydrogen 2.784 N/A PHE 110.A N CYS 126.A O no hydrogen 2.861 N/A SER 111.A N PHE 148.A O no hydrogen 2.818 N/A SER 111.A OG GLN 125.A OE1 no hydrogen 2.496 N/A VAL 112.A N TYR 124.A O no hydrogen 2.820 N/A LEU 113.A N VAL 146.A O no hydrogen 3.095 N/A ALA 114.A N GLY 122.A O no hydrogen 2.863 N/A CYS 115.A N SER 145.A OG no hydrogen 2.977 N/A CYS 115.A SG LEU 113.A O no hydrogen 3.657 N/A TYR 116.A N SER 119.A O no hydrogen 3.087 N/A GLY 118.A N ASN 26.A OD1 no hydrogen 2.772 N/A SER 119.A N TYR 116.A O no hydrogen 2.926 N/A SER 121.A N ALA 114.A O no hydrogen 2.748 N/A GLY 122.A N ALA 114.A O no hydrogen 3.410 N/A TYR 124.A N VAL 112.A O no hydrogen 3.201 N/A TYR 124.A OH SER 137.A O no hydrogen 2.933 N/A CYS 126.A N PHE 110.A O no hydrogen 2.806 N/A CYS 126.A SG LYS 135.A O no hydrogen 4.020 N/A MET 128.A N GLN 108.A O no hydrogen 2.955 N/A ARG 129.A N THR 133.A O no hydrogen 2.869 N/A ARG 129.A NE ASP 195.A OD1 no hydrogen 2.923 N/A ARG 129.A NH1 ASP 287.A OD1 no hydrogen 3.102 N/A ARG 129.A NH1 ASP 287.A OD2 no hydrogen 3.364 N/A ARG 129.A NH1 GLU 288.A OE2 no hydrogen 2.982 N/A ARG 129.A NH2 ASP 195.A OD1 no hydrogen 3.495 N/A ARG 129.A NH2 THR 196.A O no hydrogen 3.107 N/A ARG 129.A NH2 ASP 287.A OD2 no hydrogen 2.864 N/A ASN 131.A ND2 GLY 193.A O no hydrogen 2.929 N/A PHE 132.A N ARG 129.A O no hydrogen 2.841 N/A THR 133.A OG1 ASN 131.A OD1 no hydrogen 2.800 N/A ILE 134.A N HIS 170.A O no hydrogen 2.925 N/A GLY 136.A N HIS 170.A ND1 no hydrogen 3.230 N/A SER 137.A N TYR 124.A OH no hydrogen 2.835 N/A LEU 139.A N TYR 116.A OH no hydrogen 2.865 N/A SER 142.A N LEU 139.A O no hydrogen 3.121 N/A SER 142.A OG LEU 139.A O no hydrogen 2.621 N/A CYS 143.A SG HIS 162.A O no hydrogen 3.190 N/A GLY 144.A N HIS 161.A O no hydrogen 2.951 N/A SER 145.A N SER 142.A O no hydrogen 3.059 N/A SER 145.A OG SER 142.A O no hydrogen 2.684 N/A GLY 147.A N TYR 159.A O no hydrogen 2.836 N/A PHE 148.A N SER 111.A O no hydrogen 2.758 N/A ASN 149.A N SER 156.A O no hydrogen 3.056 N/A ASN 149.A ND2 THR 109.A O no hydrogen 3.060 N/A ASP 151.A N CYS 154.A O no hydrogen 2.914 N/A CYS 154.A N ASP 151.A O no hydrogen 2.790 N/A VAL 155.A N LYS 98.A O no hydrogen 2.853 N/A SER 156.A N ASN 149.A O no hydrogen 2.788 N/A PHE 157.A N LYS 100.A O no hydrogen 2.850 N/A CYS 158.A N GLY 147.A O no hydrogen 3.010 N/A TYR 159.A N GLY 147.A O no hydrogen 3.398 N/A TYR 159.A OH HIS 161.A ND1 no hydrogen 2.854 N/A MET 160.A N THR 173.A O no hydrogen 2.754 N/A HIS 161.A N SER 145.A O no hydrogen 2.842 N/A HIS 161.A ND1 TYR 159.A OH no hydrogen 2.854 N/A HIS 162.A N ALA 171.A O no hydrogen 3.260 N/A HIS 162.A ND1 HIS 39.A NE2 no hydrogen 3.003 N/A HIS 162.A NE2 THR 173.A OG1 no hydrogen 2.904 N/A MET 163.A N ALA 171.A O no hydrogen 2.919 N/A LEU 165.A N VAL 169.A O no hydrogen 2.755 N/A GLY 168.A N LEU 165.A O no hydrogen 2.817 N/A HIS 170.A N ILE 134.A O no hydrogen 2.885 N/A HIS 170.A NE2 GLU 164.A OE2 no hydrogen 3.043 N/A ALA 171.A N MET 163.A O no hydrogen 2.800 N/A THR 173.A N MET 160.A O no hydrogen 2.972 N/A THR 173.A OG1 HIS 162.A NE2 no hydrogen 2.904 N/A THR 173.A OG1 ASP 174.A O no hydrogen 2.881 N/A ASP 174.A N ASN 178.A O no hydrogen 2.992 N/A GLU 176.A N ASP 174.A OD1 no hydrogen 3.054 N/A GLY 177.A N ASP 174.A O no hydrogen 3.024 N/A ASN 178.A N ASP 174.A OD1 no hydrogen 2.885 N/A TYR 180.A N GLY 172.A O no hydrogen 3.057 N/A TYR 180.A OH CYS 158.A O no hydrogen 2.667 N/A VAL 184.A N GLN 190.A OE1 no hydrogen 2.981 N/A ARG 186.A N VAL 184.A O no hydrogen 3.050 N/A GLN 187.A N MET 47.A O no hydrogen 2.765 N/A GLN 190.A NE2 VAL 184.A O no hydrogen 2.999 N/A GLN 190.A NE2 THR 188.A O no hydrogen 3.542 N/A THR 196.A OG1 GLU 238.A OE1 no hydrogen 2.701 N/A THR 197.A N ASN 236.A O no hydrogen 2.878 N/A ILE 198.A N ASP 287.A OD2 no hydrogen 2.841 N/A THR 199.A OG1 GLU 238.A O no hydrogen 2.526 N/A ASN 201.A N ILE 198.A O no hydrogen 3.086 N/A ASN 201.A ND2 GLY 107.A O no hydrogen 2.857 N/A ASN 201.A ND2 ASP 287.A O no hydrogen 2.973 N/A VAL 202.A N ILE 198.A O no hydrogen 3.062 N/A LEU 203.A N THR 199.A O no hydrogen 2.931 N/A ALA 204.A N VAL 200.A O no hydrogen 3.053 N/A TRP 205.A N ASN 201.A O no hydrogen 2.866 N/A LEU 206.A N VAL 202.A O no hydrogen 2.857 N/A TYR 207.A N LEU 203.A O no hydrogen 2.941 N/A TYR 207.A OH ILE 257.A O no hydrogen 2.751 N/A ALA 208.A N ALA 204.A O no hydrogen 2.891 N/A ALA 209.A N TRP 205.A O no hydrogen 2.969 N/A VAL 210.A N LEU 206.A O no hydrogen 3.021 N/A ILE 211.A N TYR 207.A O no hydrogen 2.870 N/A ASN 212.A N ALA 208.A O no hydrogen 3.170 N/A ASN 212.A N ALA 209.A O no hydrogen 3.035 N/A GLY 213.A N VAL 210.A O no hydrogen 2.993 N/A ASP 214.A N ALA 209.A O no hydrogen 2.891 N/A TRP 216.A NE1 THR 278.A O no hydrogen 2.768 N/A LEU 218.A N ARG 215.A O no hydrogen 3.111 N/A ASN 219.A N SER 265.A OG no hydrogen 3.273 N/A ASN 219.A ND2 ALA 264.A O no hydrogen 3.660 N/A THR 222.A OG1 ASP 261.A OD1 no hydrogen 2.644 N/A THR 223.A OG1 THR 224.A O no hydrogen 3.108 N/A ASP 227.A N THR 224.A OG1 no hydrogen 3.003 N/A PHE 228.A N THR 224.A O no hydrogen 3.089 N/A ASN 229.A N LEU 225.A O no hydrogen 2.947 N/A ASN 229.A ND2 LEU 240.A O no hydrogen 3.135 N/A LEU 230.A N ASN 226.A O no hydrogen 3.027 N/A VAL 231.A N ASP 227.A O no hydrogen 3.139 N/A ALA 232.A N PHE 228.A O no hydrogen 2.729 N/A MET 233.A N ASN 229.A O no hydrogen 3.084 N/A LYS 234.A N VAL 231.A O no hydrogen 2.924 N/A TYR 235.A N ALA 232.A O no hydrogen 2.861 N/A ASN 236.A N MET 233.A O no hydrogen 3.321 N/A ASN 236.A ND2 ASP 195.A O no hydrogen 3.339 N/A TYR 237.A N ALA 232.A O no hydrogen 3.046 N/A GLU 238.A N THR 197.A O no hydrogen 3.065 N/A LEU 240.A N ASN 229.A OD1 no hydrogen 2.805 N/A THR 241.A N HIS 244.A ND1 no hydrogen 2.969 N/A GLN 242.A NE2 ASP 246.A OD2 no hydrogen 3.097 N/A HIS 244.A N THR 241.A OG1 no hydrogen 3.052 N/A VAL 245.A N THR 241.A O no hydrogen 3.117 N/A ASP 246.A N GLN 242.A O no hydrogen 2.978 N/A ILE 247.A N ASP 243.A O no hydrogen 2.943 N/A LEU 248.A N HIS 244.A O no hydrogen 3.183 N/A GLY 249.A N ASP 246.A O no hydrogen 3.002 N/A SER 252.A N LEU 248.A O no hydrogen 2.968 N/A SER 252.A OG ILE 257.A O no hydrogen 2.767 N/A ALA 253.A N GLY 249.A O no hydrogen 2.911 N/A GLN 254.A N PRO 250.A O no hydrogen 2.952 N/A THR 255.A N LEU 251.A O no hydrogen 3.070 N/A THR 255.A OG1 LEU 251.A O no hydrogen 2.909 N/A THR 255.A OG1 SER 252.A O no hydrogen 3.454 N/A ILE 257.A N THR 255.A OG1 no hydrogen 3.362 N/A MET 262.A N ALA 258.A O no hydrogen 2.952 N/A CYS 263.A N VAL 259.A O no hydrogen 2.855 N/A CYS 263.A SG VAL 259.A O no hydrogen 3.471 N/A ALA 264.A N LEU 260.A O no hydrogen 3.030 N/A SER 265.A N ASP 261.A O no hydrogen 3.024 N/A SER 265.A OG PHE 217.A O no hydrogen 3.340 N/A SER 265.A OG ASN 219.A OD1 no hydrogen 3.289 N/A SER 265.A OG ASP 261.A O no hydrogen 3.525 N/A LEU 266.A N MET 262.A O no hydrogen 2.924 N/A LYS 267.A N CYS 263.A O no hydrogen 2.816 N/A LYS 267.A NZ THR 223.A OG1 no hydrogen 2.735 N/A GLU 268.A N ALA 264.A O no hydrogen 3.075 N/A LEU 269.A N SER 265.A O no hydrogen 3.074 N/A LEU 270.A N LEU 266.A O no hydrogen 2.870 N/A GLN 271.A N LYS 267.A O no hydrogen 2.927 N/A ASN 272.A N GLU 268.A O no hydrogen 2.861 N/A GLY 273.A N LEU 269.A O no hydrogen 2.827 N/A ARG 277.A N MET 274.A O no hydrogen 3.009 N/A ILE 279.A N SER 282.A O no hydrogen 2.845 N/A LEU 280.A N ASP 214.A OD2 no hydrogen 2.927 N/A SER 282.A N ILE 279.A O no hydrogen 3.109 N/A SER 282.A OG LEU 284.A O no hydrogen 3.329 N/A GLU 288.A N GLU 286.A OE1 no hydrogen 3.024 N/A THR 290.A N ASP 293.A OD2 no hydrogen 2.981 N/A THR 290.A OG1 ASP 293.A OD2 no hydrogen 2.995 N/A ASP 293.A N THR 290.A OG1 no hydrogen 3.025 N/A VAL 294.A N THR 290.A O no hydrogen 2.999 N/A VAL 295.A N PRO 291.A O no hydrogen 3.181 N/A ARG 296.A N PHE 292.A O no hydrogen 2.780 N/A ARG 296.A NH1 ALA 5.A O no hydrogen 3.301 N/A ARG 296.A NH2 MET 4.A O no hydrogen 3.344 N/A GLN 297.A N VAL 294.A O no hydrogen 3.255 N/A CYS 298.A N VAL 294.A O no hydrogen 2.846 N/A CYS 298.A SG VAL 294.A O no hydrogen 3.448 N/A