Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3dfj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N HIS 131.A O no hydrogen 2.795 N/A ILE 1.A N ASP 193.A OD1 no hydrogen 3.555 N/A ILE 1.A N ASP 193.A OD2 no hydrogen 2.642 N/A THR 2.A N ASP 188.A O no hydrogen 2.871 N/A THR 2.A OG1 VAL 132.A O no hydrogen 2.735 N/A SER 5.A N GLN 146.A O no hydrogen 2.928 N/A ALA 7.A N LEU 144.A O no hydrogen 2.859 N/A VAL 8.A N GLN 11.A OE1 no hydrogen 3.062 N/A GLN 11.A N VAL 8.A O no hydrogen 3.058 N/A TRP 12.A NE1 GLN 146.A OE1 no hydrogen 2.939 N/A TRP 14.A NE1 SER 199.A OG no hydrogen 3.073 N/A GLN 15.A N TRP 12.A O no hydrogen 2.971 N/A GLN 15.A NE2 VAL 16.A O no hydrogen 3.024 N/A VAL 16.A N GLY 28.A O no hydrogen 2.985 N/A SER 17.A N LYS 55.A O no hydrogen 3.005 N/A SER 17.A OG HIS 24.A ND1 no hydrogen 2.798 N/A ILE 18.A N CYS 26.A O no hydrogen 2.865 N/A THR 19.A N GLU 53.A O no hydrogen 2.892 N/A TYR 20.A N VAL 23.A O no hydrogen 2.899 N/A GLU 21.A N ALA 51.A O no hydrogen 2.870 N/A VAL 23.A N TYR 20.A O no hydrogen 3.133 N/A HIS 24.A ND1 SER 17.A OG no hydrogen 2.798 N/A HIS 24.A NE2 GLY 192.A O no hydrogen 2.810 N/A VAL 25.A N ILE 18.A O no hydrogen 2.859 N/A CYS 26.A N ILE 18.A O no hydrogen 3.329 N/A CYS 26.A SG VAL 25.A O no hydrogen 3.103 N/A CYS 26.A SG SER 194.A OG no hydrogen 3.598 N/A GLY 27.A N SER 194.A O no hydrogen 2.795 N/A GLY 28.A N VAL 16.A O no hydrogen 3.210 N/A SER 29.A N LEU 37.A O no hydrogen 2.829 N/A LEU 30.A N TRP 14.A O no hydrogen 2.836 N/A VAL 31.A N TRP 35.A O no hydrogen 2.973 N/A SER 32.A N TRP 35.A O no hydrogen 3.430 N/A GLN 34.A N SER 32.A OG no hydrogen 3.406 N/A GLN 34.A NE2 LEU 244.A O no hydrogen 2.896 N/A TRP 35.A N SER 32.A OG no hydrogen 3.193 N/A VAL 36.A N LEU 94.A O no hydrogen 2.920 N/A LEU 37.A N SER 29.A O no hydrogen 2.797 N/A SER 38.A N ALA 92.A O no hydrogen 2.958 N/A SER 38.A OG GLY 27.A O no hydrogen 2.769 N/A HIS 41.A N ASP 90.A OD1 no hydrogen 2.846 N/A HIS 41.A ND1 ASP 90.A OD2 no hydrogen 2.733 N/A HIS 41.A NE2 SER 194.A OG no hydrogen 2.701 N/A CYS 42.A N ALA 39.A O no hydrogen 3.105 N/A CYS 42.A SG HIS 41.A NE2 no hydrogen 3.676 N/A PHE 43.A N ALA 40.A O no hydrogen 3.010 N/A GLU 46.A N GLU 46.A OE1 no hydrogen 2.862 N/A HIS 47.A N PRO 44.A O no hydrogen 3.122 N/A HIS 47.A ND1 TYR 52.A OH no hydrogen 2.902 N/A LYS 49.A NZ LYS 74.A O.A no hydrogen 2.642 N/A LYS 49.A NZ LYS 74.A O.B no hydrogen 2.959 N/A GLU 50.A N GLU 50.A OE1 no hydrogen 2.722 N/A ALA 51.A N HIS 48.A O no hydrogen 3.012 N/A TYR 52.A N LYS 49.A O no hydrogen 3.210 N/A GLU 53.A N THR 19.A O no hydrogen 3.031 N/A VAL 54.A N SER 71.A O.A no hydrogen 2.881 N/A VAL 54.A N SER 71.A O.B no hydrogen 2.812 N/A LYS 55.A N SER 17.A O no hydrogen 2.779 N/A LYS 55.A NZ LEU 61.A O no hydrogen 2.819 N/A LEU 56.A N LYS 69.A O no hydrogen 2.775 N/A GLN 60.A NE2 SER 63.A OG no hydrogen 2.742 N/A LEU 61.A N LYS 142.A O no hydrogen 3.093 N/A ASP 62.A N PRO 141.A O no hydrogen 3.070 N/A SER 63.A N GLN 60.A O no hydrogen 3.160 N/A ASP 67.A N SER 65.A OG no hydrogen 3.046 N/A ALA 68.A N SER 65.A O no hydrogen 3.341 N/A LYS 69.A N LEU 56.A O no hydrogen 2.873 N/A LYS 69.A NZ ALA 68.A O no hydrogen 3.141 N/A SER 71.A N.A VAL 54.A O no hydrogen 2.854 N/A SER 71.A N.B VAL 54.A O no hydrogen 2.861 N/A SER 71.A OG.B THR 72.A O no hydrogen 2.813 N/A THR 72.A OG1 SER 97.A OG no hydrogen 2.708 N/A LYS 74.A N.A GLN 95.A O no hydrogen 2.716 N/A LYS 74.A N.B GLN 95.A O no hydrogen 2.741 N/A ASP 75.A N GLN 95.A O no hydrogen 3.408 N/A ILE 76.A N ASP 75.A OD1 no hydrogen 2.845 N/A ILE 77.A N LEU 93.A O no hydrogen 2.770 N/A HIS 79.A N ILE 91.A O no hydrogen 2.966 N/A HIS 79.A ND1 SER 81.A OG no hydrogen 2.751 N/A SER 81.A N HIS 79.A ND1 no hydrogen 3.124 N/A SER 81.A OG HIS 79.A ND1 no hydrogen 2.751 N/A TYR 82.A N HIS 79.A O no hydrogen 3.007 N/A LEU 83.A N SER 87.A OG.A no hydrogen 2.928 N/A LEU 83.A N SER 87.A OG.B no hydrogen 3.237 N/A SER 87.A N.A GLN 84.A O no hydrogen 3.071 N/A SER 87.A N.B GLN 84.A O no hydrogen 3.051 N/A SER 87.A OG.A GLN 84.A O no hydrogen 2.723 N/A SER 87.A OG.A GLN 88.A O no hydrogen 3.464 N/A SER 87.A OG.B GLN 88.A O no hydrogen 2.790 N/A GLY 89.A N ASP 176.A OD2 no hydrogen 2.846 N/A ILE 91.A N GLY 89.A O no hydrogen 2.777 N/A ALA 92.A N SER 38.A O no hydrogen 2.861 N/A LEU 93.A N ILE 77.A O no hydrogen 2.921 N/A LEU 94.A N VAL 36.A O no hydrogen 2.781 N/A GLN 95.A N ASP 75.A O no hydrogen 2.891 N/A GLN 95.A NE2 GLN 34.A OE1 no hydrogen 2.917 N/A LEU 96.A N GLN 34.A O no hydrogen 2.847 N/A SER 97.A N THR 72.A O no hydrogen 2.896 N/A SER 97.A OG THR 72.A OG1 no hydrogen 2.708 N/A ILE 100.A N GLU 33.A O no hydrogen 2.871 N/A SER 103.A N ILE 106.A O no hydrogen 2.916 N/A TYR 105.A N SER 103.A OG no hydrogen 3.133 N/A ILE 106.A N SER 103.A O no hydrogen 3.214 N/A ARG 107.A N.A PRO 13.A O no hydrogen 3.158 N/A ARG 107.A N.B PRO 13.A O no hydrogen 3.148 N/A ARG 107.A NE.A SER 103.A O no hydrogen 2.685 N/A ILE 109.A N LEU 30.A O no hydrogen 3.001 N/A ALA 116.A N ALA 113.A O no hydrogen 3.104 N/A GLY 121.A N LEU 151.A O no hydrogen 2.922 N/A LEU 122.A N PRO 119.A O no hydrogen 3.079 N/A CYS 124.A N VAL 149.A O no hydrogen 2.957 N/A CYS 124.A SG LEU 122.A O no hydrogen 3.836 N/A THR 125.A N SER 199.A O no hydrogen 2.857 N/A VAL 126.A N LEU 147.A O no hydrogen 2.956 N/A THR 127.A OG1 GLN 15.A OE1 no hydrogen 2.662 N/A GLY 128.A N GLN 145.A O no hydrogen 3.023 N/A TRP 129.A NE1 HIS 59.A O no hydrogen 2.959 N/A GLY 130.A N ASP 193.A OD1 no hydrogen 2.758 N/A HIS 131.A N GLN 191.A O.A no hydrogen 2.854 N/A HIS 131.A N GLN 191.A O.B no hydrogen 3.018 N/A VAL 132.A N VAL 136.A O no hydrogen 2.935 N/A VAL 136.A N ALA 133.A O no hydrogen 2.854 N/A THR 140.A OG1 ASP 62.A OD1 no hydrogen 2.699 N/A LYS 142.A N LEU 139.A O no hydrogen 2.878 N/A LYS 142.A NZ LEU 138.A O no hydrogen 2.768 N/A LEU 144.A N HIS 59.A O no hydrogen 2.889 N/A GLN 145.A N GLY 128.A O no hydrogen 3.124 N/A GLN 145.A NE2 SER 6.A OG no hydrogen 2.936 N/A GLN 145.A NE2 PRO 143.A O no hydrogen 3.069 N/A GLN 146.A N SER 5.A O no hydrogen 2.797 N/A GLN 146.A NE2 SER 5.A OG no hydrogen 3.098 N/A LEU 147.A N VAL 126.A O no hydrogen 2.915 N/A VAL 149.A N CYS 124.A O no hydrogen 2.767 N/A LEU 151.A N LEU 122.A O no hydrogen 2.993 N/A ILE 152.A N CYS 179.A O no hydrogen 2.803 N/A SER 153.A OG GLU 155.A OE1 no hydrogen 3.510 N/A ARG 154.A NE VAL 173.A O no hydrogen 3.192 N/A ARG 154.A NE GLN 174.A O no hydrogen 2.956 N/A ARG 154.A NH2 VAL 173.A O no hydrogen 2.897 N/A GLU 155.A N GLU 155.A OE1 no hydrogen 2.874 N/A THR 156.A N SER 153.A OG no hydrogen 3.087 N/A CYS 157.A N SER 153.A O no hydrogen 2.935 N/A ASN 158.A N ARG 154.A O no hydrogen 2.821 N/A ASN 158.A ND2 VAL 173.A O no hydrogen 3.146 N/A ALA 159.A N GLU 155.A O no hydrogen 3.303 N/A LEU 160.A N THR 156.A O no hydrogen 2.953 N/A TYR 161.A N CYS 157.A O no hydrogen 2.904 N/A TYR 161.A OH PRO 224.A O no hydrogen 2.708 N/A ASN 162.A N ASN 158.A O no hydrogen 3.140 N/A ILE 163.A N LEU 160.A O no hydrogen 3.011 N/A GLU 168.A N GLU 168.A OE1 no hydrogen 2.921 N/A GLU 169.A N LYS 166.A O no hydrogen 2.950 N/A HIS 171.A NE2 GLU 169.A OE2 no hydrogen 2.683 N/A VAL 173.A N ASN 158.A OD1 no hydrogen 2.783 N/A GLN 174.A NE2 GLY 86.A O no hydrogen 2.910 N/A MET 177.A N GLN 174.A O no hydrogen 3.028 N/A VAL 178.A N TYR 227.A O no hydrogen 2.886 N/A CYS 179.A N ILE 152.A O no hydrogen 2.982 N/A ALA 180.A N GLY 225.A O no hydrogen 3.081 N/A GLY 181.A N PRO 150.A O no hydrogen 3.064 N/A TYR 182.A OH GLU 148.A O no hydrogen 2.613 N/A GLU 184.A N.B GLU 184.A OE1.B no hydrogen 2.814 N/A GLY 186.A N GLY 219.A O no hydrogen 2.696 N/A ASP 188.A N THR 2.A O no hydrogen 3.185 N/A ALA 189.A N ASP 188.A OD2 no hydrogen 2.683 N/A CYS 190.A N ASP 193.A OD2 no hydrogen 2.842 N/A CYS 190.A SG HIS 131.A O no hydrogen 3.328 N/A CYS 190.A SG ASP 188.A O no hydrogen 4.008 N/A ASP 193.A N CYS 190.A O no hydrogen 2.969 N/A SER 194.A OG HIS 41.A NE2 no hydrogen 2.701 N/A GLY 195.A N VAL 212.A O no hydrogen 2.844 N/A GLY 196.A N ASP 193.A O no hydrogen 3.083 N/A LEU 198.A N GLY 210.A O no hydrogen 2.880 N/A SER 199.A N THR 125.A O no hydrogen 2.832 N/A CYS 200.A N TYR 207.A O no hydrogen 2.929 N/A CYS 200.A SG THR 209.A OG1 no hydrogen 2.916 N/A VAL 202.A N LEU 205.A O no hydrogen 3.015 N/A LEU 205.A N VAL 202.A O no hydrogen 3.025 N/A TYR 207.A N CYS 200.A O no hydrogen 2.917 N/A LEU 208.A N SER 110.A O no hydrogen 2.965 N/A THR 209.A N LEU 198.A O no hydrogen 3.024 N/A GLY 210.A N LEU 198.A O no hydrogen 3.348 N/A ILE 211.A N THR 228.A O no hydrogen 2.914 N/A VAL 212.A N GLY 196.A O no hydrogen 2.887 N/A SER 213.A N VAL 226.A O no hydrogen 2.764 N/A SER 213.A OG ASP 90.A OD2 no hydrogen 2.732 N/A TRP 214.A N VAL 226.A O no hydrogen 2.975 N/A CYS 218.A N ALA 189.A O no hydrogen 3.082 N/A ALA 220.A N ALA 217.A O no hydrogen 3.290 N/A ARG 221.A NH2 ASP 164.A OD2 no hydrogen 3.396 N/A ASN 222.A N VAL 183.A O no hydrogen 2.882 N/A ARG 223.A NH1 ILE 163.A O no hydrogen 2.900 N/A ARG 223.A NH2 ILE 163.A O no hydrogen 3.104 N/A ARG 223.A NH2 ASN 222.A O no hydrogen 2.907 N/A GLY 225.A N ASP 188.A OD1 no hydrogen 2.923 N/A VAL 226.A N TRP 214.A O no hydrogen 3.057 N/A TYR 227.A N VAL 178.A O no hydrogen 2.777 N/A THR 228.A N ILE 211.A O no hydrogen 2.866 N/A THR 228.A OG1 ASP 90.A O no hydrogen 2.813 N/A LEU 229.A N ASP 176.A O no hydrogen 2.844 N/A ALA 230.A N THR 209.A O no hydrogen 3.051 N/A SER 232.A N LEU 229.A O no hydrogen 3.134 N/A TYR 233.A N ALA 230.A O no hydrogen 2.949 N/A TYR 233.A OH ASP 176.A OD2 no hydrogen 2.504 N/A ALA 234.A N SER 231.A O no hydrogen 3.404 N/A ILE 237.A N TYR 233.A O no hydrogen 2.874 N/A GLN 238.A N ALA 234.A O no hydrogen 2.981 N/A SER 239.A N SER 235.A O no hydrogen 2.991 N/A LYS 240.A N TRP 236.A O no hydrogen 3.002 N/A VAL 241.A N ILE 237.A O no hydrogen 2.894 N/A THR 242.A N GLN 238.A O no hydrogen 2.985 N/A THR 242.A OG1 GLN 238.A O no hydrogen 2.726 N/A GLU 243.A N SER 239.A O no hydrogen 3.045 N/A LEU 244.A N LYS 240.A O no hydrogen 3.091 N/A