Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8ec5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 3.A N VAL 85.A O no hydrogen 2.930 N/A HIS 3.A ND1 ASP 29.A OD2 no hydrogen 2.624 N/A SER 4.A N ASP 29.A OD1 no hydrogen 2.880 N/A SER 4.A OG ASP 29.A OD1 no hydrogen 3.540 N/A MET 5.A N CYS 83.A O no hydrogen 2.887 N/A ARG 6.A N TYR 27.A O no hydrogen 2.902 N/A ARG 6.A NH1 MET 5.A O no hydrogen 2.954 N/A ARG 6.A NH1 CYS 83.A O no hydrogen 3.348 N/A ARG 6.A NH1 ASP 84.A OD1 no hydrogen 3.080 N/A ARG 6.A NH2 ASP 84.A OD1 no hydrogen 2.812 N/A TYR 7.A N TYR 81.A O no hydrogen 2.866 N/A PHE 8.A N VAL 25.A O no hydrogen 2.896 N/A ASP 9.A N SER 79.A O no hydrogen 2.890 N/A THR 10.A N ILE 23.A O no hydrogen 2.783 N/A ALA 11.A N LEU 77.A O no hydrogen 2.804 N/A MET 12.A N ARG 21.A O no hydrogen 2.932 N/A SER 13.A N HIS 75.A O no hydrogen 2.903 N/A SER 13.A OG HIS 75.A O no hydrogen 3.442 N/A ARG 14.A NE GLU 19.A O no hydrogen 2.875 N/A ARG 14.A NH1 ASP 39.A OD2 no hydrogen 2.896 N/A ARG 14.A NH2 GLU 19.A O no hydrogen 2.947 N/A ARG 14.A NH2 ASP 39.A OD1 no hydrogen 2.908 N/A ARG 14.A NH2 ASP 39.A OD2 no hydrogen 3.547 N/A ARG 17.A N ARG 14.A O no hydrogen 2.844 N/A ARG 21.A N MET 12.A O no hydrogen 3.053 N/A ARG 21.A NE ASP 37.A OD1 no hydrogen 3.075 N/A ARG 21.A NH2 ASP 37.A OD2 no hydrogen 2.867 N/A PHE 22.A N SER 38.A OG no hydrogen 2.920 N/A ILE 23.A N THR 10.A O no hydrogen 2.881 N/A SER 24.A N PHE 36.A O no hydrogen 2.874 N/A SER 24.A OG ASP 9.A OD1 no hydrogen 2.632 N/A VAL 25.A N PHE 8.A O no hydrogen 3.020 N/A GLY 26.A N VAL 34.A O no hydrogen 2.938 N/A TYR 27.A N ARG 6.A O no hydrogen 2.797 N/A VAL 28.A N THR 31.A O no hydrogen 2.885 N/A ASP 29.A N SER 4.A O no hydrogen 2.896 N/A THR 31.A N VAL 28.A O no hydrogen 2.868 N/A THR 31.A OG1 TYR 191.A OH no hydrogen 2.766 N/A PHE 33.A N GLY 26.A O no hydrogen 2.803 N/A VAL 34.A N GLY 26.A O no hydrogen 3.454 N/A PHE 36.A N SER 24.A O no hydrogen 2.845 N/A SER 38.A N PHE 22.A O no hydrogen 2.798 N/A SER 38.A OG PHE 22.A O no hydrogen 3.370 N/A ASP 39.A N ASP 37.A OD1 no hydrogen 2.996 N/A ALA 40.A N ASP 37.A O no hydrogen 2.956 N/A THR 46.A N TRP 42.A O no hydrogen 3.019 N/A THR 46.A OG1 TRP 42.A O no hydrogen 3.466 N/A GLN 47.A N ASP 43.A O no hydrogen 2.897 N/A ILE 48.A N ARG 44.A O no hydrogen 3.134 N/A PHE 49.A N ASN 45.A O no hydrogen 2.967 N/A LYS 50.A N THR 46.A O no hydrogen 2.916 N/A THR 51.A N GLN 47.A O no hydrogen 2.913 N/A THR 51.A OG1 GLN 47.A O no hydrogen 3.083 N/A ASN 52.A N ILE 48.A O no hydrogen 2.786 N/A THR 53.A N PHE 49.A O no hydrogen 2.943 N/A THR 53.A OG1 PHE 49.A O no hydrogen 3.061 N/A GLN 54.A N LYS 50.A O no hydrogen 3.367 N/A THR 55.A N THR 51.A O no hydrogen 2.865 N/A THR 55.A OG1 THR 51.A O no hydrogen 3.091 N/A ASP 56.A N ASN 52.A O no hydrogen 2.886 N/A ARG 57.A N THR 53.A O no hydrogen 3.071 N/A ARG 57.A NE PRO 20.A O no hydrogen 2.844 N/A ARG 57.A NH2 PRO 20.A O no hydrogen 2.841 N/A CYS 58.A N GLN 54.A O no hydrogen 2.948 N/A SER 59.A N THR 55.A O no hydrogen 2.910 N/A SER 59.A OG THR 55.A O no hydrogen 3.075 N/A LEU 60.A N ASP 56.A O no hydrogen 2.922 N/A ARG 61.A N ARG 57.A O no hydrogen 3.083 N/A ASN 62.A N CYS 58.A O no hydrogen 2.982 N/A LEU 63.A N SER 59.A O no hydrogen 2.840 N/A ARG 64.A N LEU 60.A O no hydrogen 3.057 N/A ARG 64.A NH1 GLN 69.A O no hydrogen 2.876 N/A GLY 65.A N ARG 61.A O no hydrogen 3.300 N/A TYR 66.A N ASN 62.A O no hydrogen 2.892 N/A TYR 67.A N LEU 63.A O no hydrogen 3.166 N/A TYR 67.A N ARG 64.A O no hydrogen 3.357 N/A TYR 67.A OH ASP 119.A OD1 no hydrogen 3.323 N/A TYR 67.A OH ASP 119.A OD2 no hydrogen 2.575 N/A ASN 68.A N GLY 65.A O no hydrogen 3.060 N/A GLN 69.A N ARG 64.A O no hydrogen 2.882 N/A ALA 72.A N SER 70.A OG no hydrogen 3.230 N/A SER 74.A OG SER 13.A O no hydrogen 3.341 N/A HIS 75.A N SER 13.A OG no hydrogen 2.909 N/A HIS 75.A ND1 ASP 101.A OD2 no hydrogen 2.726 N/A THR 76.A N ASP 101.A OD1 no hydrogen 2.922 N/A LEU 77.A N ALA 11.A O no hydrogen 2.829 N/A GLN 78.A N ALA 99.A O no hydrogen 2.871 N/A SER 79.A N ASP 9.A O no hydrogen 2.896 N/A MET 80.A N GLN 97.A O no hydrogen 2.883 N/A TYR 81.A N TYR 7.A O no hydrogen 3.200 N/A GLY 82.A N HIS 95.A O no hydrogen 3.012 N/A CYS 83.A N MET 5.A O no hydrogen 3.004 N/A ASP 84.A N ARG 93.A O no hydrogen 2.888 N/A VAL 85.A N HIS 3.A O no hydrogen 2.798 N/A GLY 86.A N ARG 90.A O no hydrogen 2.991 N/A GLY 89.A N GLY 86.A O no hydrogen 2.757 N/A ARG 90.A N ASP 88.A OD1 no hydrogen 3.176 N/A LEU 92.A N ASP 84.A O no hydrogen 2.727 N/A ARG 93.A N ASP 84.A O no hydrogen 3.454 N/A ARG 93.A NE GLY 94.A O no hydrogen 3.010 N/A ARG 93.A NH2 GLY 94.A O no hydrogen 3.042 N/A HIS 95.A N GLY 82.A O no hydrogen 2.871 N/A HIS 95.A NE2 ASP 84.A OD2 no hydrogen 2.767 N/A GLN 97.A N MET 80.A O no hydrogen 2.860 N/A TYR 98.A N ILE 106.A O no hydrogen 2.870 N/A TYR 98.A OH ASN 96.A OD1 no hydrogen 2.773 N/A ALA 99.A N GLN 78.A O no hydrogen 2.896 N/A TYR 100.A N LYS 103.A O no hydrogen 2.899 N/A TYR 100.A OH GLN 69.A OE1 no hydrogen 2.652 N/A ASP 101.A N THR 76.A O no hydrogen 2.812 N/A LYS 103.A N TYR 100.A O no hydrogen 3.015 N/A TYR 105.A N TYR 98.A O no hydrogen 2.891 N/A TYR 105.A OH THR 125.A OG1 no hydrogen 2.747 N/A ILE 106.A N TYR 98.A O no hydrogen 3.467 N/A ALA 107.A N THR 116.A O no hydrogen 3.027 N/A LEU 108.A N ASN 96.A O no hydrogen 2.886 N/A ASN 109.A N SER 114.A O no hydrogen 2.810 N/A ASN 109.A ND2 SER 114.A OG no hydrogen 2.847 N/A LEU 112.A N ASN 109.A O no hydrogen 2.878 N/A ARG 113.A N ASP 111.A OD1 no hydrogen 2.838 N/A SER 114.A N ASP 111.A OD1 no hydrogen 3.064 N/A SER 114.A OG ASP 111.A OD1 no hydrogen 3.082 N/A SER 114.A OG ASP 111.A OD2 no hydrogen 2.765 N/A THR 116.A N ALA 107.A O no hydrogen 2.892 N/A THR 116.A OG1 ASN 109.A OD1 no hydrogen 2.634 N/A ALA 118.A N TYR 105.A O no hydrogen 2.913 N/A ALA 122.A N ASP 119.A OD1 no hydrogen 2.838 N/A GLN 123.A N ASP 119.A O no hydrogen 2.998 N/A ILE 124.A N ALA 121.A O no hydrogen 2.892 N/A THR 125.A N ALA 121.A O no hydrogen 3.469 N/A THR 125.A OG1 TYR 105.A OH no hydrogen 2.747 N/A GLN 126.A N ALA 122.A O no hydrogen 2.815 N/A GLN 126.A NE2 GLU 130.A OE2 no hydrogen 2.871 N/A ARG 127.A N GLN 123.A O no hydrogen 2.926 N/A LYS 128.A N ILE 124.A O no hydrogen 2.986 N/A TRP 129.A N THR 125.A O no hydrogen 2.859 N/A GLU 130.A N GLN 126.A O no hydrogen 2.807 N/A ALA 131.A N ARG 127.A O no hydrogen 2.947 N/A ALA 132.A N LYS 128.A O no hydrogen 3.040 N/A ARG 133.A N GLU 130.A O no hydrogen 3.192 N/A ARG 133.A NH1 GLU 136.A OE2 no hydrogen 2.640 N/A VAL 134.A N TRP 129.A O no hydrogen 2.971 N/A GLU 136.A N GLU 136.A OE1 no hydrogen 2.873 N/A ASP 138.A N VAL 134.A O no hydrogen 3.009 N/A ARG 139.A N ALA 135.A O no hydrogen 2.765 N/A ARG 139.A NE GLU 143.A OE1 no hydrogen 2.850 N/A ALA 140.A N GLU 136.A O no hydrogen 3.101 N/A TYR 141.A N GLN 137.A O no hydrogen 3.125 N/A LEU 142.A N ASP 138.A O no hydrogen 2.853 N/A GLU 143.A N ARG 139.A O no hydrogen 2.923 N/A GLY 144.A N ALA 140.A O no hydrogen 3.007 N/A CYS 146.A N TYR 141.A O no hydrogen 2.828 N/A GLU 148.A N GLY 144.A O no hydrogen 2.980 N/A TRP 149.A N THR 145.A O no hydrogen 2.903 N/A LEU 150.A N CYS 146.A O no hydrogen 2.886 N/A ARG 151.A N VAL 147.A O no hydrogen 2.938 N/A ARG 151.A NE GLY 89.A O no hydrogen 2.726 N/A ARG 151.A NH2 GLY 89.A O no hydrogen 2.874 N/A ARG 152.A N GLU 148.A O no hydrogen 3.046 N/A TYR 153.A N TRP 149.A O no hydrogen 2.851 N/A LEU 154.A N LEU 150.A O no hydrogen 2.903 N/A GLU 155.A N ARG 151.A O no hydrogen 3.092 N/A ASN 156.A N ARG 152.A O no hydrogen 2.915 N/A GLY 157.A N TYR 153.A O no hydrogen 2.789 N/A LYS 158.A N GLU 155.A O no hydrogen 3.304 N/A LYS 158.A NZ GLU 155.A O no hydrogen 3.262 N/A LYS 158.A NZ GLU 155.A OE2 no hydrogen 3.102 N/A THR 160.A N GLY 157.A O no hydrogen 3.012 N/A THR 160.A OG1 GLY 157.A O no hydrogen 3.264 N/A LEU 161.A N GLY 157.A O no hydrogen 2.778 N/A GLU 162.A N LYS 158.A O no hydrogen 3.292 N/A ARG 163.A N THR 160.A O no hydrogen 3.128 N/A ARG 163.A NE ASP 165.A OD1 no hydrogen 2.836 N/A ARG 163.A NH1 ASP 159.A O no hydrogen 2.764 N/A ARG 163.A NH2 ASP 165.A OD2 no hydrogen 3.188 N/A ASP 165.A N TYR 191.A O no hydrogen 2.811 N/A LYS 168.A N LEU 188.A O no hydrogen 2.769 N/A HIS 170.A N TRP 186.A O no hydrogen 3.358 N/A THR 172.A N ARG 184.A O no hydrogen 2.868 N/A HIS 173.A NE2 GLU 236.A OE2 no hydrogen 2.815 N/A HIS 174.A N THR 182.A O no hydrogen 2.909 N/A ILE 176.A N GLU 180.A O no hydrogen 2.981 N/A SER 177.A N GLU 180.A O no hydrogen 3.293 N/A HIS 179.A N SER 177.A OG no hydrogen 3.146 N/A ALA 181.A N VAL 231.A O no hydrogen 2.944 N/A THR 182.A N HIS 174.A O no hydrogen 2.822 N/A LEU 183.A N VAL 229.A O no hydrogen 2.825 N/A ARG 184.A N THR 172.A O no hydrogen 2.955 N/A CYS 185.A N ALA 227.A O no hydrogen 2.782 N/A TRP 186.A N HIS 170.A O no hydrogen 2.889 N/A ALA 187.A N LYS 225.A O no hydrogen 2.917 N/A LEU 188.A N LYS 168.A O no hydrogen 2.858 N/A PHE 190.A N PHE 223.A O no hydrogen 3.309 N/A TYR 191.A N ASP 165.A O no hydrogen 2.981 N/A TYR 191.A OH THR 31.A OG1 no hydrogen 2.766 N/A ALA 193.A N ASP 30.A OD2 no hydrogen 2.887 N/A THR 196.A N GLN 244.A O no hydrogen 3.020 N/A THR 198.A N HIS 242.A O no hydrogen 3.005 N/A TRP 199.A NE1 ALA 227.A O no hydrogen 2.941 N/A GLN 200.A N THR 240.A O no hydrogen 2.788 N/A GLN 200.A NE2 ASP 205.A OD1 no hydrogen 3.032 N/A ARG 201.A N GLU 204.A O no hydrogen 2.915 N/A ARG 201.A NH1 GLU 235.A OE1 no hydrogen 2.769 N/A ARG 201.A NH1 TYR 239.A OH no hydrogen 2.781 N/A ARG 201.A NH2 GLU 235.A OE1 no hydrogen 3.217 N/A ASP 202.A N ARG 238.A O no hydrogen 2.896 N/A GLU 204.A N ARG 201.A O no hydrogen 3.015 N/A GLN 206.A N TRP 199.A O no hydrogen 3.107 N/A ASP 209.A N GLN 206.A O no hydrogen 2.990 N/A THR 210.A N THR 207.A O no hydrogen 3.440 N/A THR 210.A OG1 GLN 206.A O no hydrogen 2.736 N/A GLU 211.A N ALA 228.A O no hydrogen 2.782 N/A VAL 213.A N TRP 226.A O no hydrogen 3.237 N/A ARG 216.A N GLN 224.A O no hydrogen 2.953 N/A ARG 216.A NE GLN 224.A OE1 no hydrogen 2.940 N/A ARG 216.A NH2 GLN 224.A OE1 no hydrogen 3.080 N/A ALA 218.A N THR 222.A O no hydrogen 2.873 N/A ARG 221.A NE ASP 165.A OD2 no hydrogen 3.404 N/A ARG 221.A NH1 THR 160.A O no hydrogen 2.917 N/A ARG 221.A NH2 THR 160.A O no hydrogen 3.379 N/A ARG 221.A NH2 ARG 163.A O no hydrogen 2.989 N/A ARG 221.A NH2 ASP 165.A OD2 no hydrogen 2.818 N/A THR 222.A N ASP 220.A OD1 no hydrogen 3.019 N/A THR 222.A OG1 ASP 220.A OD1 no hydrogen 2.642 N/A PHE 223.A N PHE 190.A O no hydrogen 2.835 N/A GLN 224.A N ARG 216.A O no hydrogen 2.870 N/A LYS 225.A N ALA 187.A O no hydrogen 2.934 N/A LYS 225.A NZ VAL 213.A O no hydrogen 2.839 N/A LYS 225.A NZ THR 215.A OG1 no hydrogen 2.957 N/A ALA 227.A N CYS 185.A O no hydrogen 3.005 N/A ALA 228.A N GLU 211.A O no hydrogen 2.842 N/A VAL 229.A N LEU 183.A O no hydrogen 2.947 N/A VAL 231.A N ALA 181.A O no hydrogen 2.773 N/A SER 233.A N HIS 179.A O no hydrogen 2.951 N/A SER 233.A OG ASP 178.A O no hydrogen 3.087 N/A GLY 234.A N GLU 236.A OE1 no hydrogen 2.933 N/A GLU 235.A N PRO 232.A O no hydrogen 2.952 N/A GLU 236.A N GLU 236.A OE1 no hydrogen 2.848 N/A GLN 237.A NE2 TRP 256.A O no hydrogen 3.024 N/A ARG 238.A N GLU 235.A O no hydrogen 3.014 N/A ARG 238.A NE ASP 202.A OD1 no hydrogen 2.879 N/A ARG 238.A NE ASP 202.A OD2 no hydrogen 3.330 N/A ARG 238.A NH2 ASP 202.A OD2 no hydrogen 2.634 N/A TYR 239.A N GLU 236.A O no hydrogen 3.076 N/A THR 240.A N GLN 200.A O no hydrogen 2.932 N/A THR 240.A OG1 HIS 242.A NE2 no hydrogen 2.839 N/A CYS 241.A N LEU 254.A O no hydrogen 2.774 N/A CYS 241.A SG THR 198.A O no hydrogen 3.701 N/A HIS 242.A N THR 198.A O no hydrogen 2.780 N/A HIS 242.A NE2 THR 240.A OG1 no hydrogen 2.839 N/A VAL 243.A N LEU 252.A O no hydrogen 3.045 N/A GLN 244.A N THR 196.A O no hydrogen 2.934 N/A HIS 245.A NE2 PRO 192.A O no hydrogen 2.934 N/A GLY 247.A N HIS 245.A ND1 no hydrogen 2.862 N/A LEU 248.A N HIS 245.A O no hydrogen 3.108 N/A LEU 252.A N VAL 243.A O no hydrogen 2.994 N/A LEU 254.A N CYS 241.A O no hydrogen 2.799 N/A