Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3g89_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 7.A N HIS 5.A ND1 no hydrogen 2.917 N/A LEU 9.A N SER 36.A OG no hydrogen 2.862 N/A SER 10.A N GLU 48.A OE2 no hydrogen 2.712 N/A SER 10.A OG GLU 48.A OE1 no hydrogen 2.664 N/A SER 10.A OG GLU 48.A OE2 no hydrogen 3.376 N/A GLU 11.A N GLY 3.A O no hydrogen 3.043 N/A GLY 13.A N SER 10.A OG no hydrogen 2.950 N/A ARG 14.A N SER 10.A O no hydrogen 2.928 N/A ARG 14.A NE LEU 9.A O no hydrogen 3.105 N/A ALA 15.A N GLU 11.A O no hydrogen 3.014 N/A LEU 16.A N ARG 12.A O no hydrogen 2.852 N/A LEU 17.A N GLY 13.A O no hydrogen 2.994 N/A LEU 18.A N ARG 14.A O no hydrogen 2.921 N/A GLU 19.A N ALA 15.A O no hydrogen 2.897 N/A GLY 20.A N LEU 16.A O no hydrogen 2.846 N/A GLY 21.A N LEU 17.A O no hydrogen 2.870 N/A LYS 22.A N LEU 18.A O no hydrogen 2.920 N/A ALA 23.A N GLU 19.A O no hydrogen 3.083 N/A LEU 24.A N GLY 20.A O no hydrogen 3.242 N/A LEU 24.A N GLY 21.A O no hydrogen 2.987 N/A GLY 25.A N LYS 22.A O no hydrogen 2.941 N/A LEU 26.A N GLY 21.A O no hydrogen 2.823 N/A LYS 29.A N ASP 27.A OD1 no hydrogen 2.919 N/A HIS 31.A N LEU 28.A O no hydrogen 2.883 N/A LEU 32.A N LYS 29.A O no hydrogen 3.383 N/A PHE 35.A N HIS 31.A O no hydrogen 3.046 N/A SER 36.A N LEU 32.A O no hydrogen 2.802 N/A ARG 37.A N GLU 33.A O no hydrogen 2.860 N/A LEU 38.A N ALA 34.A O no hydrogen 3.023 N/A TYR 39.A N PHE 35.A O no hydrogen 2.891 N/A ALA 40.A N SER 36.A O no hydrogen 2.872 N/A LEU 41.A N ARG 37.A O no hydrogen 2.897 N/A LEU 42.A N LEU 38.A O no hydrogen 2.965 N/A GLN 43.A N TYR 39.A O no hydrogen 2.993 N/A GLU 44.A N ALA 40.A O no hydrogen 3.002 N/A ALA 45.A N LEU 41.A O no hydrogen 3.074 N/A GLU 47.A N GLU 47.A OE2 no hydrogen 2.740 N/A GLU 49.A N GLU 49.A OE1 no hydrogen 2.781 N/A VAL 50.A N GLY 46.A O no hydrogen 3.026 N/A VAL 51.A N GLU 47.A O no hydrogen 3.286 N/A VAL 52.A N GLU 48.A O no hydrogen 2.913 N/A LYS 53.A N GLU 49.A O no hydrogen 2.928 N/A HIS 54.A N VAL 50.A O no hydrogen 3.193 N/A PHE 55.A N VAL 51.A O no hydrogen 2.907 N/A LEU 56.A N VAL 52.A O no hydrogen 2.913 N/A ASP 57.A N LYS 53.A O no hydrogen 2.688 N/A SER 58.A N HIS 54.A O no hydrogen 3.017 N/A SER 58.A OG HIS 54.A O no hydrogen 2.756 N/A LEU 59.A N PHE 55.A O no hydrogen 3.047 N/A THR 60.A N LEU 56.A O no hydrogen 3.129 N/A THR 60.A N ASP 57.A O no hydrogen 3.156 N/A THR 60.A OG1 ASP 57.A O no hydrogen 2.644 N/A LEU 61.A N SER 58.A O no hydrogen 3.222 N/A LEU 62.A N.A LEU 59.A O no hydrogen 2.960 N/A LEU 62.A N.B LEU 59.A O no hydrogen 3.044 N/A ARG 63.A N THR 60.A O no hydrogen 2.929 N/A ARG 63.A NH1 LEU 24.A O no hydrogen 2.803 N/A LEU 64.A N LEU 61.A O no hydrogen 3.157 N/A TRP 67.A NE1 LEU 61.A O no hydrogen 2.868 N/A ARG 72.A NH1 GLY 136.A O no hydrogen 3.069 N/A VAL 73.A N GLU 95.A O no hydrogen 2.906 N/A LEU 74.A N ARG 143.A O no hydrogen 3.012 N/A ASP 75.A N VAL 97.A O no hydrogen 2.824 N/A LEU 76.A N VAL 145.A O no hydrogen 2.937 N/A THR 78.A N VAL 99.A O no hydrogen 2.955 N/A THR 78.A OG1 ASP 75.A OD2 no hydrogen 2.711 N/A GLY 79.A N ASP 100.A OD2 no hydrogen 2.823 N/A GLY 81.A N THR 78.A O no hydrogen 2.934 N/A PHE 82.A N THR 78.A O no hydrogen 3.022 N/A GLY 84.A N ASP 75.A OD2 no hydrogen 2.772 N/A LEU 85.A N GLY 81.A O no hydrogen 2.837 N/A LEU 87.A N PRO 83.A O no hydrogen 3.218 N/A LYS 88.A N GLY 84.A O no hydrogen 2.918 N/A LYS 88.A NZ PRO 92.A O no hydrogen 2.732 N/A LYS 88.A NZ LEU 94.A O no hydrogen 2.682 N/A LYS 88.A NZ LYS 119.A O no hydrogen 2.701 N/A LYS 88.A NZ GLY 120.A O no hydrogen 3.126 N/A ILE 89.A N LEU 85.A O no hydrogen 2.889 N/A VAL 90.A N.A PRO 86.A O no hydrogen 3.218 N/A VAL 90.A N.A LEU 87.A O no hydrogen 3.225 N/A VAL 90.A N.B PRO 86.A O no hydrogen 3.173 N/A ARG 91.A N.A LEU 87.A O no hydrogen 2.831 N/A ARG 91.A N.B LEU 87.A O no hydrogen 2.899 N/A ARG 91.A NE.B VAL 90.A O.A no hydrogen 2.799 N/A ARG 91.A NE.B VAL 90.A O.B no hydrogen 3.431 N/A ARG 91.A NH1.A VAL 90.A O.A no hydrogen 2.349 N/A ARG 91.A NH1.A VAL 90.A O.B no hydrogen 2.886 N/A LEU 94.A N ARG 91.A O.A no hydrogen 3.132 N/A LEU 94.A N ARG 91.A O.B no hydrogen 3.098 N/A GLU 95.A N LEU 71.A O no hydrogen 2.881 N/A LEU 96.A N GLY 120.A O no hydrogen 3.036 N/A VAL 97.A N VAL 73.A O no hydrogen 2.837 N/A LEU 98.A N ARG 122.A O no hydrogen 2.879 N/A VAL 99.A N ASP 75.A O no hydrogen 2.892 N/A ASP 100.A N LEU 124.A O no hydrogen 3.111 N/A THR 102.A N ASP 100.A OD1 no hydrogen 2.841 N/A THR 102.A OG1 ASP 100.A OD1 no hydrogen 3.457 N/A LYS 105.A N THR 102.A O no hydrogen 3.038 N/A VAL 106.A N THR 102.A O no hydrogen 3.257 N/A ALA 107.A N ARG 103.A O no hydrogen 2.878 N/A PHE 108.A N LYS 104.A O no hydrogen 3.095 N/A VAL 109.A N LYS 105.A O no hydrogen 2.972 N/A GLU 110.A N VAL 106.A O no hydrogen 2.876 N/A ARG 111.A N ALA 107.A O no hydrogen 3.059 N/A ARG 111.A NE GLU 44.A OE2 no hydrogen 3.535 N/A ARG 111.A NH2 GLU 44.A OE2 no hydrogen 3.443 N/A ALA 112.A N PHE 108.A O no hydrogen 2.891 N/A ILE 113.A N VAL 109.A O no hydrogen 2.922 N/A GLU 114.A N GLU 110.A O no hydrogen 3.181 N/A VAL 115.A N ARG 111.A O no hydrogen 2.887 N/A LEU 116.A N ALA 112.A O no hydrogen 2.868 N/A GLY 117.A N GLU 114.A O no hydrogen 3.085 N/A LEU 118.A N ILE 113.A O no hydrogen 2.948 N/A LYS 119.A NZ GLY 117.A O no hydrogen 3.490 N/A ARG 122.A N LEU 96.A O no hydrogen 2.899 N/A LEU 124.A N LEU 98.A O no hydrogen 2.780 N/A TRP 125.A NE1 ALA 101.A O no hydrogen 2.871 N/A GLY 126.A N ASP 100.A O no hydrogen 3.103 N/A ARG 127.A NH1 GLU 129.A OE2 no hydrogen 3.391 N/A GLU 129.A N GLU 129.A OE1 no hydrogen 2.687 N/A VAL 130.A N ARG 127.A O no hydrogen 3.012 N/A LEU 131.A N ARG 127.A O no hydrogen 2.860 N/A ALA 132.A N ALA 128.A O no hydrogen 3.026 N/A ARG 133.A N VAL 130.A O no hydrogen 3.070 N/A ARG 133.A NE PRO 226.A O no hydrogen 3.423 N/A ARG 133.A NH1 PRO 223.A O no hydrogen 2.731 N/A ARG 133.A NH2 PRO 223.A O no hydrogen 2.810 N/A ARG 133.A NH2 PRO 226.A O no hydrogen 2.820 N/A GLU 134.A N LEU 131.A O no hydrogen 3.093 N/A HIS 137.A N GLU 134.A O no hydrogen 3.088 N/A HIS 137.A ND1 TYR 141.A OH no hydrogen 2.747 N/A ARG 138.A N GLU 134.A O no hydrogen 2.855 N/A ARG 138.A NH1 ALA 132.A O no hydrogen 3.000 N/A ARG 138.A NH1 TYR 225.A O no hydrogen 2.882 N/A ARG 138.A NH2 THR 221.A O no hydrogen 3.117 N/A ARG 138.A NH2 TYR 225.A O no hydrogen 2.887 N/A GLU 139.A N PRO 161.A O no hydrogen 2.883 N/A ALA 140.A N HIS 137.A O no hydrogen 3.239 N/A TYR 141.A N PHE 162.A O no hydrogen 2.990 N/A TYR 141.A OH HIS 137.A ND1 no hydrogen 2.747 N/A ALA 142.A N ARG 72.A O no hydrogen 2.932 N/A ARG 143.A N ARG 72.A O no hydrogen 3.160 N/A ARG 143.A NE LEU 66.A O no hydrogen 2.780 N/A ARG 143.A NH1 ALA 142.A O no hydrogen 2.974 N/A ARG 143.A NH2 LEU 66.A O no hydrogen 3.484 N/A ALA 144.A N ALA 168.A O no hydrogen 3.223 N/A VAL 145.A N LEU 74.A O no hydrogen 2.870 N/A ALA 146.A N VAL 170.A O no hydrogen 3.222 N/A ARG 147.A NH1 HIS 54.A ND1 no hydrogen 3.502 N/A ARG 147.A NH1 ASP 57.A OD2 no hydrogen 2.854 N/A ARG 147.A NH2 HIS 54.A ND1 no hydrogen 2.794 N/A LEU 152.A N GLU 180.A OE1 no hydrogen 2.809 N/A VAL 154.A N PRO 151.A O no hydrogen 2.978 N/A LEU 155.A N PRO 151.A O no hydrogen 2.849 N/A SER 156.A N LEU 152.A O no hydrogen 2.857 N/A SER 156.A OG LEU 152.A O no hydrogen 2.787 N/A LEU 158.A N VAL 154.A O no hydrogen 3.211 N/A LEU 159.A N LEU 155.A O no hydrogen 2.800 N/A LEU 160.A N SER 156.A O no hydrogen 2.948 N/A PHE 162.A N LEU 159.A O no hydrogen 3.037 N/A LEU 163.A N LEU 160.A O no hydrogen 3.029 N/A GLU 164.A N TYR 141.A O no hydrogen 2.892 N/A GLY 166.A N LYS 217.A O no hydrogen 2.878 N/A GLY 167.A N GLU 164.A O no hydrogen 2.841 N/A ALA 168.A N ALA 142.A O no hydrogen 3.026 N/A ALA 169.A N LEU 215.A O no hydrogen 2.782 N/A VAL 170.A N ALA 144.A O no hydrogen 2.850 N/A ALA 171.A N VAL 213.A O no hydrogen 2.876 N/A MET 172.A N ALA 146.A O no hydrogen 3.013 N/A LYS 173.A N HIS 211.A O no hydrogen 2.831 N/A LYS 173.A NZ ALA 150.A O no hydrogen 2.868 N/A LYS 173.A NZ GLU 180.A OE1 no hydrogen 2.832 N/A LEU 181.A N VAL 177.A O no hydrogen 2.901 N/A ALA 182.A N GLU 178.A O no hydrogen 2.967 N/A LEU 184.A N LEU 181.A O no hydrogen 2.926 N/A ALA 187.A N LEU 184.A O no hydrogen 2.945 N/A LEU 188.A N LEU 184.A O no hydrogen 3.021 N/A GLU 189.A N PRO 185.A O no hydrogen 3.085 N/A ARG 190.A N PRO 186.A O no hydrogen 3.334 N/A LEU 191.A N LEU 188.A O no hydrogen 2.913 N/A GLY 192.A N GLU 189.A O no hydrogen 3.245 N/A GLY 193.A N LEU 188.A O no hydrogen 2.771 N/A ARG 194.A N GLU 216.A O no hydrogen 2.920 N/A GLY 196.A N VAL 214.A O no hydrogen 2.781 N/A LEU 199.A N LEU 212.A O no hydrogen 2.899 N/A LEU 201.A N ARG 210.A O no hydrogen 3.028 N/A LEU 203.A N GLU 208.A O no hydrogen 2.810 N/A SER 206.A OG GLU 208.A OE2 no hydrogen 2.963 N/A GLY 207.A N LEU 203.A O no hydrogen 2.961 N/A GLU 208.A N SER 206.A OG no hydrogen 3.153 N/A ARG 210.A N LEU 201.A O no hydrogen 2.934 N/A ARG 210.A NE ASP 57.A OD1 no hydrogen 2.973 N/A ARG 210.A NH1 ALA 209.A O no hydrogen 2.927 N/A ARG 210.A NH2 GLU 208.A OE1 no hydrogen 3.392 N/A HIS 211.A N LYS 173.A O no hydrogen 2.950 N/A HIS 211.A ND1 GLY 174.A O no hydrogen 2.829 N/A LEU 212.A N LEU 199.A O no hydrogen 2.875 N/A VAL 213.A N ALA 171.A O no hydrogen 2.949 N/A VAL 214.A N GLU 197.A O.A no hydrogen 2.921 N/A VAL 214.A N GLU 197.A O.B no hydrogen 2.853 N/A LEU 215.A N ALA 169.A O no hydrogen 2.816 N/A GLU 216.A N ARG 194.A O no hydrogen 2.825 N/A LYS 217.A N GLY 167.A O no hydrogen 2.953 N/A LYS 217.A NZ GLU 139.A OE2 no hydrogen 2.799 N/A LYS 217.A NZ LEU 160.A O no hydrogen 2.739 N/A LYS 217.A NZ LEU 163.A O no hydrogen 2.832 N/A LYS 217.A NZ THR 221.A OG1 no hydrogen 2.978 N/A THR 218.A N GLY 192.A O no hydrogen 2.755 N/A THR 218.A OG1 GLY 192.A O no hydrogen 3.265 N/A ALA 219.A N GLY 192.A O no hydrogen 3.031 N/A THR 221.A N GLU 139.A OE2 no hydrogen 2.771 N/A THR 221.A OG1 GLU 139.A OE2 no hydrogen 3.522 N/A THR 221.A OG1 LEU 191.A O no hydrogen 2.824 N/A TYR 225.A N PRO 222.A O no hydrogen 3.013 N/A ARG 227.A N GLU 157.A OE2 no hydrogen 2.926 N/A ARG 227.A NE GLU 157.A OE2 no hydrogen 2.911 N/A ARG 227.A NH1 HIS 235.A O no hydrogen 2.929 N/A ARG 227.A NH2 GLU 157.A OE1 no hydrogen 2.838 N/A ARG 227.A NH2 HIS 235.A O no hydrogen 2.738 N/A GLY 230.A N GLU 129.A OE2 no hydrogen 3.464 N/A VAL 231.A N ARG 228.A O no hydrogen 2.781 N/A ARG 234.A N GLY 230.A O no hydrogen 3.031 N/A HIS 235.A N VAL 231.A O no hydrogen 2.882 N/A CYS 238.A SG PRO 183.A O no hydrogen 3.631 N/A