Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4xgn_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 3.A ND1 MET 4.A O no hydrogen 3.360 N/A ASP 8.A N GLY 32.A O no hydrogen 2.788 N/A ASN 9.A N ILE 6.A O no hydrogen 3.161 N/A ASN 9.A ND2 GLU 5.A O no hydrogen 2.798 N/A VAL 10.A N THR 79.A O no hydrogen 2.848 N/A PHE 11.A N LYS 34.A O no hydrogen 2.900 N/A LEU 12.A N GLY 82.A O no hydrogen 2.888 N/A ILE 13.A N VAL 36.A O no hydrogen 2.826 N/A THR 14.A N VAL 84.A O no hydrogen 2.906 N/A GLY 15.A N ALA 38.A O no hydrogen 2.851 N/A ALA 17.A N ASP 39.A OD2 no hydrogen 3.038 N/A SER 18.A N GLY 15.A O no hydrogen 3.396 N/A ALA 22.A N SER 18.A O no hydrogen 2.935 N/A GLY 23.A N GLY 19.A O no hydrogen 2.918 N/A THR 24.A N LEU 20.A O no hydrogen 2.940 N/A THR 24.A OG1 LEU 20.A O no hydrogen 2.826 N/A ALA 25.A N GLY 21.A O no hydrogen 2.922 N/A ARG 26.A N ALA 22.A O no hydrogen 2.945 N/A ARG 26.A NH1 GLU 51.A OE2 no hydrogen 2.923 N/A LEU 27.A N GLY 23.A O no hydrogen 3.063 N/A LEU 28.A N THR 24.A O no hydrogen 2.924 N/A THR 29.A N ALA 25.A O no hydrogen 2.970 N/A THR 29.A OG1 ALA 25.A O no hydrogen 2.838 N/A GLU 30.A N ARG 26.A O no hydrogen 2.899 N/A ALA 31.A N LEU 27.A O no hydrogen 3.094 N/A GLY 32.A N THR 29.A O no hydrogen 2.827 N/A GLY 33.A N LEU 28.A O no hydrogen 2.853 N/A LYS 34.A N ASN 9.A O no hydrogen 2.886 N/A LYS 34.A NZ ASP 8.A O no hydrogen 2.981 N/A VAL 36.A N PHE 11.A O no hydrogen 2.922 N/A LEU 37.A N VAL 55.A O no hydrogen 2.855 N/A ALA 38.A N ILE 13.A O no hydrogen 2.931 N/A ASP 39.A N VAL 57.A O no hydrogen 3.462 N/A ASN 41.A N ASP 39.A OD1 no hydrogen 2.851 N/A ALA 44.A N ASN 41.A OD1 no hydrogen 3.037 N/A GLY 45.A N ASN 41.A O no hydrogen 2.979 N/A GLU 46.A N GLN 42.A O no hydrogen 2.908 N/A ALA 47.A N ASP 43.A O no hydrogen 3.150 N/A LEU 48.A N ALA 44.A O no hydrogen 2.974 N/A ALA 49.A N GLY 45.A O no hydrogen 2.883 N/A ARG 50.A N GLU 46.A O no hydrogen 2.921 N/A ARG 50.A NE GLU 46.A OE2 no hydrogen 2.851 N/A GLU 51.A N ALA 47.A O no hydrogen 3.010 N/A LEU 52.A N LEU 48.A O no hydrogen 2.896 N/A GLY 53.A N ARG 50.A O no hydrogen 3.135 N/A GLY 54.A N ALA 49.A O no hydrogen 2.818 N/A VAL 55.A N VAL 35.A O no hydrogen 2.946 N/A VAL 57.A N LEU 37.A O no hydrogen 2.958 N/A CYS 59.A N ASP 39.A O no hydrogen 3.025 N/A CYS 59.A SG ASP 66.A O no hydrogen 3.490 N/A ASP 60.A N ASP 66.A OD2 no hydrogen 2.801 N/A ALA 62.A N ASP 60.A OD1 no hydrogen 3.029 N/A ARG 63.A N ASP 60.A O no hydrogen 2.954 N/A ARG 63.A NE ASP 66.A OD1 no hydrogen 3.390 N/A GLU 65.A N GLU 65.A OE1 no hydrogen 2.675 N/A ALA 67.A N ARG 63.A O no hydrogen 3.084 N/A GLN 68.A N GLU 64.A O no hydrogen 2.980 N/A ALA 69.A N GLU 65.A O no hydrogen 2.965 N/A ALA 70.A N ASP 66.A O no hydrogen 2.966 N/A VAL 71.A N ALA 67.A O no hydrogen 2.912 N/A ALA 72.A N GLN 68.A O no hydrogen 2.897 N/A ALA 73.A N ALA 69.A O no hydrogen 2.912 N/A ALA 74.A N ALA 70.A O no hydrogen 3.135 N/A THR 75.A N VAL 71.A O no hydrogen 2.981 N/A THR 75.A OG1 VAL 71.A O no hydrogen 3.505 N/A THR 75.A OG1 ALA 72.A O no hydrogen 3.260 N/A LYS 76.A N ALA 72.A O no hydrogen 2.926 N/A LEU 77.A N ALA 73.A O no hydrogen 3.012 N/A GLY 78.A N ALA 74.A O no hydrogen 3.155 N/A ARG 81.A N VAL 10.A O no hydrogen 2.870 N/A ARG 81.A NH1 GLU 133.A O no hydrogen 2.811 N/A ARG 81.A NH1 ARG 140.A O no hydrogen 3.014 N/A ARG 81.A NH2 GLU 133.A O no hydrogen 3.258 N/A GLY 82.A N VAL 10.A O no hydrogen 3.403 N/A LEU 83.A N VAL 142.A O no hydrogen 3.162 N/A VAL 84.A N LEU 12.A O no hydrogen 2.844 N/A ASN 85.A N VAL 144.A O no hydrogen 2.806 N/A ASN 85.A ND2 SER 145.A OG no hydrogen 3.005 N/A CYS 86.A N THR 14.A O no hydrogen 3.079 N/A CYS 86.A N THR 14.A OG1 no hydrogen 3.020 N/A CYS 86.A SG THR 146.A OG1 no hydrogen 3.668 N/A CYS 86.A SG TYR 226.A OH no hydrogen 3.482 N/A ALA 87.A N THR 14.A OG1 no hydrogen 3.069 N/A ILE 89.A N ASN 114.A OD1 no hydrogen 2.947 N/A ALA 93.A N GLY 157.A O no hydrogen 2.895 N/A GLY 97.A N GLY 100.A O no hydrogen 2.904 N/A GLY 100.A N GLY 97.A O no hydrogen 3.507 N/A HIS 102.A N THR 95.A O no hydrogen 2.888 N/A HIS 102.A ND1 PRO 103.A O no hydrogen 2.792 N/A ALA 108.A N LEU 104.A O no hydrogen 2.915 N/A LYS 109.A N GLU 105.A O no hydrogen 2.748 N/A THR 110.A N LEU 106.A O no hydrogen 3.148 N/A THR 110.A OG1 LEU 106.A O no hydrogen 2.867 N/A ILE 111.A N PHE 107.A O no hydrogen 3.014 N/A THR 112.A N ALA 108.A O no hydrogen 2.796 N/A THR 112.A OG1 ALA 108.A O no hydrogen 2.877 N/A VAL 113.A N LYS 109.A O no hydrogen 2.935 N/A ASN 114.A N THR 110.A O no hydrogen 2.938 N/A ASN 114.A ND2 ILE 89.A O no hydrogen 2.895 N/A ASN 114.A ND2 SER 164.A OG no hydrogen 3.021 N/A LEU 115.A N ILE 111.A O no hydrogen 2.916 N/A ILE 116.A N ILE 111.A O no hydrogen 3.031 N/A GLY 117.A N THR 112.A O no hydrogen 2.782 N/A THR 118.A OG1 ASN 114.A O no hydrogen 3.091 N/A PHE 119.A N LEU 115.A O no hydrogen 2.990 N/A ASN 120.A N ILE 116.A O no hydrogen 2.825 N/A ASN 120.A ND2 VAL 61.A O no hydrogen 2.835 N/A ASN 120.A ND2 ARG 63.A O no hydrogen 3.021 N/A MET 121.A N GLY 117.A O no hydrogen 3.156 N/A ILE 122.A N THR 118.A O no hydrogen 2.971 N/A ARG 123.A N PHE 119.A O no hydrogen 2.913 N/A ARG 123.A NE ASN 120.A OD1 no hydrogen 2.914 N/A ARG 123.A NH2 GLU 64.A OE2 no hydrogen 2.915 N/A ARG 123.A NH2 ASN 120.A OD1 no hydrogen 2.858 N/A VAL 124.A N ASN 120.A O no hydrogen 3.346 N/A ALA 125.A N MET 121.A O no hydrogen 2.935 N/A ALA 126.A N ILE 122.A O no hydrogen 2.737 N/A ALA 127.A N ARG 123.A O no hydrogen 3.137 N/A ALA 128.A N VAL 124.A O no hydrogen 3.186 N/A MET 129.A N ALA 125.A O no hydrogen 2.854 N/A ALA 130.A N ALA 126.A O no hydrogen 2.869 N/A ALA 131.A N ALA 128.A O no hydrogen 3.262 N/A ASN 132.A N MET 129.A O no hydrogen 2.861 N/A ASN 132.A ND2 LEU 80.A O no hydrogen 2.814 N/A ASN 132.A ND2 ARG 140.A O no hydrogen 3.064 N/A ALA 135.A N GLU 139.A O no hydrogen 2.755 N/A THR 137.A OG1 GLU 139.A OE1 no hydrogen 2.560 N/A GLY 138.A N ALA 135.A O no hydrogen 2.894 N/A GLU 139.A N GLU 139.A OE1 no hydrogen 3.085 N/A ARG 140.A N ALA 183.A O no hydrogen 2.810 N/A ARG 140.A NE ASN 132.A O no hydrogen 2.836 N/A ARG 140.A NH1 ASN 182.A O no hydrogen 2.953 N/A VAL 142.A N ARG 81.A O no hydrogen 2.931 N/A ILE 143.A N ARG 185.A O no hydrogen 2.757 N/A VAL 144.A N LEU 83.A O no hydrogen 2.788 N/A SER 145.A N MET 187.A O no hydrogen 2.883 N/A THR 146.A OG1 ASN 85.A O no hydrogen 2.713 N/A THR 146.A OG1 TYR 226.A OH no hydrogen 2.645 N/A ALA 147.A N ILE 189.A O no hydrogen 2.807 N/A VAL 149.A N PRO 191.A O no hydrogen 2.948 N/A ALA 150.A N SER 148.A OG no hydrogen 2.856 N/A ALA 151.A N SER 148.A O no hydrogen 3.025 N/A PHE 152.A N VAL 149.A O no hydrogen 2.898 N/A ASP 153.A N VAL 149.A O no hydrogen 2.835 N/A GLN 155.A N GLN 158.A OE1 no hydrogen 2.823 N/A GLN 155.A NE2 GLN 253.A O no hydrogen 2.843 N/A ILE 156.A N PRO 254.A O no hydrogen 2.932 N/A GLN 158.A N GLN 155.A O no hydrogen 2.939 N/A ALA 162.A N GLN 158.A O no hydrogen 2.711 N/A ALA 163.A N ALA 159.A O no hydrogen 2.861 N/A SER 164.A N ALA 160.A O no hydrogen 2.997 N/A SER 164.A OG TYR 161.A O no hydrogen 2.797 N/A LYS 165.A N TYR 161.A O no hydrogen 2.911 N/A LYS 165.A NZ THR 146.A O no hydrogen 2.916 N/A LYS 165.A NZ ALA 147.A O no hydrogen 3.333 N/A ALA 166.A N ALA 162.A O no hydrogen 2.805 N/A GLY 167.A N ALA 163.A O no hydrogen 3.007 N/A VAL 168.A N SER 164.A O no hydrogen 3.173 N/A ALA 169.A N LYS 165.A O no hydrogen 2.917 N/A GLY 170.A N ALA 166.A O no hydrogen 2.804 N/A MET 171.A N GLY 167.A O no hydrogen 3.009 N/A THR 172.A N ALA 169.A O no hydrogen 3.185 N/A THR 172.A OG1 VAL 168.A O no hydrogen 3.254 N/A THR 172.A OG1 ALA 169.A O no hydrogen 2.759 N/A THR 172.A OG1 THR 188.A OG1 no hydrogen 2.616 N/A ILE 175.A N MET 171.A O no hydrogen 3.070 N/A ALA 176.A N THR 172.A O no hydrogen 2.915 N/A ARG 177.A N LEU 173.A O no hydrogen 2.861 N/A ASP 178.A N PRO 174.A O no hydrogen 2.817 N/A LEU 179.A N ILE 175.A O no hydrogen 2.923 N/A SER 180.A N ARG 177.A O no hydrogen 3.406 N/A SER 180.A OG ARG 177.A O no hydrogen 2.862 N/A ASN 182.A N LEU 179.A O no hydrogen 3.007 N/A ALA 183.A N SER 180.A O no hydrogen 3.069 N/A ILE 184.A N LEU 179.A O no hydrogen 3.242 N/A ARG 185.A N GLY 141.A O no hydrogen 3.147 N/A ARG 185.A NE GLU 139.A OE2 no hydrogen 3.036 N/A ARG 185.A NH1 ILE 233.A O no hydrogen 2.842 N/A ARG 185.A NH1 LEU 239.A O no hydrogen 2.812 N/A ARG 185.A NH2 GLU 139.A OE2 no hydrogen 2.936 N/A ARG 185.A NH2 ILE 233.A O no hydrogen 3.055 N/A ARG 185.A NH2 PHE 234.A O no hydrogen 3.079 N/A VAL 186.A N ASN 240.A OD1 no hydrogen 2.873 N/A MET 187.A N ILE 143.A O no hydrogen 2.871 N/A THR 188.A N GLU 242.A O no hydrogen 2.967 N/A THR 188.A OG1 THR 172.A OG1 no hydrogen 2.616 N/A ILE 189.A N SER 145.A O no hydrogen 2.921 N/A ALA 190.A N ILE 244.A O no hydrogen 2.774 N/A GLY 192.A N LEU 246.A O no hydrogen 2.892 N/A GLU 195.A N GLY 221.A O no hydrogen 2.846 N/A MET 198.A N THR 196.A OG1 no hydrogen 3.052 N/A LEU 199.A N THR 196.A O no hydrogen 3.055 N/A LEU 200.A N PRO 197.A O no hydrogen 2.909 N/A MET 202.A N LEU 199.A O no hydrogen 2.866 N/A GLN 204.A NE2 ASP 208.A OD1 no hydrogen 3.036 N/A VAL 206.A N PRO 203.A O no hydrogen 2.852 N/A GLN 207.A N PRO 203.A O no hydrogen 3.112 N/A GLN 207.A NE2 MET 202.A O no hydrogen 2.732 N/A ASP 208.A N GLN 204.A O no hydrogen 2.816 N/A ALA 209.A N GLU 205.A O no hydrogen 2.932 N/A LEU 210.A N VAL 206.A O no hydrogen 2.986 N/A GLY 211.A N GLN 207.A O no hydrogen 2.909 N/A ALA 212.A N ASP 208.A O no hydrogen 3.030 N/A MET 213.A N LEU 210.A O no hydrogen 2.866 N/A VAL 214.A N GLY 211.A O no hydrogen 3.016 N/A PHE 216.A N GLY 248.A O no hydrogen 3.175 N/A ARG 219.A N PRO 217.A O no hydrogen 2.773 N/A ARG 219.A NH1 LEU 220.A O no hydrogen 3.054 N/A ARG 219.A NH1 GLU 225.A OE1 no hydrogen 2.889 N/A ARG 219.A NH1 GLU 225.A OE2 no hydrogen 3.531 N/A ARG 219.A NH2 GLU 225.A OE2 no hydrogen 2.753 N/A GLY 221.A N ILE 193.A O no hydrogen 2.859 N/A LYS 222.A N GLU 225.A OE1 no hydrogen 2.872 N/A GLU 225.A N LYS 222.A O no hydrogen 2.834 N/A TYR 226.A N LYS 222.A O no hydrogen 3.487 N/A TYR 226.A OH THR 146.A OG1 no hydrogen 2.645 N/A ALA 227.A N PRO 223.A O no hydrogen 2.945 N/A MET 228.A N ALA 224.A O no hydrogen 2.834 N/A LEU 229.A N GLU 225.A O no hydrogen 3.401 N/A VAL 230.A N TYR 226.A O no hydrogen 3.013 N/A ARG 231.A N ALA 227.A O no hydrogen 3.015 N/A ARG 231.A NE GLU 235.A OE1 no hydrogen 3.319 N/A ARG 231.A NE GLU 235.A OE2 no hydrogen 2.993 N/A ARG 231.A NH2 GLU 235.A OE2 no hydrogen 3.184 N/A GLN 232.A N MET 228.A O no hydrogen 3.079 N/A ILE 233.A N LEU 229.A O no hydrogen 3.020 N/A PHE 234.A N VAL 230.A O no hydrogen 2.961 N/A GLU 235.A N ARG 231.A O no hydrogen 2.887 N/A ASN 236.A ND2 GLN 232.A OE1 no hydrogen 2.920 N/A MET 238.A N ASN 236.A OD1 no hydrogen 3.044 N/A LEU 239.A N ASN 236.A O no hydrogen 3.173 N/A GLY 241.A N VAL 186.A O no hydrogen 2.764 N/A VAL 243.A N GLU 242.A OE1 no hydrogen 2.838 N/A ILE 244.A N THR 188.A O no hydrogen 2.875 N/A ARG 245.A NE ASP 247.A OD2 no hydrogen 2.827 N/A ARG 245.A NH1 ASP 153.A OD1 no hydrogen 3.047 N/A ARG 245.A NH2 ASP 153.A OD2 no hydrogen 2.869 N/A ARG 245.A NH2 ASP 247.A OD2 no hydrogen 2.963 N/A LEU 246.A N ALA 190.A O no hydrogen 2.939 N/A ALA 249.A N ASP 247.A OD1 no hydrogen 2.874 N/A ILE 250.A N ASP 247.A O no hydrogen 3.198 N/A ARG 251.A NH1 ILE 250.A O no hydrogen 2.920 N/A MET 252.A N ASP 153.A OD2 no hydrogen 3.039 N/A