Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2xw9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N ILE 130.A O no hydrogen 2.861 N/A ILE 1.A N ASP 182.A OD2 no hydrogen 2.678 N/A LEU 2.A N ASP 177.A O no hydrogen 2.867 N/A ARG 5.A N HIS 143.A O no hydrogen 3.031 N/A ARG 5.A NH1.B GLY 3.A O no hydrogen 3.564 N/A ARG 5.A NH1.B GLY 4.A O no hydrogen 3.515 N/A ALA 7.A N LEU 141.A O no hydrogen 2.841 N/A ALA 11.A N GLU 8.A O no hydrogen 3.092 N/A ARG 12.A NE ASP 124.A OD2 no hydrogen 2.856 N/A ARG 12.A NH2 ASP 124.A OD1 no hydrogen 3.082 N/A MET 15.A N ARG 12.A O no hydrogen 2.991 N/A ALA 16.A N GLY 28.A O no hydrogen 2.981 N/A SER 17.A N LEU 54.A O no hydrogen 3.046 N/A SER 17.A OG HIS 24.A ND1 no hydrogen 2.743 N/A VAL 18.A N CYS 26.A O no hydrogen 2.840 N/A GLN 19.A N GLN 52.A O no hydrogen 2.803 N/A GLN 19.A NE2 SER 17.A OG no hydrogen 3.003 N/A LEU 20.A N ALA 23.A O no hydrogen 2.916 N/A ASN 21.A N LYS 50.A O no hydrogen 2.958 N/A ALA 23.A N LEU 20.A O no hydrogen 3.121 N/A HIS 24.A ND1 SER 17.A OG no hydrogen 2.743 N/A HIS 24.A NE2 GLY 181.A O no hydrogen 2.889 N/A LEU 25.A N VAL 18.A O no hydrogen 2.820 N/A CYS 26.A N VAL 18.A O no hydrogen 3.133 N/A CYS 26.A SG.B GLY 27.A O no hydrogen 3.767 N/A CYS 26.A SG.B SER 38.A OG no hydrogen 3.463 N/A GLY 27.A N ALA 183.A O no hydrogen 2.837 N/A GLY 28.A N ALA 16.A O no hydrogen 3.010 N/A VAL 29.A N LEU 37.A O no hydrogen 2.872 N/A LEU 30.A N TYR 14.A O no hydrogen 2.890 N/A VAL 31.A N TRP 35.A O no hydrogen 3.000 N/A ALA 32.A N TRP 35.A O no hydrogen 3.373 N/A GLN 34.A NE2 LEU 95.A O no hydrogen 2.870 N/A TRP 35.A N ALA 32.A O no hydrogen 3.308 N/A VAL 36.A N LEU 93.A O no hydrogen 2.933 N/A LEU 37.A N VAL 29.A O no hydrogen 2.851 N/A SER 38.A N LEU 91.A O no hydrogen 2.812 N/A SER 38.A OG GLY 27.A O no hydrogen 2.695 N/A ALA 39.A N SER 38.A OG no hydrogen 2.813 N/A HIS 41.A N ASP 89.A OD1 no hydrogen 3.050 N/A HIS 41.A N SER 199.A OG.B no hydrogen 3.274 N/A HIS 41.A NE2 THR 85.A O no hydrogen 2.728 N/A CYS 42.A N ALA 39.A O no hydrogen 3.209 N/A CYS 42.A SG.B ALA 183.A O no hydrogen 3.964 N/A LEU 43.A N ALA 40.A O no hydrogen 3.070 N/A GLU 44.A N HIS 41.A O no hydrogen 3.146 N/A GLY 49.A N ALA 46.A O no hydrogen 3.061 N/A LYS 50.A N ASN 21.A OD1 no hydrogen 3.084 N/A LYS 50.A NZ.B ASP 71.A OD1 no hydrogen 3.004 N/A GLN 52.A N GLN 19.A O no hydrogen 2.965 N/A VAL 53.A N TYR 70.A O no hydrogen 2.875 N/A LEU 54.A N SER 17.A O no hydrogen 2.813 N/A LEU 55.A N ARG 68.A O no hydrogen 2.955 N/A HIS 58.A N GLU 64.A OE1 no hydrogen 2.827 N/A HIS 58.A NE2 GLU 6.A OE2 no hydrogen 2.858 N/A SER 59.A N GLU 64.A OE2 no hydrogen 2.825 N/A SER 59.A OG ASP 139.A OD1 no hydrogen 3.346 N/A SER 59.A OG ASP 139.A OD2 no hydrogen 2.623 N/A LEU 60.A N ASP 139.A O no hydrogen 2.831 N/A SER 61.A N SER 59.A OG no hydrogen 3.134 N/A SER 61.A N ASP 139.A OD1 no hydrogen 3.250 N/A SER 61.A OG ASP 139.A OD1 no hydrogen 2.632 N/A GLN 62.A N SER 59.A OG no hydrogen 2.937 N/A GLN 62.A NE2 SER 61.A OG no hydrogen 2.815 N/A SER 66.A OG GLY 56.A O no hydrogen 2.715 N/A LYS 67.A N GLU 64.A O no hydrogen 3.086 N/A LYS 67.A NZ SER 59.A O no hydrogen 2.867 N/A LYS 67.A NZ LEU 60.A O no hydrogen 3.191 N/A LYS 67.A NZ GLN 62.A O no hydrogen 2.739 N/A ARG 68.A N LEU 55.A O no hydrogen 2.968 N/A ARG 68.A NH1 GLU 97.A OE2 no hydrogen 3.414 N/A ARG 68.A NH2 GLU 97.A OE2 no hydrogen 2.545 N/A TYR 70.A N VAL 53.A O no hydrogen 2.775 N/A LEU 73.A N GLN 94.A O no hydrogen 2.781 N/A ARG 74.A NH2.A GLN 94.A OE1 no hydrogen 3.499 N/A VAL 76.A N LEU 92.A O no hydrogen 2.755 N/A HIS 78.A N LEU 90.A O no hydrogen 2.883 N/A ASP 80.A N HIS 78.A ND1 no hydrogen 2.988 N/A SER 81.A N HIS 78.A O no hydrogen 3.089 N/A SER 81.A OG HIS 78.A O no hydrogen 2.684 N/A THR 85.A N GLN 82.A O no hydrogen 3.310 N/A ASP 87.A N THR 85.A OG1 no hydrogen 3.197 N/A LEU 90.A N HIS 88.A O no hydrogen 2.922 N/A LEU 91.A N SER 38.A O no hydrogen 2.905 N/A LEU 92.A N VAL 76.A O no hydrogen 2.934 N/A LEU 93.A N VAL 36.A O no hydrogen 2.813 N/A GLN 94.A N ARG 74.A O no hydrogen 2.872 N/A LEU 95.A N GLN 34.A O no hydrogen 2.840 N/A SER 96.A N ASP 71.A O no hydrogen 2.909 N/A LYS 98.A NZ.B GLN 34.A OE1 no hydrogen 2.744 N/A ALA 99.A N GLU 33.A O no hydrogen 2.830 N/A THR 100.A N TYR 70.A OH no hydrogen 2.972 N/A GLY 102.A N VAL 105.A O no hydrogen 2.977 N/A VAL 105.A N GLY 102.A O no hydrogen 3.139 N/A ARG 106.A N PRO 13.A O no hydrogen 3.097 N/A LEU 108.A N LEU 30.A O no hydrogen 2.954 N/A GLN 111.A N LEU 193.A O no hydrogen 3.006 N/A GLN 111.A NE2 GLU 194.A OE2 no hydrogen 2.850 N/A ARG 112.A NH1 TRP 110.A O no hydrogen 2.928 N/A VAL 113.A N GLN 111.A OE1 no hydrogen 3.048 N/A ARG 115.A N VAL 113.A O no hydrogen 2.907 N/A GLY 120.A N VAL 148.A O no hydrogen 2.816 N/A THR 121.A N ALA 118.A O no hydrogen 3.159 N/A THR 121.A OG1 ALA 118.A O no hydrogen 2.675 N/A CYS 123.A N LEU 146.A O no hydrogen 2.840 N/A CYS 123.A SG THR 121.A O no hydrogen 3.817 N/A ASP 124.A N VAL 188.A O no hydrogen 2.808 N/A VAL 125.A N VAL 144.A O no hydrogen 3.009 N/A GLY 127.A N GLN 142.A O no hydrogen 2.921 N/A TRP 128.A NE1 HIS 58.A O no hydrogen 3.050 N/A GLY 129.A N ASP 182.A OD1 no hydrogen 2.787 N/A ILE 130.A N LYS 180.A O no hydrogen 2.857 N/A VAL 131.A N ARG 136.A O no hydrogen 2.975 N/A GLY 135.A N ASN 132.A O no hydrogen 3.066 N/A ARG 136.A N ASN 132.A OD1 no hydrogen 2.992 N/A SER 140.A OG GLU 6.A OE2 no hydrogen 3.015 N/A LEU 141.A N HIS 58.A O no hydrogen 3.165 N/A GLN 142.A N GLY 127.A O no hydrogen 3.019 N/A GLN 142.A NE2 SER 140.A O no hydrogen 2.952 N/A HIS 143.A N ARG 5.A O no hydrogen 2.923 N/A HIS 143.A ND1 ASP 124.A OD1 no hydrogen 2.817 N/A VAL 144.A N VAL 125.A O no hydrogen 2.919 N/A LEU 146.A N CYS 123.A O no hydrogen 2.839 N/A VAL 148.A N THR 121.A O no hydrogen 2.890 N/A LEU 149.A N CYS 170.A O no hydrogen 2.922 N/A ARG 151.A NE THR 165.A O no hydrogen 3.015 N/A ARG 151.A NE LEU 168.A O no hydrogen 3.268 N/A ARG 151.A NH1 ASP 116.A OD2 no hydrogen 2.849 N/A ARG 151.A NH2 ASP 116.A OD1 no hydrogen 2.876 N/A ARG 151.A NH2 LEU 168.A O no hydrogen 2.881 N/A THR 153.A N ASP 150.A OD1 no hydrogen 2.808 N/A THR 153.A OG1 ASP 150.A OD1 no hydrogen 3.055 N/A THR 153.A OG1 ASP 150.A OD2 no hydrogen 2.623 N/A CYS 154.A N ASP 150.A O no hydrogen 3.090 N/A ASN 155.A N ARG 151.A O no hydrogen 2.921 N/A ASN 155.A N ALA 152.A O no hydrogen 3.182 N/A ASN 155.A ND2 ILE 164.A O no hydrogen 2.907 N/A ARG 156.A N THR 153.A O no hydrogen 3.100 N/A THR 158.A OG1 HIS 159.A ND1 no hydrogen 2.690 N/A HIS 159.A N ARG 156.A O no hydrogen 2.850 N/A HIS 159.A ND1 THR 158.A OG1 no hydrogen 2.690 N/A HIS 160.A N CYS 154.A O no hydrogen 2.877 N/A HIS 160.A NE2 PRO 210.A O no hydrogen 2.737 N/A ASP 161.A N ARG 156.A O no hydrogen 2.860 N/A GLY 162.A N ASN 155.A O no hydrogen 2.979 N/A ALA 163.A N HIS 160.A O no hydrogen 3.111 N/A ILE 164.A N ASN 155.A OD1 no hydrogen 2.839 N/A ARG 167.A N THR 165.A OG1 no hydrogen 3.081 N/A ARG 167.A NE SER 218.A OG.B no hydrogen 2.790 N/A ARG 167.A NH2 SER 218.A O no hydrogen 2.795 N/A LEU 168.A N THR 165.A O no hydrogen 3.105 N/A MET 169.A N TYR 213.A O no hydrogen 2.871 N/A ALA 171.A N GLY 211.A O no hydrogen 3.045 N/A GLU 172.A N PRO 147.A O no hydrogen 2.965 N/A SER 173.A OG ASN 206.A O no hydrogen 2.707 N/A SER 173.A OG LYS 209.A O no hydrogen 3.119 N/A ARG 175.A N GLY 205.A O no hydrogen 3.075 N/A ASP 177.A N LEU 2.A O no hydrogen 3.024 N/A SER 178.A N ASP 177.A OD1 no hydrogen 2.854 N/A CYS 179.A N ASP 182.A OD2 no hydrogen 2.886 N/A CYS 179.A SG.B SER 178.A O no hydrogen 2.669 N/A ASP 182.A N CYS 179.A O no hydrogen 2.891 N/A GLY 184.A N VAL 197.A O no hydrogen 2.905 N/A GLY 185.A N ASP 182.A O no hydrogen 3.106 N/A LEU 187.A N GLY 195.A O no hydrogen 2.859 N/A VAL 188.A N ASP 124.A O no hydrogen 2.890 N/A CYS 189.A N VAL 192.A O no hydrogen 2.933 N/A VAL 192.A N CYS 189.A O no hydrogen 3.130 N/A LEU 193.A N PRO 109.A O no hydrogen 2.874 N/A GLU 194.A N LEU 187.A O no hydrogen 2.932 N/A GLY 195.A N LEU 187.A O no hydrogen 3.130 N/A VAL 196.A N THR 214.A O no hydrogen 2.962 N/A VAL 197.A N GLY 185.A O no hydrogen 2.918 N/A THR 198.A N ILE 212.A O no hydrogen 3.147 N/A THR 198.A OG1.A ILE 212.A O no hydrogen 2.994 N/A THR 198.A OG1.B ILE 212.A O no hydrogen 3.258 N/A SER 199.A N ASP 89.A OD2 no hydrogen 2.849 N/A SER 199.A OG.A ASP 89.A OD1 no hydrogen 3.301 N/A SER 199.A OG.A ASP 89.A OD2 no hydrogen 2.732 N/A SER 199.A OG.B ASP 89.A OD1 no hydrogen 3.065 N/A SER 199.A OG.B ASP 89.A OD2 no hydrogen 2.546 N/A SER 199.A OG.C SER 199.A O no hydrogen 2.528 N/A ARG 202.A NH1 ASP 177.A OD1 no hydrogen 3.532 N/A ARG 202.A NH1 ASP 177.A OD2 no hydrogen 2.825 N/A ARG 202.A NH1 LYS 209.A O no hydrogen 2.916 N/A ARG 202.A NH2 ASP 177.A OD1 no hydrogen 3.074 N/A ARG 202.A NH2 ASP 177.A OD2 no hydrogen 3.196 N/A CYS 204.A SG.A SER 178.A O no hydrogen 3.865 N/A CYS 204.A SG.A ARG 202.A O no hydrogen 3.815 N/A GLY 205.A N ASP 177.A OD2 no hydrogen 2.837 N/A LYS 208.A N ASN 206.A OD1.A no hydrogen 3.020 N/A LYS 208.A N ASN 206.A OD1.B no hydrogen 2.828 N/A LYS 209.A N ASN 206.A O no hydrogen 2.895 N/A LYS 209.A NZ.A HIS 159.A O no hydrogen 2.710 N/A LYS 209.A NZ.B THR 158.A O no hydrogen 2.918 N/A LYS 209.A NZ.B HIS 159.A O no hydrogen 3.214 N/A LYS 209.A NZ.B LYS 208.A O no hydrogen 3.256 N/A GLY 211.A N ALA 171.A O no hydrogen 3.010 N/A TYR 213.A N MET 169.A O no hydrogen 2.891 N/A THR 214.A N VAL 196.A O no hydrogen 2.848 N/A ARG 215.A N ARG 167.A O no hydrogen 2.958 N/A ARG 215.A NH1 ASP 114.A OD1 no hydrogen 2.870 N/A ARG 215.A NH1 GLU 166.A O no hydrogen 2.961 N/A ARG 215.A NH2 ASP 114.A OD1 no hydrogen 2.852 N/A VAL 216.A N GLU 194.A O no hydrogen 3.004 N/A SER 218.A N ARG 215.A O no hydrogen 3.083 N/A TYR 219.A N VAL 216.A O no hydrogen 2.896 N/A ALA 220.A N ALA 217.A O no hydrogen 3.408 N/A ILE 223.A N TYR 219.A O no hydrogen 2.975 N/A ASP 224.A N ALA 220.A O no hydrogen 2.985 N/A SER 225.A N ALA 221.A O no hydrogen 2.892 N/A SER 225.A OG TRP 222.A O no hydrogen 2.744 N/A VAL 226.A N TRP 222.A O no hydrogen 2.976 N/A LEU 227.A N ILE 223.A O no hydrogen 3.080 N/A ALA 228.A N SER 225.A O no hydrogen 3.246 N/A