Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3w0o_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A N THR 1.A O no hydrogen 3.386 N/A PHE 6.A N SER 2.A O no hydrogen 2.884 N/A LEU 7.A N VAL 3.A O no hydrogen 2.873 N/A ILE 8.A N GLU 4.A O no hydrogen 2.889 N/A GLU 9.A N LYS 5.A O no hydrogen 3.339 N/A LYS 10.A N LEU 7.A O no hydrogen 2.875 N/A SER 13.A N PHE 11.A O no hydrogen 2.539 N/A SER 15.A N ASP 32.A O no hydrogen 3.034 N/A MET 18.A N SER 30.A O no hydrogen 2.907 N/A LEU 20.A N ALA 28.A O no hydrogen 2.787 N/A SER 21.A N ALA 28.A O no hydrogen 3.358 N/A GLY 23.A N SER 26.A O no hydrogen 2.693 N/A ARG 27.A N VAL 42.A O no hydrogen 2.937 N/A ALA 28.A N SER 21.A O no hydrogen 3.194 N/A PHE 29.A N LEU 40.A O no hydrogen 2.744 N/A SER 30.A N MET 18.A O no hydrogen 2.887 N/A PHE 31.A N TYR 38.A O no hydrogen 3.061 N/A ASP 32.A N SER 15.A O no hydrogen 2.853 N/A VAL 33.A N ARG 36.A O no hydrogen 3.035 N/A ARG 36.A N VAL 33.A O no hydrogen 3.062 N/A TYR 38.A N PHE 31.A O no hydrogen 2.833 N/A VAL 39.A N SER 84.A O no hydrogen 2.824 N/A LEU 40.A N PHE 29.A O no hydrogen 2.831 N/A ARG 41.A N CYS 82.A O no hydrogen 2.935 N/A ARG 41.A NH1 ASP 52.A OD1 no hydrogen 2.785 N/A ARG 41.A NH2 ASP 52.A OD1 no hydrogen 3.189 N/A VAL 42.A N ARG 27.A O no hydrogen 2.882 N/A ASN 43.A N THR 80.A O no hydrogen 2.917 N/A SER 44.A N GLU 25.A O no hydrogen 3.066 N/A TYR 50.A N ALA 46.A O no hydrogen 3.386 N/A LYS 51.A N ASP 47.A O no hydrogen 3.304 N/A LYS 51.A NZ PHE 128.A O no hydrogen 3.174 N/A LYS 51.A NZ SER 210.A O no hydrogen 2.912 N/A LYS 51.A NZ ALA 212.A O no hydrogen 2.789 N/A ASP 52.A N GLY 48.A O no hydrogen 2.872 N/A ARG 53.A N PHE 49.A O no hydrogen 3.041 N/A TYR 54.A N TYR 50.A O no hydrogen 2.947 N/A VAL 55.A N LYS 51.A O no hydrogen 2.879 N/A TYR 56.A N ASP 52.A O no hydrogen 3.045 N/A ARG 57.A N ARG 53.A O no hydrogen 2.990 N/A HIS 58.A N TYR 54.A O no hydrogen 2.981 N/A HIS 58.A ND1 TYR 54.A O no hydrogen 2.936 N/A PHE 59.A N VAL 55.A O no hydrogen 2.772 N/A ALA 60.A N TYR 56.A O no hydrogen 3.376 N/A SER 61.A N LEU 64.A O no hydrogen 2.914 N/A ALA 63.A N SER 61.A OG no hydrogen 3.143 N/A LEU 64.A N SER 61.A O no hydrogen 3.220 N/A LEU 64.A N SER 61.A OG no hydrogen 2.995 N/A LEU 70.A N ILE 83.A O no hydrogen 2.743 N/A ASP 71.A N ILE 83.A O no hydrogen 3.425 N/A GLY 73.A N TYR 81.A O no hydrogen 3.122 N/A PHE 75.A N LEU 79.A O no hydrogen 2.761 N/A SER 76.A N LEU 79.A O no hydrogen 3.172 N/A SER 78.A N SER 76.A OG no hydrogen 3.327 N/A LEU 79.A N SER 76.A O no hydrogen 3.474 N/A THR 80.A N ASN 43.A O no hydrogen 2.878 N/A TYR 81.A N GLY 73.A O no hydrogen 2.810 N/A TYR 81.A OH ASP 71.A OD1 no hydrogen 2.643 N/A CYS 82.A N ARG 41.A O no hydrogen 2.881 N/A CYS 82.A SG ASP 71.A O no hydrogen 4.035 N/A ILE 83.A N ASP 71.A O no hydrogen 2.852 N/A SER 84.A N VAL 39.A O no hydrogen 2.981 N/A ARG 85.A N GLU 68.A O no hydrogen 2.956 N/A ARG 85.A NE GLU 68.A OE1 no hydrogen 2.807 N/A ARG 85.A NH1 TYR 38.A OH no hydrogen 3.113 N/A ARG 85.A NH2 GLU 68.A OE1 no hydrogen 3.566 N/A ARG 86.A N GLY 37.A O no hydrogen 2.976 N/A ARG 86.A NH1 PHE 31.A O no hydrogen 3.118 N/A ARG 86.A NH1 ASP 32.A OD1 no hydrogen 3.102 N/A ARG 86.A NH1 TYR 38.A O no hydrogen 3.310 N/A ARG 86.A NH2 ASP 32.A OD1 no hydrogen 3.142 N/A VAL 90.A N THR 198.A O no hydrogen 2.944 N/A THR 91.A OG1 ASP 94.A OD2 no hydrogen 2.767 N/A LEU 92.A N SER 193.A O no hydrogen 3.258 N/A LEU 92.A N VAL 196.A O no hydrogen 2.949 N/A GLN 93.A N THR 91.A OG1 no hydrogen 3.164 N/A ASP 94.A N THR 91.A O no hydrogen 2.942 N/A LEU 95.A N THR 91.A O no hydrogen 3.061 N/A GLU 99.A N PRO 96.A O no hydrogen 2.813 N/A LEU 100.A N GLU 97.A O no hydrogen 3.113 N/A VAL 103.A N LEU 100.A O no hydrogen 2.859 N/A LEU 104.A N PRO 101.A O no hydrogen 3.256 N/A VAL 107.A N VAL 103.A O no hydrogen 2.870 N/A ALA 108.A N LEU 104.A O no hydrogen 2.908 N/A GLU 109.A N GLN 105.A O no hydrogen 2.793 N/A VAL 110.A N PRO 106.A O no hydrogen 3.050 N/A MET 111.A N VAL 107.A O no hydrogen 2.859 N/A ASP 112.A N ALA 108.A O no hydrogen 2.850 N/A ALA 113.A N GLU 109.A O no hydrogen 2.917 N/A ILE 114.A N VAL 110.A O no hydrogen 2.887 N/A ALA 115.A N MET 111.A O no hydrogen 3.054 N/A ALA 116.A N ASP 112.A O no hydrogen 2.926 N/A ALA 117.A N ILE 114.A O no hydrogen 3.151 N/A SER 120.A N ASP 118.A OD2 no hydrogen 2.926 N/A SER 120.A OG ASP 118.A OD2 no hydrogen 2.702 N/A THR 122.A N LEU 119.A O no hydrogen 2.904 N/A THR 122.A OG1 LEU 119.A O no hydrogen 2.731 N/A SER 123.A N GLY 132.A O no hydrogen 3.316 N/A PHE 125.A N TYR 136.A O no hydrogen 2.940 N/A GLY 126.A N PHE 214.A O no hydrogen 2.864 N/A PHE 128.A N ALA 212.A O no hydrogen 3.364 N/A GLY 129.A N ILE 133.A O no hydrogen 3.233 N/A GLY 132.A N GLY 129.A O no hydrogen 2.964 N/A GLY 134.A N SER 123.A O no hydrogen 2.763 N/A GLN 135.A N PRO 127.A O no hydrogen 2.915 N/A TYR 136.A N PHE 125.A O no hydrogen 2.933 N/A TRP 139.A N GLU 182.A OE2 no hydrogen 2.794 N/A TRP 139.A NE1 TYR 257.A OH no hydrogen 2.865 N/A ARG 140.A N GLU 182.A OE1 no hydrogen 3.129 N/A ASP 141.A N THR 138.A OG1 no hydrogen 2.911 N/A PHE 142.A N THR 138.A O no hydrogen 3.249 N/A ILE 143.A N TRP 139.A O no hydrogen 2.902 N/A CYS 144.A N ARG 140.A O no hydrogen 2.831 N/A CYS 144.A SG ARG 140.A O no hydrogen 3.396 N/A ALA 145.A N PHE 142.A O no hydrogen 3.209 N/A ALA 147.A N CYS 144.A O no hydrogen 2.982 N/A ASP 148.A N ALA 145.A O no hydrogen 2.922 N/A HIS 150.A N ASP 148.A OD2 no hydrogen 2.911 N/A VAL 151.A N ASP 148.A O no hydrogen 2.836 N/A TYR 152.A N ASP 148.A O no hydrogen 2.852 N/A TYR 152.A OH ASP 264.A OD1 no hydrogen 2.553 N/A HIS 153.A N TYR 267.A OH no hydrogen 3.054 N/A TRP 154.A NE1 ILE 146.A O no hydrogen 2.897 N/A THR 156.A N HIS 153.A O no hydrogen 3.067 N/A THR 156.A OG1 HIS 153.A O no hydrogen 2.883 N/A VAL 157.A N TRP 154.A O no hydrogen 2.919 N/A MET 158.A N TRP 154.A O no hydrogen 2.876 N/A VAL 162.A N ASP 159.A O no hydrogen 3.156 N/A SER 163.A N ASP 159.A O no hydrogen 2.989 N/A SER 165.A OG GLN 282.A OE1 no hydrogen 2.925 N/A SER 165.A OG ASP 286.A OD1 no hydrogen 2.648 N/A SER 165.A OG ASP 286.A OD2 no hydrogen 3.244 N/A VAL 166.A N VAL 162.A O no hydrogen 2.951 N/A ALA 167.A N SER 163.A O no hydrogen 2.847 N/A GLN 168.A N ALA 164.A O no hydrogen 2.926 N/A ALA 169.A N SER 165.A O no hydrogen 3.069 N/A LEU 170.A N VAL 166.A O no hydrogen 2.866 N/A ASP 171.A N ALA 167.A O no hydrogen 2.925 N/A GLU 172.A N GLN 168.A O no hydrogen 3.267 N/A LEU 173.A N ALA 169.A O no hydrogen 2.991 N/A MET 174.A N LEU 170.A O no hydrogen 2.763 N/A LEU 175.A N ASP 171.A O no hydrogen 3.169 N/A TRP 176.A N GLU 172.A O no hydrogen 3.011 N/A ALA 177.A N LEU 173.A O no hydrogen 2.874 N/A GLU 178.A N LEU 175.A O no hydrogen 3.272 N/A ASP 179.A N TRP 176.A O no hydrogen 2.956 N/A CYS 180.A N ALA 177.A O no hydrogen 3.033 N/A CYS 180.A SG PRO 181.A O no hydrogen 3.544 N/A ARG 184.A NH1 LEU 119.A O no hydrogen 3.438 N/A ARG 184.A NH1 THR 122.A O no hydrogen 3.308 N/A ARG 184.A NH1 THR 122.A OG1 no hydrogen 3.190 N/A ARG 184.A NH2 THR 122.A OG1 no hydrogen 3.042 N/A ARG 184.A NH2 GLY 124.A O no hydrogen 2.974 N/A HIS 185.A N GLY 215.A O no hydrogen 2.797 N/A VAL 187.A N MET 213.A O no hydrogen 2.877 N/A HIS 188.A N GLU 220.A OE1 no hydrogen 2.779 N/A HIS 188.A NE2 ILE 207.A O no hydrogen 2.892 N/A ALA 189.A N GLU 220.A OE2 no hydrogen 2.794 N/A ASP 190.A N HIS 188.A ND1 no hydrogen 2.960 N/A SER 193.A OG ASN 194.A OD1 no hydrogen 3.079 N/A ASN 195.A ND2 ASP 190.A O no hydrogen 2.932 N/A VAL 196.A N SER 193.A O no hydrogen 3.360 N/A LEU 197.A N ALA 205.A O no hydrogen 2.865 N/A THR 198.A N VAL 90.A O no hydrogen 2.843 N/A THR 198.A OG1 ARG 202.A O no hydrogen 2.881 N/A ASP 199.A N ARG 202.A O no hydrogen 2.890 N/A ARG 202.A N ASP 199.A O no hydrogen 2.987 N/A THR 204.A N LEU 197.A O no hydrogen 2.856 N/A THR 204.A OG1 GLN 88.A O no hydrogen 2.728 N/A VAL 206.A N PRO 65.A O no hydrogen 2.813 N/A ILE 207.A N ASN 195.A O no hydrogen 2.849 N/A TRP 209.A N ASP 52.A OD2 no hydrogen 2.762 N/A TRP 209.A NE1 VAL 206.A O no hydrogen 2.920 N/A SER 210.A N ASP 208.A OD2 no hydrogen 3.093 N/A SER 210.A OG ASP 208.A OD2 no hydrogen 3.118 N/A ALA 212.A N TRP 209.A O no hydrogen 2.995 N/A MET 213.A N VAL 187.A O no hydrogen 2.834 N/A PHE 214.A N GLY 126.A O no hydrogen 3.022 N/A GLY 215.A N HIS 185.A O no hydrogen 2.792 N/A LEU 218.A N ASP 216.A OD1 no hydrogen 2.982 N/A TYR 219.A N ASP 216.A O no hydrogen 2.780 N/A GLU 220.A N PRO 217.A O no hydrogen 2.990 N/A ALA 222.A N LEU 218.A O no hydrogen 2.885 N/A ASN 223.A N TYR 219.A O no hydrogen 3.337 N/A ASN 223.A N GLU 220.A O no hydrogen 3.066 N/A PHE 225.A N VAL 221.A O no hydrogen 3.050 N/A PHE 226.A N ALA 222.A O no hydrogen 2.817 N/A TRP 227.A N ASN 223.A O no hydrogen 3.050 N/A ARG 228.A N PHE 225.A O no hydrogen 3.347 N/A ARG 228.A NE GLU 235.A OE1 no hydrogen 2.805 N/A ARG 228.A NH1 GLU 242.A OE1 no hydrogen 2.670 N/A ARG 228.A NH2 GLU 235.A OE2 no hydrogen 2.974 N/A ARG 228.A NH2 GLU 242.A OE2 no hydrogen 3.118 N/A TRP 230.A N TRP 227.A O no hydrogen 2.838 N/A CYS 233.A SG GLY 192.A O no hydrogen 3.523 N/A MET 234.A N LEU 231.A O no hydrogen 3.048 N/A GLU 235.A N LEU 231.A O no hydrogen 3.056 N/A GLN 236.A N ALA 232.A O no hydrogen 2.857 N/A GLN 237.A N CYS 233.A O no hydrogen 3.188 N/A ALA 238.A N MET 234.A O no hydrogen 2.829 N/A ARG 239.A N GLU 235.A O no hydrogen 2.880 N/A ARG 239.A NE GLU 235.A OE2 no hydrogen 2.637 N/A ARG 239.A NH1 GLU 235.A OE2 no hydrogen 3.349 N/A TYR 240.A N GLN 236.A O no hydrogen 3.021 N/A TYR 240.A OH GLN 105.A OE1 no hydrogen 2.247 N/A PHE 241.A N GLN 237.A O no hydrogen 2.916 N/A GLU 242.A N ALA 238.A O no hydrogen 2.825 N/A ARG 243.A N ARG 239.A O no hydrogen 3.044 N/A ARG 244.A N TYR 240.A O no hydrogen 3.309 N/A HIS 245.A N PHE 241.A O no hydrogen 2.774 N/A ALA 249.A N HIS 245.A O no hydrogen 3.001 N/A GLY 250.A N GLU 247.A O no hydrogen 3.270 N/A SER 251.A N LEU 248.A O no hydrogen 3.254 N/A SER 251.A OG LEU 248.A O no hydrogen 2.884 N/A ARG 253.A NH1 ASP 216.A OD2 no hydrogen 2.835 N/A LEU 254.A N SER 251.A OG no hydrogen 3.115 N/A ARG 255.A N SER 251.A O no hydrogen 3.090 N/A ALA 256.A N PRO 252.A O no hydrogen 2.851 N/A TYR 257.A N ARG 253.A O no hydrogen 2.930 N/A TYR 257.A OH ASP 216.A OD2 no hydrogen 2.555 N/A MET 258.A N LEU 254.A O no hydrogen 2.875 N/A LEU 259.A N ARG 255.A O no hydrogen 2.893 N/A ARG 260.A N ALA 256.A O no hydrogen 2.896 N/A ARG 260.A NE PHE 142.A O no hydrogen 3.275 N/A ARG 260.A NE ILE 143.A O no hydrogen 2.906 N/A ARG 260.A NH1 ARG 260.A O no hydrogen 3.342 N/A ARG 260.A NH2 PHE 142.A O no hydrogen 2.944 N/A ILE 261.A N TYR 257.A O no hydrogen 2.940 N/A GLY 262.A N MET 258.A O no hydrogen 2.847 N/A LEU 263.A N LEU 259.A O no hydrogen 2.749 N/A ASP 264.A N ARG 260.A O no hydrogen 3.332 N/A GLN 265.A N ILE 261.A O no hydrogen 2.979 N/A LEU 266.A N GLY 262.A O no hydrogen 2.836 N/A TYR 267.A N LEU 263.A O no hydrogen 2.861 N/A GLN 268.A N ASP 264.A O no hydrogen 2.830 N/A GLN 268.A NE2 ASP 272.A OD2 no hydrogen 3.004 N/A SER 269.A N GLN 265.A O no hydrogen 2.976 N/A SER 269.A OG GLN 265.A O no hydrogen 2.795 N/A LEU 270.A N LEU 266.A O no hydrogen 2.934 N/A VAL 271.A N TYR 267.A O no hydrogen 2.868 N/A ASP 272.A N GLN 268.A O no hydrogen 2.890 N/A GLY 273.A N LEU 270.A O no hydrogen 3.123 N/A ASN 274.A N SER 269.A O no hydrogen 2.851 N/A ALA 278.A N ASN 274.A O no hydrogen 2.964 N/A ALA 279.A N PHE 275.A O no hydrogen 2.871 N/A TRP 280.A N ASP 276.A O no hydrogen 3.003 N/A ALA 281.A N ASP 277.A O no hydrogen 2.979 N/A GLN 282.A N ALA 278.A O no hydrogen 2.864 N/A GLY 283.A N ALA 279.A O no hydrogen 3.008 N/A ARG 284.A N TRP 280.A O no hydrogen 2.883 N/A ARG 284.A NE PHE 226.A O no hydrogen 2.854 N/A ARG 284.A NH1 PHE 225.A O no hydrogen 2.804 N/A CYS 285.A N ALA 281.A O no hydrogen 2.882 N/A CYS 285.A SG ALA 281.A O no hydrogen 3.393 N/A ASP 286.A N GLN 282.A O no hydrogen 2.812 N/A ALA 287.A N GLY 283.A O no hydrogen 2.936 N/A ILE 288.A N ARG 284.A O no hydrogen 2.959 N/A VAL 289.A N CYS 285.A O no hydrogen 2.889 N/A ARG 290.A N ASP 286.A O no hydrogen 2.922 N/A SER 291.A N ALA 287.A O no hydrogen 2.991 N/A SER 291.A OG ILE 288.A O no hydrogen 2.684 N/A GLY 292.A N VAL 289.A O no hydrogen 3.001 N/A ALA 293.A N ARG 290.A O no hydrogen 3.202 N/A