Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3sg8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A N LYS 49.A O no hydrogen 2.801 N/A ARG 2.A NE THR 3.A O no hydrogen 2.733 N/A TYR 4.A OH PRO 48.A O no hydrogen 2.724 N/A THR 5.A N GLN 8.A OE1 no hydrogen 3.288 N/A GLN 8.A N THR 5.A OG1 no hydrogen 2.993 N/A VAL 9.A N THR 5.A O no hydrogen 3.085 N/A GLU 10.A N PHE 6.A O no hydrogen 2.904 N/A LYS 11.A N ASP 7.A O no hydrogen 2.919 N/A ALA 12.A N GLN 8.A O no hydrogen 3.012 N/A ILE 13.A N VAL 9.A O no hydrogen 3.095 N/A GLU 14.A N GLU 10.A O no hydrogen 2.812 N/A GLN 15.A N LYS 11.A O no hydrogen 3.054 N/A LEU 16.A N ILE 13.A O no hydrogen 3.144 N/A TYR 17.A N ILE 13.A O no hydrogen 2.694 N/A TYR 17.A OH THR 81.A O no hydrogen 3.408 N/A PHE 20.A N TYR 17.A O no hydrogen 3.198 N/A ASN 23.A N ASN 40.A OD1 no hydrogen 2.969 N/A SER 28.A N ALA 36.A O no hydrogen 2.762 N/A GLY 29.A N ALA 36.A O no hydrogen 3.289 N/A GLY 31.A N CYS 34.A O no hydrogen 2.917 N/A ASN 32.A ND2 TYR 278.A OH no hydrogen 2.820 N/A ILE 35.A N PHE 47.A O no hydrogen 2.944 N/A ALA 36.A N GLY 29.A O no hydrogen 2.726 N/A TYR 37.A N PHE 45.A O no hydrogen 2.871 N/A GLU 38.A N GLU 26.A O no hydrogen 2.549 N/A ILE 39.A N PHE 43.A O no hydrogen 3.117 N/A ASN 40.A N THR 24.A O no hydrogen 2.902 N/A ASN 40.A ND2 THR 21.A O no hydrogen 3.410 N/A ASP 42.A N ILE 39.A O no hydrogen 3.287 N/A ILE 44.A N PHE 95.A O no hydrogen 2.722 N/A PHE 45.A N TYR 37.A O no hydrogen 2.953 N/A LYS 46.A N ALA 93.A O no hydrogen 2.737 N/A LYS 46.A NZ GLU 60.A OE2 no hydrogen 2.753 N/A LYS 46.A NZ ASP 217.A OD1 no hydrogen 2.698 N/A PHE 47.A N ILE 35.A O no hydrogen 2.955 N/A LYS 49.A N ASP 33.A O no hydrogen 2.849 N/A LYS 49.A NZ GLU 30.A OE2 no hydrogen 3.217 N/A LYS 49.A NZ GLY 31.A O no hydrogen 2.526 N/A HIS 50.A NE2 ASN 32.A O no hydrogen 2.977 N/A SER 51.A OG.A THR 87.A O no hydrogen 2.780 N/A SER 51.A OG.B THR 87.A O no hydrogen 3.031 N/A ARG 52.A NE GLU 281.A O no hydrogen 2.942 N/A GLY 53.A N HIS 50.A ND1 no hydrogen 2.908 N/A SER 54.A N HIS 50.A O no hydrogen 3.058 N/A SER 54.A OG MET 90.A O no hydrogen 2.604 N/A THR 55.A N SER 51.A O no hydrogen 2.990 N/A THR 55.A OG1 SER 51.A O no hydrogen 3.392 N/A THR 55.A OG1 GLN 89.A OE1 no hydrogen 2.865 N/A ASN 56.A N ARG 52.A O no hydrogen 3.059 N/A ASN 56.A ND2.B ASP 33.A OD1 no hydrogen 3.329 N/A ASN 56.A ND2.B ASP 33.A OD2 no hydrogen 3.379 N/A ASN 56.A ND2.B TYR 282.A OH no hydrogen 2.939 N/A LEU 57.A N GLY 53.A O no hydrogen 2.945 N/A PHE 58.A N SER 54.A O no hydrogen 2.806 N/A ASN 59.A N THR 55.A O no hydrogen 2.965 N/A ASN 59.A ND2.A GLY 219.A O no hydrogen 3.133 N/A ASN 59.A ND2.A ALA 221.A O no hydrogen 3.159 N/A GLU 60.A N ASN 56.A O no hydrogen 2.832 N/A VAL 61.A N LEU 57.A O no hydrogen 3.039 N/A ASN 62.A N PHE 58.A O no hydrogen 2.976 N/A ILE 63.A N ASN 59.A O no hydrogen 2.931 N/A LEU 64.A N GLU 60.A O no hydrogen 3.017 N/A LYS 65.A N VAL 61.A O no hydrogen 3.283 N/A ARG 66.A N ILE 63.A O no hydrogen 2.855 N/A ILE 67.A N ILE 63.A O no hydrogen 3.117 N/A ILE 67.A N LEU 64.A O no hydrogen 3.357 N/A LYS 70.A N ILE 67.A O no hydrogen 3.211 N/A VAL 79.A N GLY 94.A O no hydrogen 2.843 N/A PHE 80.A N GLY 94.A O no hydrogen 3.024 N/A THR 81.A N TYR 17.A OH no hydrogen 3.011 N/A GLY 82.A N PHE 92.A O no hydrogen 2.793 N/A MET 83.A N SER 91.A OG no hydrogen 2.890 N/A SER 85.A N TYR 88.A O no hydrogen 2.791 N/A GLU 86.A N GLU 86.A OE1 no hydrogen 2.672 N/A THR 87.A N SER 85.A OG no hydrogen 3.210 N/A TYR 88.A N SER 85.A OG no hydrogen 3.174 N/A MET 90.A N SER 54.A OG no hydrogen 3.027 N/A SER 91.A N MET 83.A O no hydrogen 3.006 N/A SER 91.A OG MET 83.A O no hydrogen 3.445 N/A ALA 93.A N LYS 46.A O no hydrogen 3.032 N/A GLY 94.A N PHE 80.A O no hydrogen 2.748 N/A PHE 95.A N ILE 44.A O no hydrogen 2.655 N/A THR 96.A N GLU 77.A O no hydrogen 3.066 N/A THR 96.A OG1 GLU 77.A OE1 no hydrogen 3.052 N/A LYS 97.A NZ GLU 38.A OE1 no hydrogen 3.101 N/A VAL 101.A N PHE 205.A O no hydrogen 3.040 N/A LEU 103.A N ILE 203.A O no hydrogen 2.788 N/A THR 104.A N PRO 102.A O no hydrogen 2.984 N/A LEU 107.A N THR 104.A OG1 no hydrogen 3.057 N/A LEU 108.A N THR 104.A O no hydrogen 2.857 N/A ASN 109.A N PRO 105.A O no hydrogen 2.951 N/A ASN 110.A N LEU 106.A O no hydrogen 3.173 N/A ASN 110.A N LEU 107.A O no hydrogen 3.082 N/A LEU 111.A N LEU 108.A O no hydrogen 3.053 N/A GLN 116.A N PRO 112.A O no hydrogen 3.012 N/A ASN 117.A N LYS 113.A O no hydrogen 2.876 N/A GLN 118.A N GLN 114.A O no hydrogen 3.042 N/A GLN 118.A NE2 ASP 122.A OD1 no hydrogen 2.980 N/A ALA 119.A N SER 115.A O no hydrogen 2.874 N/A ALA 120.A N GLN 116.A O no hydrogen 2.981 N/A LYS 121.A N ASN 117.A O no hydrogen 2.940 N/A ASP 122.A N GLN 118.A O no hydrogen 2.818 N/A LEU 123.A N ALA 119.A O no hydrogen 2.955 N/A ALA 124.A N ALA 120.A O no hydrogen 2.890 N/A ARG 125.A N LYS 121.A O no hydrogen 2.979 N/A PHE 126.A N ASP 122.A O no hydrogen 3.058 N/A LEU 127.A N LEU 123.A O no hydrogen 2.911 N/A SER 128.A N ALA 124.A O no hydrogen 2.737 N/A GLU 129.A N ARG 125.A O no hydrogen 2.894 N/A LEU 130.A N PHE 126.A O no hydrogen 2.829 N/A HIS 131.A N LEU 127.A O no hydrogen 2.765 N/A HIS 131.A ND1 TYR 252.A OH no hydrogen 2.552 N/A HIS 131.A NE2 ASP 229.A OD1 no hydrogen 2.836 N/A SER 132.A N GLU 129.A O no hydrogen 3.124 N/A SER 132.A OG SER 128.A O no hydrogen 2.661 N/A ILE 133.A N LEU 130.A O no hydrogen 3.083 N/A SER 136.A N ASN 134.A OD1 no hydrogen 2.862 N/A SER 136.A OG ASN 134.A OD1 no hydrogen 2.944 N/A PHE 138.A N ILE 135.A O no hydrogen 2.966 N/A LEU 142.A N LYS 139.A O no hydrogen 3.022 N/A VAL 143.A N SER 140.A O no hydrogen 3.115 N/A LEU 144.A N ILE 223.A O no hydrogen 3.101 N/A PHE 146.A N TYR 189.A OH no hydrogen 3.143 N/A ARG 147.A NH2 GLU 184.A OE2 no hydrogen 2.478 N/A GLU 148.A N ASP 145.A OD2 no hydrogen 2.996 N/A LYS 149.A N ASP 145.A O no hydrogen 3.127 N/A LYS 149.A NZ ASP 153.A OD1 no hydrogen 2.759 N/A LYS 149.A NZ ASP 153.A OD2 no hydrogen 3.378 N/A ILE 150.A N PHE 146.A O no hydrogen 3.027 N/A ASN 151.A N ARG 147.A O no hydrogen 3.071 N/A ASN 151.A ND2 ARG 147.A O no hydrogen 3.210 N/A GLU 152.A N GLU 148.A O no hydrogen 2.853 N/A ASP 153.A N LYS 149.A O no hydrogen 2.744 N/A ASN 154.A N ILE 150.A O no hydrogen 2.959 N/A LYS 155.A N ASN 151.A O no hydrogen 3.233 N/A LYS 156.A N GLU 152.A O no hydrogen 2.906 N/A LYS 156.A NZ GLU 281.A OE2 no hydrogen 2.614 N/A ILE 157.A N ASP 153.A O no hydrogen 2.867 N/A LYS 158.A N ASN 154.A O no hydrogen 3.102 N/A LYS 159.A N LYS 155.A O no hydrogen 2.916 N/A LEU 160.A N LYS 156.A O no hydrogen 2.721 N/A LEU 161.A N ILE 157.A O no hydrogen 2.640 N/A SER 162.A N LYS 158.A O no hydrogen 2.812 N/A GLU 164.A N LEU 161.A O no hydrogen 2.837 N/A LEU 165.A N LEU 161.A O no hydrogen 3.105 N/A LYS 166.A N GLN 169.A OE1 no hydrogen 3.072 N/A MET 170.A N LYS 166.A O no hydrogen 2.968 N/A LYS 171.A N GLY 167.A O no hydrogen 2.957 N/A LYS 171.A NZ ASP 175.A OD1 no hydrogen 2.611 N/A LYS 172.A N PRO 168.A O no hydrogen 3.149 N/A VAL 173.A N GLN 169.A O no hydrogen 2.990 N/A ASP 174.A N MET 170.A O no hydrogen 2.913 N/A ASP 175.A N LYS 171.A O no hydrogen 2.844 N/A PHE 176.A N LYS 172.A O no hydrogen 2.963 N/A TYR 177.A N VAL 173.A O no hydrogen 3.110 N/A TYR 177.A OH TYR 270.A OH no hydrogen 2.786 N/A ARG 178.A N ASP 174.A O no hydrogen 2.961 N/A ASP 179.A N ASP 175.A O no hydrogen 2.913 N/A ILE 180.A N PHE 176.A O no hydrogen 3.111 N/A LEU 181.A N TYR 177.A O no hydrogen 2.967 N/A GLU 182.A N ARG 178.A O no hydrogen 3.230 N/A GLU 182.A N ASP 179.A O no hydrogen 3.329 N/A ASN 183.A N ILE 180.A O no hydrogen 3.110 N/A ILE 185.A N ASN 183.A OD1 no hydrogen 3.223 N/A TYR 186.A N ASN 183.A O no hydrogen 3.341 N/A PHE 187.A N GLU 184.A O no hydrogen 2.966 N/A LYS 188.A N GLU 184.A O no hydrogen 3.126 N/A TYR 189.A OH LEU 144.A O no hydrogen 3.160 N/A CYS 192.A N SER 224.A O no hydrogen 3.113 N/A CYS 192.A SG LEU 193.A O no hydrogen 3.643 N/A ILE 194.A N ALA 222.A O no hydrogen 2.796 N/A HIS 195.A N ASP 229.A OD1 no hydrogen 2.998 N/A HIS 195.A NE2 ILE 216.A O no hydrogen 2.937 N/A ASN 196.A N ASP 229.A OD2 no hydrogen 2.875 N/A ASN 196.A ND2 ASP 220.A O no hydrogen 3.197 N/A ASP 197.A N HIS 195.A ND1 no hydrogen 3.058 N/A SER 199.A OG ASP 197.A O no hydrogen 3.474 N/A SER 199.A OG ASP 201.A OD2 no hydrogen 2.762 N/A SER 200.A N GLU 239.A OE1 no hydrogen 2.773 N/A SER 200.A OG GLU 238.A O no hydrogen 3.458 N/A SER 200.A OG GLU 239.A OE1 no hydrogen 2.895 N/A HIS 202.A N SER 199.A O no hydrogen 2.976 N/A HIS 202.A ND1 ASP 197.A O no hydrogen 2.853 N/A ILE 203.A N SER 200.A O no hydrogen 3.222 N/A LEU 204.A N GLY 214.A O no hydrogen 2.845 N/A PHE 205.A N VAL 101.A O no hydrogen 2.665 N/A ASP 206.A N THR 211.A O no hydrogen 2.852 N/A GLU 208.A N ASP 206.A OD1 no hydrogen 3.102 N/A LYS 209.A N ASP 206.A OD1 no hydrogen 3.326 N/A LYS 209.A NZ ASP 206.A OD2 no hydrogen 2.755 N/A THR 211.A N ASP 206.A O no hydrogen 3.362 N/A CYS 213.A N LEU 204.A O no hydrogen 2.815 N/A CYS 213.A SG LYS 99.A O no hydrogen 3.359 N/A ILE 215.A N PRO 74.A O no hydrogen 3.059 N/A ILE 216.A N HIS 202.A O no hydrogen 2.968 N/A PHE 218.A N GLU 60.A OE1 no hydrogen 2.801 N/A ALA 221.A N PHE 218.A O no hydrogen 3.144 N/A ALA 222.A N ILE 194.A O no hydrogen 3.144 N/A ILE 223.A N LEU 142.A O no hydrogen 2.921 N/A SER 224.A N CYS 192.A O no hydrogen 2.997 N/A SER 224.A OG LEU 144.A O no hydrogen 2.753 N/A ASP 227.A N ASP 225.A OD2 no hydrogen 2.885 N/A ASN 228.A N ASP 225.A O no hydrogen 3.192 N/A ASN 228.A ND2 ASN 196.A OD1 no hydrogen 3.299 N/A ASP 229.A N PRO 226.A O no hydrogen 3.184 N/A PHE 230.A N ASP 227.A O no hydrogen 3.110 N/A ILE 231.A N ASP 227.A O no hydrogen 3.157 N/A SER 232.A N ASN 228.A O no hydrogen 3.328 N/A SER 232.A OG PHE 198.A O no hydrogen 2.750 N/A SER 232.A OG ASN 228.A O no hydrogen 3.101 N/A LEU 233.A N PHE 230.A O no hydrogen 2.982 N/A MET 234.A N ILE 231.A O no hydrogen 3.256 N/A GLU 239.A N GLU 235.A O no hydrogen 3.177 N/A TYR 240.A N LEU 233.A O no hydrogen 2.918 N/A TYR 240.A OH LEU 103.A O no hydrogen 2.592 N/A GLY 241.A N LEU 233.A O no hydrogen 3.239 N/A VAL 245.A N GLY 241.A O no hydrogen 3.285 N/A SER 246.A N MET 242.A O no hydrogen 2.945 N/A SER 246.A OG MET 242.A O no hydrogen 2.951 N/A SER 246.A OG GLU 243.A O no hydrogen 2.737 N/A LYS 247.A N GLU 243.A O no hydrogen 3.340 N/A ILE 248.A N PHE 244.A O no hydrogen 3.214 N/A LEU 249.A N VAL 245.A O no hydrogen 2.779 N/A ASN 250.A N SER 246.A O no hydrogen 2.930 N/A HIS 251.A N LYS 247.A O no hydrogen 2.965 N/A TYR 252.A N ILE 248.A O no hydrogen 2.915 N/A TYR 252.A OH HIS 131.A ND1 no hydrogen 2.552 N/A LYS 253.A N ASN 250.A O no hydrogen 3.104 N/A HIS 254.A N LEU 249.A O no hydrogen 3.023 N/A HIS 254.A NE2 ASP 227.A OD1 no hydrogen 2.816 N/A ASP 256.A N HIS 254.A ND1 no hydrogen 3.042 N/A THR 259.A N ASP 256.A O no hydrogen 3.190 N/A THR 259.A N ASP 256.A OD1 no hydrogen 3.368 N/A THR 259.A OG1 ASP 256.A OD2 no hydrogen 2.542 N/A LEU 261.A N ILE 257.A O no hydrogen 3.075 N/A GLU 262.A N PRO 258.A O no hydrogen 3.053 N/A LYS 263.A N THR 259.A O no hydrogen 2.956 N/A LYS 263.A NZ ASP 225.A OD1 no hydrogen 2.501 N/A LYS 263.A NZ ASP 227.A OD2 no hydrogen 2.807 N/A TYR 264.A N VAL 260.A O no hydrogen 2.926 N/A TYR 264.A OH GLU 268.A OE2 no hydrogen 3.416 N/A ARG 265.A N LEU 261.A O no hydrogen 2.913 N/A MET 266.A N GLU 262.A O no hydrogen 2.968 N/A LYS 267.A N LYS 263.A O no hydrogen 2.921 N/A LYS 267.A NZ GLU 274.A OE2 no hydrogen 3.022 N/A GLU 268.A N TYR 264.A O no hydrogen 2.867 N/A LYS 269.A N ARG 265.A O no hydrogen 3.117 N/A TYR 270.A N MET 266.A O no hydrogen 2.759 N/A TYR 270.A OH ASP 153.A OD2 no hydrogen 2.578 N/A TYR 270.A OH TYR 177.A OH no hydrogen 2.786 N/A TRP 271.A N GLU 268.A O no hydrogen 3.390 N/A SER 272.A OG GLU 294.A OE1 no hydrogen 2.661 N/A GLU 274.A N TYR 270.A O no hydrogen 2.979 N/A LYS 275.A N TRP 271.A O no hydrogen 2.807 N/A LYS 275.A NZ GLU 290.A OE2 no hydrogen 2.486 N/A LYS 275.A NZ GLU 294.A OE1 no hydrogen 3.388 N/A LYS 275.A NZ GLU 294.A OE2 no hydrogen 2.778 N/A ILE 276.A N SER 272.A O no hydrogen 3.262 N/A ILE 277.A N PHE 273.A O no hydrogen 3.031 N/A TYR 278.A N GLU 274.A O no hydrogen 2.708 N/A GLY 279.A N LYS 275.A O no hydrogen 2.918 N/A LYS 280.A N ILE 276.A O no hydrogen 3.275 N/A GLU 281.A N ILE 277.A O no hydrogen 3.091 N/A TYR 282.A N TYR 278.A O no hydrogen 2.810 N/A TYR 284.A N GLY 279.A O no hydrogen 2.670 N/A TYR 288.A N TYR 284.A O no hydrogen 3.340 N/A GLU 289.A N MET 285.A O no hydrogen 2.920 N/A GLU 290.A N ASP 286.A O no hydrogen 3.069 N/A GLY 291.A N TRP 287.A O no hydrogen 2.989 N/A LEU 292.A N TYR 288.A O no hydrogen 3.018 N/A ASN 293.A N GLU 289.A O no hydrogen 3.015 N/A GLU 294.A N GLU 290.A O no hydrogen 2.948 N/A ILE 295.A N GLY 291.A O no hydrogen 3.022 N/A ARG 296.A N LEU 292.A O no hydrogen 3.134 N/A ARG 296.A NH2 GLU 164.A O no hydrogen 2.944 N/A ARG 296.A NH2 GLU 164.A OE1 no hydrogen 3.097 N/A SER 297.A N GLU 294.A O no hydrogen 3.119 N/A SER 297.A OG ASN 293.A O no hydrogen 3.440 N/A