Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4l59_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 3.A NE1 GLU 245.A OE2 no hydrogen 2.807 N/A SER 5.A OG GLU 9.A OE1 no hydrogen 2.769 N/A TYR 6.A N CYS 2.A O no hydrogen 2.978 N/A TYR 6.A OH ASP 273.A OD2 no hydrogen 2.519 N/A LEU 7.A N TRP 3.A O no hydrogen 2.678 N/A GLU 8.A N ALA 4.A O no hydrogen 2.977 N/A GLU 9.A N SER 5.A O no hydrogen 2.822 N/A GLU 10.A N TYR 6.A O no hydrogen 2.897 N/A LYS 11.A N GLU 8.A O no hydrogen 2.813 N/A ALA 12.A N LEU 7.A O no hydrogen 3.015 N/A VAL 15.A N LYS 243.A O no hydrogen 2.937 N/A LEU 19.A N PRO 16.A O no hydrogen 2.764 N/A PHE 20.A N ALA 17.A O no hydrogen 3.048 N/A LYS 21.A N GLN 24.A OE1 no hydrogen 2.813 N/A HIS 23.A NE2 ASP 286.A O no hydrogen 2.721 N/A GLN 24.A N LYS 21.A O no hydrogen 2.874 N/A GLN 24.A NE2 ALA 285.A O no hydrogen 2.785 N/A GLN 24.A NE2 SER 287.A O no hydrogen 2.858 N/A SER 25.A N LYS 21.A O no hydrogen 3.097 N/A SER 25.A N GLU 22.A O no hydrogen 3.379 N/A SER 25.A OG LYS 21.A O no hydrogen 3.414 N/A SER 25.A OG GLU 22.A O no hydrogen 3.319 N/A ASN 31.A ND2 GLY 60.A O no hydrogen 2.876 N/A ASN 31.A ND2 ARG 62.A O no hydrogen 3.237 N/A PHE 33.A N ASN 31.A OD1 no hydrogen 3.127 N/A GLY 36.A N VAL 55.A O no hydrogen 2.826 N/A MET 37.A N LYS 34.A O no hydrogen 3.187 N/A LYS 38.A N GLN 121.A O no hydrogen 3.078 N/A LYS 38.A NZ ASP 68.A OD2 no hydrogen 2.955 N/A LEU 39.A N LEU 53.A O no hydrogen 2.950 N/A GLU 40.A N HIS 86.A O no hydrogen 2.940 N/A GLY 41.A N CYS 51.A O no hydrogen 3.045 N/A VAL 42.A N ASP 84.A O no hydrogen 3.021 N/A ASP 43.A N VAL 49.A O no hydrogen 3.029 N/A GLU 45.A N ASP 43.A OD1 no hydrogen 3.023 N/A HIS 46.A N ASP 43.A O no hydrogen 2.930 N/A HIS 46.A ND1 GLU 174.A OE1 no hydrogen 3.146 N/A HIS 46.A ND1 GLU 174.A OE2 no hydrogen 2.707 N/A GLN 47.A NE2 PRO 44.A O no hydrogen 3.317 N/A VAL 49.A N HIS 46.A O no hydrogen 2.834 N/A TYR 50.A OH ASP 159.A OD2 no hydrogen 2.506 N/A CYS 51.A N GLY 41.A O no hydrogen 2.739 N/A LEU 53.A N LEU 39.A O no hydrogen 2.896 N/A THR 54.A N HIS 66.A O no hydrogen 2.912 N/A THR 54.A OG1 ASP 68.A OD1 no hydrogen 2.501 N/A THR 54.A OG1 ASP 68.A OD2 no hydrogen 3.150 N/A VAL 55.A N MET 37.A O no hydrogen 2.884 N/A ALA 56.A N LYS 64.A O no hydrogen 2.829 N/A GLU 57.A N LYS 64.A O no hydrogen 3.359 N/A CYS 59.A N ARG 62.A O no hydrogen 3.011 N/A ARG 62.A N CYS 59.A O no hydrogen 2.896 N/A ARG 62.A NH1 PRO 252.A O no hydrogen 2.808 N/A ARG 62.A NH1 MET 253.A O no hydrogen 3.532 N/A ARG 62.A NH1 HIS 301.A NE2 no hydrogen 3.283 N/A ARG 62.A NH2 PRO 252.A O no hydrogen 2.773 N/A ILE 63.A N VAL 78.A O no hydrogen 2.900 N/A LYS 64.A N GLU 57.A O no hydrogen 2.891 N/A LYS 64.A NZ GLU 57.A OE2 no hydrogen 3.112 N/A LEU 65.A N PHE 76.A O no hydrogen 2.661 N/A HIS 66.A N THR 54.A O no hydrogen 2.830 N/A HIS 66.A ND1 ASP 75.A OD1 no hydrogen 2.827 N/A ASP 68.A N VAL 52.A O no hydrogen 3.294 N/A TYR 70.A N PHE 67.A O no hydrogen 2.966 N/A TYR 70.A OH HIS 99.A NE2 no hydrogen 2.968 N/A CYS 73.A N SER 71.A OG no hydrogen 3.063 N/A TYR 74.A N SER 71.A O no hydrogen 3.204 N/A ASP 75.A N ASP 72.A O no hydrogen 2.977 N/A PHE 76.A N LEU 65.A O no hydrogen 3.030 N/A VAL 78.A N ILE 63.A O no hydrogen 2.891 N/A ASN 79.A ND2 PRO 288.A O no hydrogen 2.921 N/A ALA 80.A N TYR 61.A O no hydrogen 2.696 N/A ALA 82.A N ASN 79.A O no hydrogen 2.817 N/A HIS 86.A N GLU 40.A O no hydrogen 2.932 N/A GLY 89.A N GLU 40.A OE2 no hydrogen 2.806 N/A TRP 90.A N PRO 87.A O no hydrogen 2.989 N/A CYS 91.A N GLU 40.A OE1 no hydrogen 2.791 N/A CYS 91.A SG GLU 40.A OE1 no hydrogen 3.142 N/A CYS 91.A SG LYS 97.A O no hydrogen 4.011 N/A LYS 93.A N GLY 89.A O no hydrogen 2.907 N/A THR 94.A N TRP 90.A O no hydrogen 2.756 N/A THR 94.A OG1 TRP 90.A O no hydrogen 2.620 N/A THR 94.A OG1 CYS 91.A O no hydrogen 3.370 N/A THR 94.A OG1 HIS 96.A ND1 no hydrogen 2.835 N/A HIS 96.A N CYS 91.A O no hydrogen 2.829 N/A HIS 96.A ND1 THR 94.A OG1 no hydrogen 2.835 N/A HIS 96.A NE2 ASP 159.A OD1 no hydrogen 2.742 N/A HIS 99.A N TYR 50.A O no hydrogen 2.773 N/A HIS 99.A NE2 TYR 70.A OH no hydrogen 2.968 N/A LYS 102.A N ASP 68.A O no hydrogen 3.282 N/A TYR 104.A N PRO 101.A O no hydrogen 2.990 N/A LYS 105.A N GLU 108.A OE1 no hydrogen 3.007 N/A GLU 107.A N GLU 107.A OE2 no hydrogen 2.994 N/A GLU 108.A N LYS 105.A O no hydrogen 2.859 N/A PHE 109.A N GLU 106.A O no hydrogen 3.053 N/A TRP 111.A NE1 GLU 40.A OE2 no hydrogen 2.799 N/A THR 113.A N ASN 110.A OD1 no hydrogen 2.915 N/A THR 113.A OG1 ASN 110.A O no hydrogen 3.141 N/A THR 113.A OG1 ASN 110.A OD1 no hydrogen 2.661 N/A TYR 114.A N ASN 110.A O no hydrogen 2.946 N/A TYR 114.A OH ASP 68.A OD2 no hydrogen 2.585 N/A LEU 115.A N TRP 111.A O no hydrogen 2.797 N/A LYS 116.A N GLN 112.A O no hydrogen 3.330 N/A THR 117.A N THR 113.A O no hydrogen 2.863 N/A THR 117.A OG1 THR 113.A O no hydrogen 3.032 N/A CYS 118.A N TYR 114.A O no hydrogen 2.854 N/A CYS 118.A SG TYR 114.A O no hydrogen 3.356 N/A LYS 119.A N LYS 116.A O no hydrogen 3.155 N/A ALA 120.A N LEU 115.A O no hydrogen 3.038 N/A ALA 123.A N LYS 38.A O no hydrogen 2.909 N/A LEU 127.A N PRO 124.A O no hydrogen 3.122 N/A PHE 128.A N LYS 125.A O no hydrogen 3.057 N/A PHE 135.A N SER 133.A OG no hydrogen 3.420 N/A ARG 136.A NH2 SER 133.A O no hydrogen 2.876 N/A ARG 136.A NH2 PHE 135.A O no hydrogen 2.927 N/A GLY 138.A N VAL 157.A O no hydrogen 2.757 N/A MET 139.A N ARG 136.A O no hydrogen 2.973 N/A LYS 140.A N LEU 223.A O no hydrogen 3.050 N/A LYS 140.A NZ THR 156.A OG1 no hydrogen 2.951 N/A LYS 140.A NZ ASP 170.A OD2 no hydrogen 2.765 N/A LEU 141.A N ALA 155.A O no hydrogen 2.992 N/A GLU 142.A N HIS 188.A O no hydrogen 2.828 N/A ALA 143.A N CYS 153.A O no hydrogen 2.819 N/A VAL 144.A N HIS 186.A O no hydrogen 2.823 N/A ASP 145.A N PHE 151.A O no hydrogen 3.108 N/A LYS 147.A N ASP 145.A OD1 no hydrogen 2.895 N/A LYS 147.A NZ SER 175.A O no hydrogen 2.964 N/A ASN 148.A N ASP 145.A O no hydrogen 2.878 N/A ASN 148.A ND2 ASP 145.A OD2 no hydrogen 3.021 N/A PHE 151.A N ASN 148.A O no hydrogen 3.032 N/A CYS 153.A N ALA 143.A O no hydrogen 2.812 N/A VAL 154.A N ILE 201.A O no hydrogen 3.231 N/A ALA 155.A N LEU 141.A O no hydrogen 3.007 N/A THR 156.A N HIS 168.A O no hydrogen 2.770 N/A THR 156.A OG1 ASP 170.A OD1 no hydrogen 2.423 N/A VAL 157.A N MET 139.A O no hydrogen 2.798 N/A THR 158.A N LEU 166.A O no hydrogen 2.943 N/A MET 160.A N ASP 159.A OD1 no hydrogen 2.910 N/A VAL 161.A N ARG 164.A O no hydrogen 2.837 N/A ARG 164.A N VAL 161.A O no hydrogen 3.065 N/A ARG 164.A NE ASP 84.A OD1 no hydrogen 3.302 N/A ARG 164.A NH2 ASP 84.A OD2 no hydrogen 2.796 N/A PHE 165.A N CYS 180.A O no hydrogen 2.823 N/A LEU 166.A N ASP 159.A O no hydrogen 2.890 N/A VAL 167.A N TYR 178.A O no hydrogen 2.843 N/A HIS 168.A N THR 156.A O no hydrogen 2.891 N/A HIS 168.A ND1 ASP 177.A OD1 no hydrogen 2.783 N/A ASP 170.A N VAL 154.A O no hydrogen 3.293 N/A ASN 171.A ND2 PRO 204.A O no hydrogen 2.653 N/A TRP 172.A N PHE 169.A O no hydrogen 2.917 N/A SER 175.A N ASP 173.A OD2 no hydrogen 3.179 N/A SER 175.A OG ASP 173.A OD2 no hydrogen 2.545 N/A TYR 176.A N ASP 173.A O no hydrogen 3.195 N/A ASP 177.A N GLU 174.A O no hydrogen 2.938 N/A TYR 178.A N VAL 167.A O no hydrogen 3.180 N/A TYR 178.A OH VAL 144.A O no hydrogen 2.667 N/A TRP 179.A N GLN 47.A OE1 no hydrogen 3.014 N/A TRP 179.A NE1 GLN 47.A O no hydrogen 2.775 N/A CYS 180.A N PHE 165.A O no hydrogen 2.810 N/A CYS 180.A SG GLU 181.A O no hydrogen 3.848 N/A SER 184.A N GLU 181.A O no hydrogen 3.225 N/A SER 184.A OG HIS 186.A ND1 no hydrogen 3.422 N/A HIS 186.A N SER 184.A OG no hydrogen 2.834 N/A ILE 187.A N SER 184.A O no hydrogen 3.437 N/A HIS 188.A N GLU 142.A O no hydrogen 2.710 N/A GLY 191.A N GLU 142.A OE2 no hydrogen 2.756 N/A TRP 192.A N GLU 142.A OE1 no hydrogen 3.152 N/A CYS 193.A N GLU 142.A OE1 no hydrogen 2.892 N/A CYS 193.A SG GLU 142.A OE1 no hydrogen 3.318 N/A GLU 195.A N GLY 191.A O no hydrogen 3.458 N/A HIS 196.A N CYS 193.A O no hydrogen 3.213 N/A HIS 196.A ND1 TRP 192.A O no hydrogen 2.805 N/A ARG 197.A N LYS 194.A O no hydrogen 3.007 N/A ARG 198.A N CYS 193.A O no hydrogen 2.895 N/A ILE 201.A N ILE 152.A O no hydrogen 2.759 N/A TYR 206.A OH GLU 219.A OE1 no hydrogen 3.331 N/A TYR 206.A OH GLU 219.A OE2 no hydrogen 2.968 N/A TRP 213.A NE1 GLU 142.A OE2 no hydrogen 2.785 N/A LYS 215.A N SER 212.A OG no hydrogen 3.280 N/A TYR 216.A N SER 212.A O no hydrogen 3.009 N/A TYR 216.A OH ASP 170.A OD2 no hydrogen 2.631 N/A LEU 217.A N TRP 213.A O no hydrogen 2.821 N/A GLU 218.A N ASP 214.A O no hydrogen 3.239 N/A GLU 219.A N LYS 215.A O no hydrogen 2.827 N/A THR 220.A N TYR 216.A O no hydrogen 2.940 N/A THR 220.A OG1 TYR 216.A O no hydrogen 3.072 N/A THR 220.A OG1 LEU 217.A O no hydrogen 3.353 N/A THR 220.A OG1 SER 222.A OG no hydrogen 2.834 N/A ASN 221.A N GLU 218.A O no hydrogen 2.949 N/A SER 222.A N LEU 217.A O no hydrogen 2.806 N/A SER 222.A OG THR 220.A O no hydrogen 2.779 N/A SER 222.A OG THR 220.A OG1 no hydrogen 2.834 N/A ALA 225.A N LYS 140.A O no hydrogen 3.024 N/A ALA 229.A N PRO 226.A O no hydrogen 2.906 N/A PHE 230.A N ALA 227.A O no hydrogen 3.153 N/A LYS 231.A N ALA 182.A O no hydrogen 3.279 N/A LYS 233.A NZ ASP 286.A OD2 no hydrogen 3.206 N/A HIS 236.A NE2 ASP 264.A O no hydrogen 2.802 N/A PHE 238.A N HIS 236.A ND1 no hydrogen 3.036 N/A LYS 241.A N VAL 260.A O no hydrogen 2.851 N/A MET 242.A N GLN 239.A O no hydrogen 3.194 N/A LYS 243.A N VAL 13.A O no hydrogen 2.946 N/A LYS 243.A NZ ASP 273.A OD2 no hydrogen 3.243 N/A LEU 244.A N ALA 258.A O no hydrogen 2.807 N/A GLU 245.A N HIS 291.A O no hydrogen 2.875 N/A VAL 246.A N ARG 256.A O no hydrogen 3.021 N/A VAL 247.A N ASP 289.A O no hydrogen 2.958 N/A ASP 248.A N PHE 254.A O no hydrogen 3.005 N/A LYS 249.A N TYR 281.A OH no hydrogen 3.160 N/A ARG 250.A N ASP 248.A OD1 no hydrogen 2.996 N/A ARG 250.A NH1 TYR 279.A O no hydrogen 2.932 N/A ARG 250.A NH2 TYR 279.A O no hydrogen 3.230 N/A ASN 251.A N ASP 248.A O no hydrogen 2.905 N/A PHE 254.A N ASN 251.A O no hydrogen 3.064 N/A ARG 256.A N VAL 246.A O no hydrogen 2.816 N/A ARG 256.A NE ASP 248.A OD2 no hydrogen 2.798 N/A ARG 256.A NH2 ASP 248.A OD2 no hydrogen 3.455 N/A VAL 257.A N GLN 304.A O no hydrogen 3.141 N/A ALA 258.A N LEU 244.A O no hydrogen 2.849 N/A THR 259.A N HIS 271.A O no hydrogen 2.810 N/A THR 259.A OG1 ASP 273.A OD1 no hydrogen 2.430 N/A VAL 260.A N MET 242.A O no hydrogen 2.923 N/A ALA 261.A N LYS 269.A O no hydrogen 2.647 N/A ASP 262.A N LYS 269.A O no hydrogen 3.446 N/A THR 263.A N ASP 262.A OD1 no hydrogen 2.757 N/A ASP 264.A N ARG 267.A O no hydrogen 3.072 N/A HIS 266.A N ASP 264.A OD1 no hydrogen 3.284 N/A ARG 267.A N ASP 264.A OD1 no hydrogen 2.858 N/A ARG 267.A NE ASP 264.A OD2 no hydrogen 2.974 N/A ARG 267.A NH1 ASP 264.A OD2 no hydrogen 3.087 N/A VAL 268.A N ILE 283.A O no hydrogen 2.968 N/A LYS 269.A N ASP 262.A O no hydrogen 2.936 N/A VAL 270.A N TYR 281.A O no hydrogen 2.976 N/A HIS 271.A N THR 259.A O no hydrogen 2.920 N/A HIS 271.A ND1 ASP 280.A OD1 no hydrogen 2.666 N/A ASP 273.A N VAL 257.A O no hydrogen 3.214 N/A TRP 275.A N PHE 272.A O no hydrogen 3.044 N/A CYS 278.A N ASN 276.A OD1 no hydrogen 2.744 N/A CYS 278.A SG ASN 276.A OD1 no hydrogen 2.938 N/A TYR 279.A N ASN 276.A O no hydrogen 3.137 N/A ASP 280.A N ASN 277.A O no hydrogen 3.008 N/A TYR 281.A N VAL 270.A O no hydrogen 3.217 N/A ILE 283.A N VAL 268.A O no hydrogen 2.919 N/A ALA 285.A N HIS 266.A O no hydrogen 2.860 N/A SER 287.A N ASP 284.A O no hydrogen 2.965 N/A ASP 289.A N SER 287.A OG no hydrogen 2.858 N/A ILE 290.A N SER 287.A O no hydrogen 3.356 N/A HIS 291.A N GLU 245.A O no hydrogen 2.738 N/A HIS 291.A ND1 GLN 24.A O no hydrogen 2.698 N/A GLY 294.A N GLU 245.A OE2 no hydrogen 2.885 N/A TRP 295.A N PRO 292.A O no hydrogen 3.007 N/A TRP 295.A NE1 SER 25.A O no hydrogen 3.068 N/A CYS 296.A N GLU 245.A OE1 no hydrogen 2.803 N/A CYS 296.A SG GLU 245.A OE1 no hydrogen 3.402 N/A CYS 296.A SG PRO 302.A O no hydrogen 3.697 N/A LYS 298.A N GLY 294.A O no hydrogen 2.965 N/A THR 299.A N TRP 295.A O no hydrogen 3.038 N/A THR 299.A N CYS 296.A O no hydrogen 3.238 N/A THR 299.A OG1 TRP 295.A O no hydrogen 2.698 N/A THR 299.A OG1 CYS 296.A O no hydrogen 3.248 N/A GLY 300.A N CYS 296.A O no hydrogen 2.945 N/A HIS 301.A N CYS 296.A O no hydrogen 2.920 N/A HIS 301.A ND1 PRO 302.A O no hydrogen 2.697 N/A GLN 304.A N ILE 255.A O no hydrogen 2.842 N/A LEU 307.A N ASP 273.A O no hydrogen 3.453 N/A