Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wi5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A N LYS 44.A O no hydrogen 2.747 N/A THR 3.A OG1 ASP 1.A OD1 no hydrogen 3.472 N/A TYR 5.A N GLY 42.A O no hydrogen 3.168 N/A TYR 5.A OH GLU 60.A OE1 no hydrogen 2.631 N/A GLY 6.A N PHE 312.A O no hydrogen 2.836 N/A THR 7.A N LYS 40.A O no hydrogen 3.009 N/A ILE 8.A N HIS 310.A O no hydrogen 2.833 N/A LYS 9.A N SER 39.A OG no hydrogen 2.975 N/A LYS 9.A NZ ASP 107.A OD1 no hydrogen 2.844 N/A ALA 10.A N LEU 308.A O no hydrogen 3.060 N/A GLY 11.A N VAL 35.A O no hydrogen 2.990 N/A VAL 12.A N VAL 306.A O no hydrogen 2.910 N/A GLU 13.A N GLY 33.A O no hydrogen 2.900 N/A THR 14.A N GLY 304.A O no hydrogen 2.909 N/A THR 14.A OG1 ALA 31.A O no hydrogen 3.329 N/A THR 14.A OG1 THR 32.A OG1 no hydrogen 2.790 N/A SER 15.A N ALA 31.A O no hydrogen 2.807 N/A ARG 16.A N THR 302.A O no hydrogen 2.872 N/A SER 17.A N THR 29.A O no hydrogen 2.834 N/A VAL 18.A N VAL 300.A O no hydrogen 2.805 N/A PHE 19.A N GLU 27.A O no hydrogen 3.014 N/A HIS 20.A N LYS 298.A O no hydrogen 2.876 N/A GLN 21.A N GLN 24.A O no hydrogen 3.376 N/A ASN 22.A ND2 GLU 296.A OE2 no hydrogen 3.426 N/A THR 26.A N PHE 19.A O no hydrogen 2.855 N/A THR 29.A N SER 17.A O no hydrogen 3.049 N/A ALA 31.A N SER 15.A O no hydrogen 3.202 N/A THR 32.A OG1 THR 14.A OG1 no hydrogen 2.790 N/A GLY 33.A N GLU 13.A O no hydrogen 2.932 N/A VAL 35.A N GLY 11.A O no hydrogen 2.905 N/A LEU 37.A N LYS 9.A O no hydrogen 2.849 N/A GLY 38.A N ASP 36.A OD1 no hydrogen 2.641 N/A SER 39.A N ASP 36.A OD1 no hydrogen 2.745 N/A SER 39.A OG LYS 9.A O no hydrogen 3.291 N/A SER 39.A OG ASP 36.A OD2 no hydrogen 2.670 N/A LYS 40.A N THR 7.A O no hydrogen 2.920 N/A LYS 40.A NZ GLU 60.A OE1 no hydrogen 3.408 N/A ILE 41.A N GLN 61.A O no hydrogen 3.145 N/A GLY 42.A N TYR 5.A O no hydrogen 2.956 N/A PHE 43.A N VAL 59.A O no hydrogen 2.778 N/A LYS 44.A N THR 3.A O no hydrogen 2.943 N/A GLY 45.A N TRP 57.A O no hydrogen 2.968 N/A GLN 46.A N ASP 1.A O no hydrogen 3.264 N/A GLU 47.A N ALA 55.A O no hydrogen 2.906 N/A LEU 49.A N LEU 53.A O no hydrogen 2.833 N/A GLY 50.A N ASP 48.A OD1 no hydrogen 2.949 N/A LEU 53.A N GLY 50.A O no hydrogen 3.083 N/A LYS 54.A N LYS 82.A O no hydrogen 2.538 N/A LYS 54.A NZ GLN 46.A OE1 no hydrogen 3.078 N/A ALA 55.A N GLU 47.A O no hydrogen 2.978 N/A ILE 56.A N GLY 80.A O no hydrogen 2.980 N/A TRP 57.A N GLY 45.A O no hydrogen 3.064 N/A GLN 58.A N PHE 78.A O no hydrogen 3.028 N/A GLN 58.A NE2 GLN 76.A O no hydrogen 2.845 N/A VAL 59.A N PHE 43.A O no hydrogen 2.754 N/A GLU 60.A N SER 77.A OG no hydrogen 3.102 N/A GLN 61.A N ILE 41.A O no hydrogen 2.908 N/A LYS 62.A N ASN 74.A OD1 no hydrogen 2.743 N/A ALA 63.A N SER 39.A O no hydrogen 2.865 N/A SER 64.A N ASP 69.A OD2 no hydrogen 2.860 N/A ILE 65.A N ASP 36.A OD2 no hydrogen 2.824 N/A ALA 66.A N SER 64.A OG no hydrogen 3.047 N/A GLY 67.A N SER 64.A O no hydrogen 2.939 N/A ARG 75.A N GLU 60.A O no hydrogen 2.845 N/A ARG 75.A NE GLU 60.A OE2 no hydrogen 2.665 N/A SER 77.A N ARG 92.A O no hydrogen 2.891 N/A SER 77.A OG ARG 75.A O no hydrogen 3.110 N/A PHE 78.A N GLN 58.A O no hydrogen 2.951 N/A ILE 79.A N VAL 90.A O no hydrogen 2.971 N/A GLY 80.A N ILE 56.A O no hydrogen 2.915 N/A LEU 81.A N LEU 88.A O no hydrogen 2.945 N/A LYS 82.A N LYS 54.A O no hydrogen 2.779 N/A GLY 83.A N GLY 86.A O no hydrogen 2.962 N/A GLY 86.A N GLY 83.A O no hydrogen 3.089 N/A LYS 87.A N ASP 131.A O no hydrogen 2.811 N/A LEU 88.A N LEU 81.A O no hydrogen 2.891 N/A ARG 89.A N ARG 129.A O no hydrogen 2.843 N/A ARG 89.A NH2 ASP 131.A OD2 no hydrogen 2.722 N/A VAL 90.A N ILE 79.A O no hydrogen 2.843 N/A GLY 91.A N SER 127.A O no hydrogen 3.218 N/A LEU 93.A N LEU 125.A O no hydrogen 2.962 N/A ASN 94.A N GLN 76.A OE1 no hydrogen 3.020 N/A ASN 94.A ND2 ASP 99.A OD1 no hydrogen 2.997 N/A SER 95.A N ALA 123.A O no hydrogen 3.000 N/A SER 95.A OG ALA 123.A O no hydrogen 3.430 N/A VAL 96.A N GLN 143.A OE1 no hydrogen 2.851 N/A LYS 98.A N SER 95.A OG no hydrogen 3.052 N/A ASP 99.A N SER 95.A O no hydrogen 3.336 N/A ASP 99.A N VAL 96.A O no hydrogen 2.953 N/A THR 100.A N LEU 97.A O no hydrogen 3.050 N/A THR 100.A OG1 LEU 97.A O no hydrogen 3.179 N/A TRP 106.A N ASN 104.A OD1 no hydrogen 3.421 N/A TRP 106.A NE1 SER 248.A OG no hydrogen 2.884 N/A SER 108.A OG SER 110.A O no hydrogen 2.825 N/A LYS 109.A N GLU 13.A OE2 no hydrogen 2.975 N/A SER 110.A N GLU 13.A OE1 no hydrogen 2.815 N/A TYR 112.A N SER 110.A OG no hydrogen 3.280 N/A LEU 113.A N SER 110.A O no hydrogen 3.306 N/A VAL 115.A N ASN 104.A OD1 no hydrogen 3.025 N/A LYS 117.A NZ ASP 261.A OD1 no hydrogen 3.519 N/A LYS 117.A NZ GLU 292.A OE2 no hydrogen 3.486 N/A ALA 119.A N ASN 116.A O no hydrogen 3.068 N/A GLU 122.A N ALA 119.A O no hydrogen 3.069 N/A ARG 124.A NH1 ASN 94.A OD1 no hydrogen 3.499 N/A LEU 125.A N LEU 93.A O no hydrogen 2.914 N/A SER 127.A N GLY 91.A O no hydrogen 2.995 N/A SER 127.A OG LEU 125.A O no hydrogen 3.191 N/A VAL 128.A N TYR 144.A O no hydrogen 2.964 N/A ARG 129.A N ARG 89.A O no hydrogen 2.912 N/A ARG 129.A NH1 ASP 131.A OD1 no hydrogen 2.966 N/A ARG 129.A NH2 ASN 94.A O no hydrogen 3.048 N/A ARG 129.A NH2 ASP 99.A OD2 no hydrogen 2.467 N/A TYR 130.A N VAL 142.A O no hydrogen 2.821 N/A TYR 130.A OH PHE 85.A O no hydrogen 2.576 N/A ASP 131.A N LYS 87.A O no hydrogen 2.781 N/A SER 132.A N GLY 140.A O no hydrogen 2.969 N/A SER 132.A OG PRO 133.A O no hydrogen 2.725 N/A PHE 135.A N LEU 138.A O no hydrogen 2.898 N/A LEU 138.A N PHE 135.A O no hydrogen 3.249 N/A SER 139.A N ASN 163.A O no hydrogen 2.973 N/A GLY 140.A N SER 132.A OG no hydrogen 3.124 N/A SER 141.A N GLY 161.A O no hydrogen 2.900 N/A SER 141.A OG ASP 131.A OD1 no hydrogen 2.551 N/A VAL 142.A N TYR 130.A O no hydrogen 3.006 N/A GLN 143.A N HIS 159.A O no hydrogen 2.942 N/A GLN 143.A NE2 ASN 94.A O no hydrogen 2.999 N/A GLN 143.A NE2 SER 127.A OG no hydrogen 2.957 N/A TYR 144.A N VAL 128.A O no hydrogen 2.929 N/A ALA 145.A N SER 157.A O no hydrogen 3.088 N/A ALA 150.A N ASN 147.A O no hydrogen 3.251 N/A SER 155.A N HIS 180.A O no hydrogen 3.093 N/A SER 155.A OG GLU 156.A O no hydrogen 2.777 N/A SER 155.A OG HIS 180.A O no hydrogen 3.554 N/A GLU 156.A N GLU 156.A OE1 no hydrogen 2.630 N/A SER 157.A N ALA 145.A O no hydrogen 3.073 N/A SER 157.A OG HIS 159.A NE2 no hydrogen 2.793 N/A TYR 158.A N TYR 177.A O no hydrogen 2.892 N/A HIS 159.A N GLN 143.A O no hydrogen 2.920 N/A HIS 159.A NE2 SER 157.A OG no hydrogen 2.793 N/A ALA 160.A N GLY 175.A O no hydrogen 3.170 N/A GLY 161.A N SER 141.A O no hydrogen 3.117 N/A PHE 162.A N TYR 173.A O no hydrogen 3.188 N/A ASN 163.A N SER 139.A O no hydrogen 2.758 N/A TYR 164.A N VAL 171.A O no hydrogen 3.017 N/A LYS 165.A N GLY 137.A O no hydrogen 2.854 N/A ASN 166.A N PHE 169.A O no hydrogen 3.084 N/A ASN 166.A ND2 TYR 164.A OH no hydrogen 3.024 N/A PHE 169.A N ASN 166.A O no hydrogen 3.161 N/A PHE 170.A N GLY 200.A O no hydrogen 3.061 N/A VAL 171.A N TYR 164.A O no hydrogen 3.215 N/A GLN 172.A N VAL 198.A O no hydrogen 2.669 N/A TYR 173.A N PHE 162.A O no hydrogen 3.017 N/A TYR 173.A OH HIS 195.A ND1 no hydrogen 2.626 N/A GLY 174.A N ARG 196.A O no hydrogen 3.089 N/A GLY 175.A N ALA 160.A O no hydrogen 2.824 N/A ALA 176.A N ILE 194.A O no hydrogen 2.983 N/A TYR 177.A N TYR 158.A O no hydrogen 2.857 N/A LYS 178.A N TYR 192.A O no hydrogen 2.815 N/A LYS 178.A NZ ASN 154.A OD1 no hydrogen 2.848 N/A LYS 178.A NZ HIS 181.A ND1 no hydrogen 2.891 N/A ARG 179.A NE GLU 156.A OE2 no hydrogen 3.050 N/A ARG 179.A NH2 GLU 156.A OE1 no hydrogen 2.611 N/A ARG 179.A NH2 GLU 156.A OE2 no hydrogen 3.205 N/A HIS 180.A N SER 155.A OG no hydrogen 2.851 N/A HIS 181.A N ILE 189.A O no hydrogen 2.837 N/A GLN 182.A N ASN 154.A OD1 no hydrogen 3.169 N/A VAL 183.A N ASN 188.A OD1 no hydrogen 2.988 N/A GLU 185.A N GLU 185.A OE1 no hydrogen 2.420 N/A ILE 189.A N HIS 181.A O no hydrogen 3.024 N/A GLU 190.A N LYS 218.A O no hydrogen 2.776 N/A LYS 191.A N ARG 179.A O no hydrogen 2.950 N/A TYR 192.A N LYS 178.A O no hydrogen 2.899 N/A TYR 192.A OH GLN 215.A OE1 no hydrogen 2.724 N/A GLN 193.A N ASP 216.A O no hydrogen 2.821 N/A ILE 194.A N ALA 176.A O no hydrogen 3.084 N/A HIS 195.A N GLN 214.A O no hydrogen 2.781 N/A HIS 195.A ND1 TYR 173.A OH no hydrogen 2.626 N/A HIS 195.A NE2 GLN 193.A OE1 no hydrogen 2.970 N/A ARG 196.A N GLY 174.A O no hydrogen 2.956 N/A ARG 196.A NE GLN 213.A OE1 no hydrogen 2.587 N/A ARG 196.A NH1 THR 100.A OG1 no hydrogen 3.297 N/A ARG 196.A NH1 GLU 122.A OE2 no hydrogen 2.909 N/A ARG 196.A NH2 GLU 122.A OE2 no hydrogen 2.863 N/A ARG 196.A NH2 GLN 213.A OE1 no hydrogen 2.705 N/A LEU 197.A N VAL 212.A O no hydrogen 2.970 N/A VAL 198.A N GLN 172.A O no hydrogen 2.865 N/A SER 199.A N VAL 210.A O no hydrogen 2.993 N/A SER 199.A OG PHE 170.A O no hydrogen 3.064 N/A GLY 200.A N PHE 170.A O no hydrogen 3.074 N/A TYR 201.A N ALA 208.A O no hydrogen 2.833 N/A ASP 202.A N GLY 168.A O no hydrogen 2.661 N/A ASN 203.A N LEU 206.A O no hydrogen 3.226 N/A TYR 207.A N ALA 237.A O no hydrogen 2.949 N/A ALA 208.A N TYR 201.A O no hydrogen 2.866 N/A SER 209.A N THR 235.A O no hydrogen 2.996 N/A VAL 210.A N SER 199.A O no hydrogen 2.901 N/A ALA 211.A N ALA 233.A O no hydrogen 2.817 N/A VAL 212.A N LEU 197.A O no hydrogen 2.964 N/A GLN 213.A N GLU 231.A O no hydrogen 2.818 N/A GLN 213.A NE2 ILE 118.A O no hydrogen 2.939 N/A GLN 214.A N HIS 195.A O no hydrogen 2.763 N/A GLN 214.A NE2 ASP 216.A OD1 no hydrogen 2.930 N/A GLN 215.A N GLN 229.A O no hydrogen 3.037 N/A ASP 216.A N GLN 193.A O no hydrogen 2.987 N/A ALA 217.A N ASN 227.A O no hydrogen 2.983 N/A LYS 218.A N GLU 190.A O no hydrogen 2.802 N/A LYS 218.A NZ HIS 226.A ND1 no hydrogen 2.857 N/A LEU 219.A N SER 225.A O no hydrogen 2.827 N/A THR 220.A N ASN 188.A O no hydrogen 2.971 N/A THR 220.A OG1 ASN 188.A O no hydrogen 2.638 N/A SER 223.A N ASP 221.A OD1 no hydrogen 3.055 N/A SER 225.A N ASP 221.A OD1 no hydrogen 3.118 N/A SER 225.A OG ASP 221.A OD1 no hydrogen 3.524 N/A SER 225.A OG ASP 221.A OD2 no hydrogen 2.735 N/A HIS 226.A NE2 ASP 216.A OD2 no hydrogen 2.847 N/A ASN 227.A N ALA 217.A O no hydrogen 2.820 N/A ASN 227.A ND2 HIS 226.A O no hydrogen 2.653 N/A SER 228.A N LEU 256.A O no hydrogen 2.952 N/A GLN 229.A N GLN 215.A O no hydrogen 3.038 N/A THR 230.A OG1 GLN 214.A OE1 no hydrogen 2.555 N/A GLU 231.A N GLN 213.A O no hydrogen 3.075 N/A VAL 232.A N HIS 251.A O no hydrogen 2.995 N/A ALA 233.A N ALA 211.A O no hydrogen 2.925 N/A ALA 234.A N TYR 249.A O no hydrogen 2.799 N/A THR 235.A N SER 209.A O no hydrogen 2.922 N/A LEU 236.A N VAL 247.A O no hydrogen 2.861 N/A ALA 237.A N TYR 207.A O no hydrogen 2.812 N/A TYR 238.A N PRO 245.A O no hydrogen 3.282 N/A PHE 240.A N VAL 243.A O no hydrogen 2.776 N/A VAL 243.A N PHE 240.A O no hydrogen 3.136 N/A THR 244.A N GLU 274.A O no hydrogen 2.960 N/A ARG 246.A N GLY 272.A O no hydrogen 2.954 N/A ARG 246.A NH2 GLU 274.A OE2 no hydrogen 3.170 N/A VAL 247.A N LEU 236.A O no hydrogen 2.914 N/A SER 248.A N VAL 270.A O no hydrogen 2.767 N/A TYR 249.A N ALA 234.A O no hydrogen 2.878 N/A TYR 249.A OH ASP 267.A OD1 no hydrogen 2.497 N/A ALA 250.A N GLN 268.A O no hydrogen 3.007 N/A HIS 251.A N VAL 232.A O no hydrogen 2.893 N/A HIS 251.A ND1 ASP 267.A OD1 no hydrogen 2.736 N/A GLY 252.A N TYR 266.A O no hydrogen 2.883 N/A PHE 253.A N THR 230.A O no hydrogen 2.962 N/A VAL 257.A N GLY 255.A O no hydrogen 3.106 N/A ALA 258.A N ASN 227.A OD1 no hydrogen 3.079 N/A TYR 266.A N GLY 252.A O no hydrogen 3.006 N/A TYR 266.A OH GLU 231.A OE2 no hydrogen 2.728 N/A ASP 267.A N GLN 291.A O no hydrogen 3.036 N/A GLN 268.A N ALA 250.A O no hydrogen 2.972 N/A GLN 268.A NE2 GLY 114.A O no hydrogen 3.077 N/A VAL 269.A N TRP 289.A O no hydrogen 3.041 N/A VAL 270.A N SER 248.A O no hydrogen 2.912 N/A VAL 271.A N ALA 287.A O no hydrogen 2.809 N/A GLY 272.A N ARG 246.A O no hydrogen 3.154 N/A ALA 273.A N VAL 285.A O no hydrogen 2.988 N/A GLU 274.A N THR 244.A O no hydrogen 3.128 N/A TYR 275.A N ALA 283.A O no hydrogen 2.829 N/A ASP 276.A N ASN 242.A O no hydrogen 3.011 N/A PHE 277.A N THR 281.A O no hydrogen 2.876 N/A SER 278.A N THR 281.A O no hydrogen 3.394 N/A ARG 280.A N SER 278.A OG no hydrogen 2.990 N/A ARG 280.A NE LYS 311.A O no hydrogen 2.996 N/A THR 281.A N SER 278.A OG no hydrogen 2.955 N/A THR 281.A OG1 HIS 310.A ND1 no hydrogen 2.888 N/A SER 282.A N ARG 309.A O no hydrogen 2.898 N/A SER 282.A OG ASP 276.A OD1 no hydrogen 2.657 N/A ALA 283.A N TYR 275.A O no hydrogen 2.773 N/A LEU 284.A N GLY 307.A O no hydrogen 2.852 N/A VAL 285.A N ALA 273.A O no hydrogen 3.103 N/A SER 286.A N GLY 305.A O no hydrogen 2.955 N/A ALA 287.A N VAL 271.A O no hydrogen 2.697 N/A GLY 288.A N ALA 303.A O no hydrogen 2.899 N/A TRP 289.A N VAL 269.A O no hydrogen 2.953 N/A LEU 290.A N ALA 301.A O no hydrogen 2.899 N/A GLN 291.A N ASP 267.A O no hydrogen 2.919 N/A GLU 292.A N PHE 299.A O no hydrogen 2.948 N/A VAL 300.A N VAL 18.A O no hydrogen 2.825 N/A ALA 301.A N LEU 290.A O no hydrogen 2.878 N/A THR 302.A N ARG 16.A O no hydrogen 3.017 N/A ALA 303.A N GLY 288.A O no hydrogen 3.028 N/A GLY 304.A N THR 14.A O no hydrogen 2.928 N/A GLY 305.A N SER 286.A O no hydrogen 3.006 N/A VAL 306.A N VAL 12.A O no hydrogen 3.160 N/A GLY 307.A N LEU 284.A O no hydrogen 2.845 N/A LEU 308.A N ALA 10.A O no hydrogen 2.805 N/A ARG 309.A N SER 282.A O no hydrogen 2.831 N/A ARG 309.A NH1 ASP 107.A OD2 no hydrogen 3.021 N/A ARG 309.A NH1 GLU 274.A OE1 no hydrogen 3.172 N/A ARG 309.A NH1 GLU 274.A OE2 no hydrogen 3.039 N/A ARG 309.A NH2 GLU 274.A OE1 no hydrogen 2.585 N/A ARG 309.A NH2 SER 282.A OG no hydrogen 3.271 N/A HIS 310.A N ILE 8.A O no hydrogen 2.735 N/A HIS 310.A ND1 THR 281.A OG1 no hydrogen 2.888 N/A LYS 311.A N ARG 280.A O no hydrogen 2.906 N/A PHE 312.A N GLY 6.A O no hydrogen 2.976 N/A