Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wdx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A OH GLU 192.A OE2 no hydrogen 2.447 N/A HIS 4.A N ALA 297.A O no hydrogen 3.034 N/A VAL 6.A N VAL 295.A O no hydrogen 2.893 N/A ASP 7.A N VAL 295.A O no hydrogen 3.122 N/A TYR 9.A N LEU 293.A O no hydrogen 2.933 N/A TYR 9.A OH TYR 79.A OH no hydrogen 2.573 N/A GLY 10.A N ASP 8.A OD1 no hydrogen 2.856 N/A GLY 12.A N THR 53.A OG1 no hydrogen 2.945 N/A GLY 14.A N ARG 11.A O no hydrogen 3.239 N/A PHE 15.A N ARG 11.A O no hydrogen 3.292 N/A PHE 16.A N GLY 12.A O no hydrogen 2.833 N/A ASP 17.A N ASN 13.A O no hydrogen 2.923 N/A LYS 18.A N PHE 15.A O no hydrogen 2.977 N/A LYS 18.A NZ ASP 7.A OD1 no hydrogen 2.811 N/A PHE 19.A N PHE 16.A O no hydrogen 3.076 N/A ASN 20.A N GLU 74.A O no hydrogen 2.824 N/A PHE 22.A N ARG 72.A O no hydrogen 2.856 N/A THR 28.A N ASP 26.A OD1 no hydrogen 3.183 N/A THR 28.A OG1 ASP 26.A OD1 no hydrogen 2.963 N/A THR 28.A OG1 ASP 26.A OD2 no hydrogen 2.639 N/A HIS 29.A N ASP 26.A O no hydrogen 2.889 N/A HIS 29.A ND1 ASP 254.A OD1 no hydrogen 3.005 N/A GLY 30.A N ASP 26.A OD2 no hydrogen 2.828 N/A TYR 31.A N PHE 251.A O no hydrogen 2.892 N/A ASP 33.A N ARG 68.A O no hydrogen 2.851 N/A VAL 35.A N SER 70.A O no hydrogen 3.076 N/A ARG 37.A NH1 ASP 17.A OD1 no hydrogen 2.638 N/A ARG 37.A NH2 ASN 13.A O no hydrogen 3.241 N/A ARG 37.A NH2 ASN 13.A OD1 no hydrogen 3.068 N/A ARG 37.A NH2 ASP 17.A OD1 no hydrogen 3.049 N/A VAL 39.A N SER 36.A OG no hydrogen 3.215 N/A ALA 40.A N SER 36.A O no hydrogen 2.816 N/A ALA 41.A N ARG 37.A O no hydrogen 2.878 N/A GLY 42.A N ASP 38.A O no hydrogen 3.036 N/A ALA 43.A N ALA 40.A O no hydrogen 3.062 N/A GLY 44.A N ALA 41.A O no hydrogen 3.220 N/A LEU 45.A N ALA 40.A O no hydrogen 2.861 N/A GLY 47.A N TYR 54.A O no hydrogen 3.208 N/A ARG 49.A N ARG 52.A O no hydrogen 2.723 N/A ARG 49.A NH1 GLU 48.A O no hydrogen 3.028 N/A ARG 52.A N ARG 49.A O no hydrogen 2.927 N/A THR 53.A N VAL 290.A O no hydrogen 3.013 N/A TYR 54.A N GLY 47.A O no hydrogen 2.843 N/A MET 55.A N TRP 288.A O no hydrogen 3.087 N/A GLY 56.A N LEU 45.A O no hydrogen 2.768 N/A ASP 58.A N ARG 69.A O no hydrogen 3.042 N/A THR 60.A N ASP 58.A OD1 no hydrogen 2.837 N/A ASN 61.A N ASP 58.A OD1 no hydrogen 2.872 N/A ALA 63.A N ARG 277.A O no hydrogen 2.987 N/A ARG 66.A NE ASP 33.A OD1 no hydrogen 3.210 N/A ARG 66.A NH1 THR 23.A O no hydrogen 3.040 N/A ARG 66.A NH1 ASP 25.A OD1 no hydrogen 3.002 N/A ARG 66.A NH2 THR 23.A O no hydrogen 3.052 N/A ARG 66.A NH2 ASP 33.A OD1 no hydrogen 2.937 N/A GLY 67.A N SER 64.A O no hydrogen 3.315 N/A ARG 68.A N TYR 31.A O no hydrogen 3.109 N/A ARG 68.A NE VAL 276.A O no hydrogen 2.865 N/A ARG 68.A NH1 ASP 58.A O no hydrogen 2.770 N/A ARG 68.A NH1 ASN 61.A O no hydrogen 2.814 N/A ARG 68.A NH2 ASN 61.A O no hydrogen 2.926 N/A ARG 68.A NH2 VAL 276.A O no hydrogen 2.877 N/A ARG 69.A NE ASP 58.A OD2 no hydrogen 3.081 N/A ARG 69.A NH2 ASP 58.A OD2 no hydrogen 3.099 N/A SER 70.A N ASP 33.A O no hydrogen 3.106 N/A SER 70.A OG VAL 249.A O no hydrogen 2.696 N/A ARG 72.A NE GLU 74.A OE1 no hydrogen 2.799 N/A ARG 72.A NH2 GLU 74.A OE1 no hydrogen 2.983 N/A LEU 73.A N PHE 247.A O no hydrogen 2.937 N/A GLU 74.A N ASN 20.A O no hydrogen 2.975 N/A SER 75.A N LEU 245.A O no hydrogen 2.762 N/A SER 75.A OG ASN 77.A O no hydrogen 2.691 N/A LYS 76.A N LYS 18.A O no hydrogen 2.995 N/A LYS 76.A NZ ASP 17.A O no hydrogen 2.816 N/A TYR 79.A N GLN 243.A O no hydrogen 2.806 N/A TYR 79.A OH TYR 9.A OH no hydrogen 2.573 N/A HIS 81.A NE2 GLU 237.A OE2 no hydrogen 3.026 N/A GLY 82.A N ILE 193.A O no hydrogen 3.081 N/A LEU 83.A N TYR 296.A O no hydrogen 2.952 N/A ILE 84.A N THR 191.A O no hydrogen 2.693 N/A VAL 85.A N ARG 294.A O no hydrogen 2.884 N/A ILE 86.A N TYR 189.A O no hydrogen 2.961 N/A ASP 87.A N SER 292.A O no hydrogen 2.854 N/A LEU 88.A N GLY 187.A O no hydrogen 2.898 N/A ALA 89.A N LEU 289.A O no hydrogen 2.839 N/A HIS 90.A ND1 TYR 287.A O no hydrogen 2.936 N/A HIS 90.A NE2 GLU 285.A OE1 no hydrogen 2.810 N/A MET 91.A N ASN 182.A OD1 no hydrogen 2.784 N/A GLY 93.A N GLU 285.A O no hydrogen 2.903 N/A SER 94.A OG ASN 125.A O no hydrogen 2.985 N/A GLY 97.A N ASN 123.A OD1 no hydrogen 2.717 N/A THR 98.A N VAL 95.A O no hydrogen 3.087 N/A THR 98.A OG1 VAL 95.A O no hydrogen 2.763 N/A TRP 99.A N THR 250.A O no hydrogen 2.882 N/A TRP 99.A NE1 GLU 120.A OE2 no hydrogen 2.954 N/A ALA 101.A N ASP 248.A O no hydrogen 2.923 N/A PHE 102.A N ILE 119.A O no hydrogen 2.848 N/A TRP 103.A N ILE 246.A O no hydrogen 2.919 N/A TRP 103.A NE1 ASP 248.A OD2 no hydrogen 2.931 N/A THR 104.A N ILE 116.A O no hydrogen 2.851 N/A THR 104.A OG1 GLN 243.A OE1 no hydrogen 2.695 N/A LEU 105.A N ARG 244.A O no hydrogen 2.973 N/A GLY 106.A N GLY 114.A O no hydrogen 2.948 N/A THR 107.A N ASN 241.A OD1 no hydrogen 2.871 N/A TYR 112.A N ASP 109.A O no hydrogen 2.983 N/A GLY 114.A N PRO 111.A O no hydrogen 2.986 N/A ALA 115.A N HIS 133.A O no hydrogen 2.973 N/A ILE 116.A N THR 104.A O no hydrogen 2.883 N/A ASP 117.A N VAL 131.A O no hydrogen 2.725 N/A ILE 118.A N PHE 102.A O no hydrogen 3.130 N/A ILE 119.A N PHE 102.A O no hydrogen 3.054 N/A GLU 120.A N ASN 128.A OD1 no hydrogen 2.969 N/A ASN 123.A N THR 98.A O no hydrogen 2.874 N/A ASN 123.A ND2 ALA 256.A O no hydrogen 3.311 N/A ASN 125.A N VAL 122.A O no hydrogen 2.987 N/A ASN 128.A N SER 176.A OG no hydrogen 2.914 N/A ASN 128.A ND2 ILE 118.A O no hydrogen 2.926 N/A HIS 129.A N GLU 120.A O no hydrogen 3.313 N/A HIS 129.A ND1 PHE 127.A O no hydrogen 3.264 N/A MET 130.A N ILE 169.A O no hydrogen 2.908 N/A VAL 131.A N ASP 117.A O no hydrogen 3.162 N/A LEU 132.A N CYS 167.A O no hydrogen 3.157 N/A HIS 133.A N ALA 115.A O no hydrogen 3.080 N/A HIS 133.A ND1 ASN 164.A OD1 no hydrogen 2.646 N/A THR 134.A N CYS 154.A O no hydrogen 2.953 N/A THR 134.A OG1 SER 135.A O no hydrogen 2.835 N/A THR 139.A N GLY 233.A O no hydrogen 3.047 N/A ILE 140.A N SER 152.A O no hydrogen 2.944 N/A ASP 141.A N ALA 230.A O no hydrogen 2.903 N/A THR 146.A N PRO 225.A O no hydrogen 2.959 N/A GLY 147.A N ALA 226.A O no hydrogen 2.895 N/A ASN 148.A N GLU 170.A O no hydrogen 2.833 N/A LYS 150.A N GLY 168.A O no hydrogen 2.790 N/A THR 151.A N GLY 168.A O no hydrogen 3.278 N/A THR 151.A OG1 GLY 166.A O no hydrogen 2.660 N/A CYS 154.A N CYS 138.A O no hydrogen 2.853 N/A CYS 154.A SG CYS 138.A O no hydrogen 3.650 N/A TYR 155.A N ASN 153.A OD1 no hydrogen 2.988 N/A VAL 156.A N THR 134.A O no hydrogen 3.128 N/A ALA 158.A N TYR 155.A O no hydrogen 3.036 N/A GLN 161.A N ALA 158.A O no hydrogen 3.056 N/A ASN 164.A N VAL 156.A O no hydrogen 2.695 N/A ALA 165.A N ASP 162.A O no hydrogen 3.050 N/A CYS 167.A N LEU 132.A O no hydrogen 3.093 N/A CYS 167.A SG LEU 132.A O no hydrogen 3.734 N/A CYS 167.A SG CYS 167.A O no hydrogen 2.921 N/A GLY 168.A N THR 151.A OG1 no hydrogen 2.825 N/A ILE 169.A N MET 130.A O no hydrogen 2.743 N/A GLU 170.A N ASN 148.A O no hydrogen 2.925 N/A ALA 171.A N ASN 128.A O no hydrogen 2.948 N/A ASN 175.A N ASP 173.A OD1 no hydrogen 2.728 N/A SER 176.A N ASP 173.A O no hydrogen 2.958 N/A SER 176.A OG ASP 173.A O no hydrogen 2.747 N/A LYS 179.A N SER 94.A OG no hydrogen 2.913 N/A PHE 181.A N TYR 177.A O no hydrogen 3.366 N/A ASN 182.A N GLY 178.A O no hydrogen 2.861 N/A ASN 182.A ND2 MET 91.A O no hydrogen 2.884 N/A SER 183.A N LYS 179.A O no hydrogen 2.904 N/A SER 183.A OG GLY 180.A O no hydrogen 2.627 N/A ILE 184.A N GLY 180.A O no hydrogen 3.312 N/A GLY 185.A N ASN 182.A O no hydrogen 2.999 N/A GLY 186.A N PHE 181.A O no hydrogen 2.787 N/A GLY 187.A N LEU 88.A O no hydrogen 2.979 N/A ILE 188.A N PHE 203.A O no hydrogen 2.930 N/A TYR 189.A N ILE 86.A O no hydrogen 2.982 N/A TYR 189.A OH SER 176.A O no hydrogen 2.663 N/A ALA 190.A N TRP 201.A O no hydrogen 3.010 N/A THR 191.A N ILE 84.A O no hydrogen 2.733 N/A GLU 192.A N SER 199.A O no hydrogen 2.832 N/A ILE 193.A N GLY 82.A O no hydrogen 2.866 N/A THR 194.A N GLY 197.A O no hydrogen 2.964 N/A THR 194.A OG1 GLY 197.A O no hydrogen 3.230 N/A ASN 196.A N THR 194.A OG1 no hydrogen 2.962 N/A GLY 197.A N THR 194.A O no hydrogen 3.232 N/A ILE 198.A N PHE 229.A O no hydrogen 2.982 N/A SER 199.A N GLU 192.A O no hydrogen 3.006 N/A ILE 200.A N ALA 227.A O no hydrogen 2.853 N/A TRP 201.A N ALA 190.A O no hydrogen 2.847 N/A TRP 201.A NE1 ASP 223.A O no hydrogen 2.871 N/A PHE 203.A N ILE 188.A O no hydrogen 2.824 N/A ARG 205.A N GLY 186.A O no hydrogen 2.915 N/A ARG 205.A NE GLY 185.A O no hydrogen 2.935 N/A ARG 205.A NH1 ASP 87.A OD1 no hydrogen 3.126 N/A ARG 205.A NH2 ASP 87.A OD1 no hydrogen 2.951 N/A ARG 205.A NH2 GLY 185.A O no hydrogen 3.130 N/A SER 207.A N PRO 204.A O no hydrogen 2.907 N/A SER 207.A OG PRO 204.A O no hydrogen 2.705 N/A GLU 208.A N GLU 208.A OE1 no hydrogen 2.665 N/A VAL 212.A N PRO 209.A O no hydrogen 3.414 N/A GLY 214.A N ASP 211.A O no hydrogen 3.154 N/A ASN 216.A ND2 TYR 3.A O no hydrogen 2.916 N/A ASN 218.A N ASP 211.A OD2 no hydrogen 2.788 N/A ALA 220.A N ASN 218.A OD1 no hydrogen 3.190 N/A ASN 221.A N ASN 218.A O no hydrogen 3.120 N/A TRP 222.A N PRO 219.A O no hydrogen 2.918 N/A TRP 222.A NE1 ASP 211.A OD1 no hydrogen 3.024 N/A ALA 226.A N ILE 200.A O no hydrogen 2.751 N/A ALA 227.A N ILE 200.A O no hydrogen 3.125 N/A PHE 229.A N ILE 198.A O no hydrogen 2.725 N/A TRP 236.A NE1 GLY 231.A O no hydrogen 3.047 N/A GLY 238.A N ASP 235.A OD1 no hydrogen 3.051 N/A LYS 239.A N ASP 235.A O no hydrogen 2.902 N/A LYS 239.A NZ SER 135.A OG no hydrogen 3.028 N/A LYS 239.A NZ ASP 136.A O no hydrogen 2.747 N/A ASN 241.A N GLY 113.A O no hydrogen 3.299 N/A ASN 241.A ND2 THR 107.A O no hydrogen 2.886 N/A GLN 243.A N TYR 79.A O no hydrogen 2.832 N/A GLN 243.A NE2 GLY 113.A O no hydrogen 2.914 N/A GLN 243.A NE2 ASN 241.A O no hydrogen 2.906 N/A ARG 244.A N LEU 105.A O no hydrogen 2.917 N/A ARG 244.A NE GLU 74.A OE2 no hydrogen 2.982 N/A ARG 244.A NH1 GLY 106.A O no hydrogen 3.497 N/A ARG 244.A NH2 GLU 74.A OE2 no hydrogen 3.358 N/A LEU 245.A N SER 75.A OG no hydrogen 2.733 N/A ILE 246.A N TRP 103.A O no hydrogen 2.660 N/A PHE 247.A N LEU 73.A O no hydrogen 2.958 N/A ASP 248.A N ALA 101.A O no hydrogen 3.043 N/A THR 250.A N TRP 99.A O no hydrogen 3.050 N/A THR 250.A OG1 ASP 26.A OD2 no hydrogen 2.772 N/A CYS 252.A N GLY 97.A O no hydrogen 2.886 N/A ASP 254.A N THR 28.A O no hydrogen 2.958 N/A VAL 259.A N TRP 255.A O no hydrogen 3.103 N/A TRP 260.A NE1 ALA 269.A O no hydrogen 3.185 N/A ILE 262.A N VAL 259.A O no hydrogen 3.091 N/A GLY 263.A N VAL 259.A O no hydrogen 3.333 N/A ALA 266.A N GLY 263.A O no hydrogen 3.363 N/A ARG 268.A N CYS 265.A O no hydrogen 2.879 N/A CYS 272.A SG GLY 97.A O no hydrogen 3.906 N/A ASP 274.A N ASN 271.A OD1 no hydrogen 2.940 N/A PHE 275.A N ASN 271.A O no hydrogen 3.303 N/A VAL 276.A N CYS 272.A O no hydrogen 2.992 N/A ARG 277.A N VAL 273.A O no hydrogen 2.885 N/A ARG 277.A NE ASP 278.A OD1 no hydrogen 2.895 N/A ARG 277.A NH1 ASP 274.A OD1 no hydrogen 3.162 N/A ARG 277.A NH2 ASP 274.A OD1 no hydrogen 3.149 N/A ARG 277.A NH2 ASP 278.A OD2 no hydrogen 3.022 N/A ASP 278.A N ASP 274.A O no hydrogen 3.079 N/A ASN 279.A N PHE 275.A O no hydrogen 3.024 N/A ASN 279.A ND2 PHE 275.A O no hydrogen 2.828 N/A ALA 282.A N ASN 279.A O no hydrogen 3.080 N/A PHE 283.A N PRO 280.A O no hydrogen 3.067 N/A SER 286.A N PHE 283.A O no hydrogen 3.063 N/A TYR 287.A N GLU 285.A O no hydrogen 2.945 N/A TRP 288.A N MET 55.A O no hydrogen 2.693 N/A LEU 289.A N HIS 90.A O no hydrogen 2.864 N/A VAL 290.A N THR 53.A O no hydrogen 2.829 N/A ASN 291.A N ASP 87.A O no hydrogen 2.741 N/A ASN 291.A ND2 ASP 87.A OD1 no hydrogen 2.950 N/A SER 292.A N ASP 87.A O no hydrogen 3.311 N/A ARG 294.A N VAL 85.A O no hydrogen 2.963 N/A ARG 294.A NE ASP 8.A OD2 no hydrogen 2.753 N/A VAL 295.A N ASP 7.A O no hydrogen 2.811 N/A TYR 296.A N LEU 83.A O no hydrogen 2.801 N/A TYR 296.A OH GLY 214.A O no hydrogen 2.761 N/A ALA 297.A N HIS 4.A O no hydrogen 2.961 N/A