Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4j78_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 3.A N LEU 299.A O no hydrogen 2.777 N/A LYS 5.A N SER 298.A O no hydrogen 2.892 N/A LYS 6.A NZ THR 295.A OG1 no hydrogen 2.648 N/A THR 7.A N VAL 296.A O no hydrogen 2.866 N/A PHE 8.A N VAL 296.A O no hydrogen 3.223 N/A SER 9.A OG PHE 294.A O no hydrogen 2.711 N/A ASN 10.A N PHE 294.A O no hydrogen 3.202 N/A SER 12.A N ASN 292.A O no hydrogen 3.002 N/A SER 12.A OG ASP 13.A O no hydrogen 2.825 N/A ARG 14.A NE ASP 291.A OD1 no hydrogen 2.883 N/A VAL 15.A N PHE 290.A O no hydrogen 2.924 N/A LYS 16.A N THR 30.A O no hydrogen 2.860 N/A GLY 17.A N THR 30.A O no hydrogen 3.299 N/A ASP 19.A N LEU 28.A O no hydrogen 3.060 N/A HIS 21.A N TRP 26.A O no hydrogen 3.042 N/A HIS 21.A NE2 TYR 83.A OH no hydrogen 2.783 N/A THR 23.A N HIS 21.A ND1 no hydrogen 3.191 N/A GLU 24.A N HIS 21.A ND1 no hydrogen 3.131 N/A TRP 26.A N GLU 24.A O no hydrogen 2.708 N/A VAL 27.A N TRP 39.A O no hydrogen 2.900 N/A LEU 28.A N ASP 19.A O no hydrogen 2.855 N/A THR 29.A N GLU 37.A O no hydrogen 2.796 N/A THR 29.A OG1 GLU 37.A O no hydrogen 3.526 N/A THR 30.A N GLY 17.A O no hydrogen 2.919 N/A THR 30.A OG1 VAL 57.A O no hydrogen 2.884 N/A LEU 31.A N ARG 35.A O no hydrogen 2.848 N/A TYR 32.A N ARG 14.A O no hydrogen 2.804 N/A GLY 34.A N LEU 31.A O no hydrogen 3.122 N/A ARG 35.A NE GLU 37.A OE1 no hydrogen 2.715 N/A ARG 35.A NH1 GLU 37.A OE1 no hydrogen 3.361 N/A ARG 35.A NH1 SER 49.A OG no hydrogen 2.902 N/A VAL 36.A N ILE 50.A O no hydrogen 2.909 N/A GLU 37.A N THR 29.A O no hydrogen 2.926 N/A ILE 38.A N ARG 48.A O no hydrogen 2.819 N/A TRP 39.A N VAL 27.A O no hydrogen 2.840 N/A TRP 39.A NE1 GLU 37.A OE2 no hydrogen 2.840 N/A ASN 40.A N VAL 45.A O no hydrogen 2.943 N/A TYR 41.A N PRO 25.A O no hydrogen 3.033 N/A GLU 42.A N ASN 40.A OD1 no hydrogen 2.910 N/A THR 43.A N ASN 40.A OD1 no hydrogen 2.938 N/A GLN 44.A N ASN 40.A O no hydrogen 2.727 N/A GLN 44.A NE2 THR 7.A O no hydrogen 3.242 N/A VAL 45.A N ASN 40.A O no hydrogen 3.373 N/A VAL 47.A N ILE 38.A O no hydrogen 2.784 N/A ARG 48.A N ILE 38.A O no hydrogen 3.493 N/A ARG 48.A NE TYR 83.A O no hydrogen 2.899 N/A ILE 50.A N VAL 36.A O no hydrogen 2.954 N/A GLN 51.A NE2 SER 33.A O no hydrogen 3.054 N/A GLN 51.A NE2 THR 53.A O no hydrogen 2.878 N/A VAL 52.A N GLY 34.A O no hydrogen 2.916 N/A THR 53.A N GLY 34.A O no hydrogen 3.270 N/A THR 53.A OG1 THR 55.A OG1 no hydrogen 3.158 N/A THR 53.A OG1 ASP 75.A OD2 no hydrogen 3.022 N/A THR 55.A N THR 53.A OG1 no hydrogen 3.291 N/A THR 55.A OG1 THR 53.A OG1 no hydrogen 3.158 N/A VAL 57.A N LEU 31.A O no hydrogen 3.069 N/A ARG 58.A NE ASP 74.A OD1 no hydrogen 2.807 N/A ARG 58.A NE ASP 74.A OD2 no hydrogen 3.293 N/A ARG 58.A NH2 ASP 74.A OD2 no hydrogen 2.917 N/A ALA 59.A N GLY 72.A O no hydrogen 3.449 N/A LYS 61.A N ILE 70.A O no hydrogen 3.004 N/A LYS 61.A NZ ILE 102.A O no hydrogen 2.845 N/A PHE 62.A N ASP 19.A OD2 no hydrogen 2.849 N/A ILE 63.A N TRP 68.A O no hydrogen 2.902 N/A ARG 65.A NH1 HIS 105.A O no hydrogen 3.496 N/A ARG 65.A NH2 HIS 105.A O no hydrogen 2.909 N/A LYS 66.A N ILE 63.A O no hydrogen 3.126 N/A ASN 67.A N ALA 64.A O no hydrogen 3.024 N/A TRP 68.A N ILE 63.A O no hydrogen 3.085 N/A ILE 69.A N PHE 81.A O no hydrogen 2.863 N/A ILE 70.A N LYS 61.A O no hydrogen 2.995 N/A VAL 71.A N ARG 79.A O no hydrogen 2.839 N/A GLY 72.A N ALA 59.A O no hydrogen 2.969 N/A SER 73.A N ARG 77.A O no hydrogen 3.181 N/A SER 73.A OG ASP 75.A OD1 no hydrogen 2.665 N/A SER 73.A OG ARG 77.A O no hydrogen 3.570 N/A ASP 74.A N PRO 56.A O no hydrogen 2.881 N/A PHE 76.A N SER 73.A O no hydrogen 3.060 N/A ARG 77.A N ASP 75.A OD1 no hydrogen 3.179 N/A ARG 77.A NE ASP 91.A OD2 no hydrogen 2.691 N/A ARG 77.A NH2 ASP 91.A O no hydrogen 3.262 N/A ARG 77.A NH2 ASP 91.A OD2 no hydrogen 3.070 N/A ILE 78.A N PHE 92.A O no hydrogen 2.942 N/A ARG 79.A N VAL 71.A O no hydrogen 2.965 N/A ARG 79.A NE ASP 91.A OD1 no hydrogen 2.931 N/A ARG 79.A NH1 ASP 75.A OD2 no hydrogen 3.072 N/A ARG 79.A NH2 ASP 75.A OD2 no hydrogen 3.120 N/A VAL 80.A N VAL 90.A O no hydrogen 3.034 N/A PHE 81.A N ILE 69.A O no hydrogen 2.986 N/A ASN 82.A N GLU 87.A O no hydrogen 2.877 N/A TYR 83.A N ASN 67.A O no hydrogen 3.093 N/A TYR 83.A OH ASN 67.A OD1 no hydrogen 2.828 N/A ASN 84.A N ASN 82.A OD1 no hydrogen 2.752 N/A THR 85.A N ASN 82.A OD1 no hydrogen 2.983 N/A GLY 86.A N ASN 82.A O no hydrogen 2.733 N/A GLU 87.A N THR 85.A OG1 no hydrogen 3.127 N/A LYS 88.A NZ ASP 91.A OD1 no hydrogen 2.854 N/A VAL 89.A N VAL 80.A O no hydrogen 2.753 N/A PHE 92.A N ILE 78.A O no hydrogen 3.071 N/A ALA 94.A N PHE 76.A O no hydrogen 2.982 N/A HIS 95.A ND1 ASP 117.A OD2 no hydrogen 2.772 N/A HIS 95.A NE2 SER 113.A OG no hydrogen 2.738 N/A TYR 98.A N ASP 97.A OD2 no hydrogen 2.781 N/A ARG 100.A N GLY 114.A O no hydrogen 2.841 N/A ARG 100.A NE ASP 116.A OD1 no hydrogen 2.681 N/A ARG 100.A NH2 ASP 116.A OD1 no hydrogen 3.485 N/A ARG 100.A NH2 ASP 116.A OD2 no hydrogen 2.900 N/A ALA 103.A N LEU 112.A O no hydrogen 2.956 N/A HIS 105.A N TYR 110.A O no hydrogen 2.967 N/A THR 107.A N HIS 105.A ND1 no hydrogen 3.179 N/A LYS 108.A N HIS 105.A ND1 no hydrogen 3.030 N/A TYR 110.A N LYS 108.A O no hydrogen 2.812 N/A VAL 111.A N TRP 123.A O no hydrogen 2.956 N/A LEU 112.A N ALA 103.A O no hydrogen 2.822 N/A SER 113.A N LYS 121.A O no hydrogen 2.923 N/A SER 113.A OG HIS 95.A NE2 no hydrogen 2.738 N/A GLY 114.A N SER 101.A O no hydrogen 2.912 N/A SER 115.A N THR 119.A O no hydrogen 3.133 N/A SER 115.A OG TYR 98.A O no hydrogen 2.814 N/A ASP 116.A N TYR 98.A O no hydrogen 3.006 N/A ASP 117.A N SER 115.A OG no hydrogen 3.021 N/A LEU 118.A N SER 115.A O no hydrogen 3.207 N/A THR 119.A N ASP 117.A OD1 no hydrogen 2.886 N/A THR 119.A OG1 ASP 117.A OD1 no hydrogen 2.811 N/A THR 119.A OG1 ASP 117.A OD2 no hydrogen 3.265 N/A VAL 120.A N PHE 135.A O no hydrogen 3.270 N/A LYS 121.A N SER 113.A O no hydrogen 2.916 N/A LYS 121.A NZ THR 134.A OG1 no hydrogen 3.060 N/A LEU 122.A N GLN 133.A O no hydrogen 2.906 N/A TRP 123.A N VAL 111.A O no hydrogen 2.876 N/A TRP 123.A NE1 SER 113.A OG no hydrogen 2.939 N/A ASN 124.A N ALA 130.A O no hydrogen 3.122 N/A ASN 124.A ND2 GLU 132.A OE1 no hydrogen 3.327 N/A TRP 125.A N PRO 109.A O no hydrogen 3.044 N/A GLU 126.A N ASN 124.A OD1 no hydrogen 2.792 N/A ASN 127.A N ASN 124.A O no hydrogen 3.049 N/A ASN 127.A ND2 GLU 132.A OE2 no hydrogen 3.087 N/A ALA 130.A N ASN 127.A O no hydrogen 3.015 N/A GLU 132.A N LEU 122.A O no hydrogen 2.854 N/A GLN 133.A NE2 GLN 171.A O no hydrogen 2.893 N/A PHE 135.A N VAL 120.A O no hydrogen 2.757 N/A HIS 138.A ND1 ASP 161.A OD2 no hydrogen 2.952 N/A HIS 138.A NE2 SER 157.A OG no hydrogen 2.678 N/A GLU 139.A N ASP 161.A OD2 no hydrogen 2.933 N/A PHE 141.A N HIS 140.A ND1 no hydrogen 2.810 N/A VAL 142.A N SER 115.A O no hydrogen 3.032 N/A MET 143.A N GLY 158.A O no hydrogen 2.873 N/A CYS 144.A SG VAL 189.A O no hydrogen 3.484 N/A VAL 145.A N SER 101.A OG no hydrogen 3.004 N/A ALA 146.A N ALA 156.A O no hydrogen 2.952 N/A ASN 148.A N THR 154.A O no hydrogen 3.079 N/A ASN 148.A ND2 TYR 214.A OH no hydrogen 3.287 N/A LYS 150.A N ASN 148.A OD1 no hydrogen 2.865 N/A LYS 150.A NZ TYR 192.A O no hydrogen 3.443 N/A LYS 150.A NZ LEU 194.A O no hydrogen 2.905 N/A ASP 151.A N ASN 148.A O no hydrogen 3.015 N/A SER 153.A N ASP 151.A OD1 no hydrogen 3.334 N/A SER 153.A OG ASP 151.A OD1 no hydrogen 2.652 N/A SER 153.A OG ASP 151.A OD2 no hydrogen 3.556 N/A THR 154.A N ASP 151.A O no hydrogen 2.949 N/A THR 154.A OG1 ASP 151.A O no hydrogen 2.873 N/A PHE 155.A N TRP 167.A O no hydrogen 3.088 N/A ALA 156.A N ALA 146.A O no hydrogen 2.826 N/A SER 157.A N LYS 165.A O no hydrogen 2.857 N/A SER 157.A OG HIS 138.A NE2 no hydrogen 2.678 N/A SER 157.A OG LYS 165.A O no hydrogen 3.394 N/A GLY 158.A N CYS 144.A O no hydrogen 2.844 N/A CYS 159.A N THR 163.A O no hydrogen 3.108 N/A CYS 159.A SG HIS 140.A O no hydrogen 3.152 N/A CYS 159.A SG PHE 141.A O no hydrogen 3.321 N/A LEU 160.A N PHE 141.A O no hydrogen 3.015 N/A ARG 162.A N CYS 159.A O no hydrogen 3.096 N/A ARG 162.A NE ASP 161.A O no hydrogen 3.261 N/A ARG 162.A NH1 GLU 183.A OE1 no hydrogen 2.967 N/A THR 163.A N ASP 161.A OD1 no hydrogen 3.031 N/A THR 163.A OG1 ASP 161.A OD1 no hydrogen 2.794 N/A VAL 164.A N LEU 178.A O no hydrogen 3.143 N/A LYS 165.A N SER 157.A O no hydrogen 2.968 N/A LYS 165.A NZ THR 177.A OG1 no hydrogen 2.912 N/A VAL 166.A N PHE 176.A O no hydrogen 3.031 N/A TRP 167.A N PHE 155.A O no hydrogen 2.851 N/A TRP 167.A NE1 SER 157.A OG no hydrogen 2.875 N/A LEU 169.A N SER 153.A O no hydrogen 2.906 N/A GLY 170.A N GLN 133.A OE1 no hydrogen 2.881 N/A GLN 171.A N SER 168.A O no hydrogen 3.015 N/A ASN 175.A N VAL 166.A O no hydrogen 2.684 N/A ASN 175.A ND2 SER 168.A OG no hydrogen 2.897 N/A PHE 176.A N VAL 166.A O no hydrogen 3.479 N/A LEU 178.A N VAL 164.A O no hydrogen 2.724 N/A THR 180.A N ARG 162.A O no hydrogen 3.349 N/A THR 180.A OG1 ARG 162.A O no hydrogen 2.827 N/A GLN 182.A N THR 180.A OG1 no hydrogen 3.014 N/A GLN 182.A NE2 THR 202.A O no hydrogen 3.499 N/A GLN 182.A NE2 THR 208.A O no hydrogen 3.285 N/A GLN 182.A NE2 THR 208.A OG1 no hydrogen 3.075 N/A GLY 185.A N GLN 182.A O no hydrogen 2.950 N/A VAL 186.A N CYS 159.A O no hydrogen 2.905 N/A ASN 187.A N ALA 203.A O no hydrogen 2.799 N/A ASN 187.A ND2 ASP 205.A OD1 no hydrogen 2.856 N/A ASN 187.A ND2 VAL 230.A O no hydrogen 2.905 N/A ASP 190.A N ILE 201.A O no hydrogen 3.044 N/A TYR 192.A N TYR 199.A O no hydrogen 2.969 N/A TYR 192.A OH ASP 196.A OD2 no hydrogen 2.781 N/A MET 200.A N TRP 212.A O no hydrogen 2.941 N/A ILE 201.A N ASP 190.A O no hydrogen 2.928 N/A THR 202.A N LYS 210.A O no hydrogen 2.890 N/A THR 202.A OG1 GLN 182.A OE1 no hydrogen 2.713 N/A ALA 203.A N TYR 188.A O no hydrogen 3.156 N/A SER 204.A N THR 208.A O no hydrogen 3.154 N/A SER 204.A OG GLY 185.A O no hydrogen 2.573 N/A ASP 206.A N SER 204.A OG no hydrogen 3.011 N/A LEU 207.A N SER 204.A O no hydrogen 3.199 N/A THR 208.A N ASP 206.A OD2 no hydrogen 2.995 N/A THR 208.A OG1 ASP 206.A OD1 no hydrogen 3.451 N/A THR 208.A OG1 ASP 206.A OD2 no hydrogen 2.664 N/A ILE 209.A N LEU 223.A O no hydrogen 3.164 N/A LYS 210.A N THR 202.A O no hydrogen 2.894 N/A LYS 210.A NZ THR 222.A OG1 no hydrogen 3.003 N/A ILE 211.A N ALA 221.A O no hydrogen 2.918 N/A TRP 212.A N MET 200.A O no hydrogen 2.808 N/A TRP 212.A NE1 THR 202.A OG1 no hydrogen 2.976 N/A ASP 213.A N SER 218.A O no hydrogen 2.970 N/A TYR 214.A N PRO 198.A O no hydrogen 2.872 N/A GLN 215.A N ASP 213.A OD1 no hydrogen 2.744 N/A THR 216.A N ASP 213.A OD1 no hydrogen 3.003 N/A THR 216.A OG1 SER 218.A OG no hydrogen 3.325 N/A LYS 217.A N ASP 213.A O no hydrogen 2.695 N/A LYS 217.A NZ GLN 215.A O no hydrogen 3.209 N/A SER 218.A N THR 216.A OG1 no hydrogen 3.271 N/A SER 218.A OG THR 216.A OG1 no hydrogen 3.325 N/A CYS 219.A SG ILE 211.A O no hydrogen 3.734 N/A CYS 219.A SG ALA 221.A O no hydrogen 3.398 N/A CYS 219.A SG THR 222.A OG1 no hydrogen 3.744 N/A VAL 220.A N ILE 211.A O no hydrogen 2.767 N/A LEU 223.A N ILE 209.A O no hydrogen 2.726 N/A HIS 226.A ND1 ASP 248.A OD1 no hydrogen 3.034 N/A HIS 226.A NE2 SER 244.A OG no hydrogen 2.734 N/A MET 227.A N ASP 248.A OD1 no hydrogen 2.848 N/A ASN 229.A N SER 228.A OG no hydrogen 2.748 N/A ASN 229.A ND2 GLU 247.A OE1 no hydrogen 2.945 N/A VAL 230.A N SER 204.A O no hydrogen 3.099 N/A SER 231.A N GLY 245.A O no hydrogen 2.842 N/A SER 231.A OG SER 272.A O no hydrogen 2.645 N/A VAL 234.A N ILE 243.A O no hydrogen 2.876 N/A PHE 235.A N ASP 190.A OD1 no hydrogen 3.069 N/A HIS 236.A N ILE 241.A O no hydrogen 3.083 N/A THR 238.A N HIS 236.A ND1 no hydrogen 3.145 N/A LEU 239.A N HIS 236.A ND1 no hydrogen 3.165 N/A ILE 241.A N LEU 239.A O no hydrogen 2.841 N/A ILE 242.A N TRP 254.A O no hydrogen 2.852 N/A ILE 243.A N VAL 234.A O no hydrogen 2.867 N/A SER 244.A N LYS 252.A O no hydrogen 2.893 N/A SER 244.A OG HIS 226.A NE2 no hydrogen 2.734 N/A GLY 245.A N PHE 232.A O no hydrogen 3.200 N/A SER 246.A N THR 250.A O no hydrogen 3.183 N/A SER 246.A OG SER 228.A O no hydrogen 2.983 N/A SER 246.A OG ASN 229.A O no hydrogen 2.937 N/A GLU 247.A N ASN 229.A O no hydrogen 2.941 N/A ASP 248.A N SER 246.A OG no hydrogen 2.978 N/A GLY 249.A N SER 246.A O no hydrogen 2.989 N/A THR 250.A N ASP 248.A OD2 no hydrogen 2.935 N/A THR 250.A OG1 ASP 248.A OD1 no hydrogen 3.570 N/A THR 250.A OG1 ASP 248.A OD2 no hydrogen 2.767 N/A LEU 251.A N LEU 265.A O no hydrogen 2.923 N/A LYS 252.A N SER 244.A O no hydrogen 2.859 N/A LYS 252.A NZ THR 264.A OG1 no hydrogen 2.947 N/A ILE 253.A N LYS 263.A O no hydrogen 2.862 N/A TRP 254.A N ILE 242.A O no hydrogen 2.816 N/A TRP 254.A NE1 SER 244.A OG no hydrogen 2.890 N/A ASN 255.A N LYS 260.A O no hydrogen 2.874 N/A SER 256.A N PRO 240.A O no hydrogen 3.144 N/A SER 257.A N ASN 255.A OD1 no hydrogen 2.781 N/A THR 258.A N ASN 255.A OD1 no hydrogen 3.150 N/A TYR 259.A N ASN 255.A O no hydrogen 2.725 N/A LYS 260.A N THR 258.A OG1 no hydrogen 3.262 N/A GLU 262.A N ILE 253.A O no hydrogen 2.705 N/A LYS 263.A N ILE 253.A O no hydrogen 3.236 N/A LEU 265.A N LEU 251.A O no hydrogen 2.872 N/A GLY 268.A N ASN 266.A OD1 no hydrogen 3.128 N/A ARG 271.A N ASP 291.A OD2 no hydrogen 3.229 N/A ARG 271.A NE ASP 291.A OD1 no hydrogen 3.437 N/A ARG 271.A NE ASP 291.A OD2 no hydrogen 2.757 N/A SER 272.A N SER 246.A O no hydrogen 3.021 N/A SER 272.A OG SER 288.A OG no hydrogen 3.118 N/A TRP 273.A N GLY 289.A O no hydrogen 2.773 N/A TRP 273.A NE1 ASP 291.A OD1 no hydrogen 2.784 N/A CYS 274.A SG VAL 15.A O no hydrogen 3.572 N/A ALA 276.A N ALA 287.A O no hydrogen 2.875 N/A HIS 278.A N TYR 285.A O no hydrogen 3.072 N/A THR 280.A N HIS 278.A ND1 no hydrogen 3.308 N/A THR 280.A OG1 HIS 278.A ND1 no hydrogen 3.224 N/A GLY 281.A N HIS 278.A O no hydrogen 2.895 N/A ARG 282.A NH1 GLU 42.A OE2 no hydrogen 2.597 N/A ASN 284.A N GLY 281.A O no hydrogen 2.776 N/A TYR 285.A N ARG 282.A O no hydrogen 2.934 N/A TYR 285.A OH GLU 42.A OE2 no hydrogen 3.030 N/A ILE 286.A N LEU 297.A O no hydrogen 2.850 N/A ALA 287.A N ALA 276.A O no hydrogen 2.917 N/A SER 288.A N THR 295.A O no hydrogen 2.998 N/A SER 288.A OG SER 272.A OG no hydrogen 3.118 N/A SER 288.A OG CYS 274.A O no hydrogen 2.739 N/A GLY 289.A N CYS 274.A O no hydrogen 3.063 N/A PHE 290.A N GLY 293.A O no hydrogen 2.770 N/A ASP 291.A N ARG 271.A O no hydrogen 2.829 N/A ASN 292.A N LEU 269.A O no hydrogen 3.130 N/A GLY 293.A N PHE 290.A O no hydrogen 3.401 N/A PHE 294.A N ASN 10.A O no hydrogen 3.067 N/A THR 295.A N SER 288.A O no hydrogen 3.061 N/A VAL 296.A N PHE 8.A O no hydrogen 2.763 N/A LEU 297.A N ILE 286.A O no hydrogen 2.836 N/A SER 298.A N LYS 5.A O no hydrogen 2.904 N/A SER 298.A OG LYS 283.A O no hydrogen 2.839 N/A LEU 299.A N ASN 284.A O no hydrogen 3.104 N/A