Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2hej_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N ILE 11.A O no hydrogen 3.038 N/A LEU 5.A N ASN 9.A O no hydrogen 2.775 N/A ASN 6.A ND2 PRO 181.A O no hydrogen 3.048 N/A ASN 6.A ND2 ASP 205.A O no hydrogen 2.912 N/A GLY 8.A N LEU 5.A O no hydrogen 2.980 N/A ASN 9.A N ASP 7.A OD1 no hydrogen 3.032 N/A ASN 9.A ND2 ASP 7.A OD1 no hydrogen 3.449 N/A ASN 9.A ND2 ASP 7.A OD2 no hydrogen 3.243 N/A ASN 9.A ND2 SER 157.A OG no hydrogen 3.251 N/A ILE 11.A N VAL 3.A O no hydrogen 3.042 N/A VAL 13.A N HIS 1.A O no hydrogen 2.903 N/A GLY 15.A N VAL 262.A O.A no hydrogen 2.770 N/A GLY 15.A N VAL 262.A O.B no hydrogen 2.754 N/A PHE 16.A N HIS 43.A O no hydrogen 2.776 N/A GLY 17.A N ASN 264.A O no hydrogen 2.825 N/A THR 18.A N ASP 45.A O no hydrogen 2.929 N/A THR 18.A OG1 ASP 45.A O no hydrogen 2.724 N/A GLU 23.A N GLU 23.A OE1 no hydrogen 2.479 N/A CYS 24.A N PRO 21.A O no hydrogen 3.221 N/A LYS 28.A N PRO 25.A O no hydrogen 2.939 N/A LYS 28.A NZ GLU 31.A OE1.B no hydrogen 3.475 N/A LYS 28.A NZ GLU 31.A OE2.B no hydrogen 3.057 N/A ALA 29.A N LYS 26.A O no hydrogen 3.051 N/A LYS 30.A N SER 27.A O no hydrogen 3.098 N/A GLU 31.A N.A SER 27.A O no hydrogen 3.450 N/A GLU 31.A N.B SER 27.A O no hydrogen 3.449 N/A LEU 32.A N LYS 28.A O no hydrogen 2.972 N/A THR 33.A N ALA 29.A O no hydrogen 3.039 N/A THR 33.A OG1 ALA 29.A O no hydrogen 2.800 N/A LYS 34.A N LYS 30.A O no hydrogen 3.124 N/A ILE 35.A N GLU 31.A O.A no hydrogen 3.141 N/A ILE 35.A N GLU 31.A O.B no hydrogen 3.116 N/A ALA 36.A N LEU 32.A O no hydrogen 2.801 N/A ILE 37.A N THR 33.A O no hydrogen 2.908 N/A ASP 38.A N LYS 34.A O no hydrogen 3.083 N/A ALA 39.A N ILE 35.A O no hydrogen 2.990 N/A ALA 39.A N ALA 36.A O no hydrogen 3.106 N/A GLY 40.A N ILE 37.A O no hydrogen 3.058 N/A PHE 41.A N ALA 36.A O no hydrogen 2.946 N/A HIS 43.A ND1 PRO 12.A O no hydrogen 2.922 N/A PHE 44.A N PHE 75.A O no hydrogen 2.820 N/A ASP 45.A N PHE 16.A O no hydrogen 2.931 N/A SER 46.A N THR 77.A O no hydrogen 2.860 N/A SER 46.A OG TYR 76.A OH no hydrogen 3.310 N/A ALA 47.A N SER 46.A OG no hydrogen 2.739 N/A SER 48.A N.A LYS 79.A O no hydrogen 3.108 N/A SER 48.A N.B LYS 79.A O no hydrogen 3.092 N/A SER 48.A OG.A LYS 79.A O no hydrogen 3.105 N/A TYR 50.A N ALA 47.A O no hydrogen 3.123 N/A ASN 51.A N SER 48.A O.A no hydrogen 3.010 N/A ASN 51.A N SER 48.A O.B no hydrogen 3.201 N/A VAL 56.A N THR 52.A O no hydrogen 3.035 N/A GLY 57.A N GLU 53.A O no hydrogen 2.811 N/A GLU 58.A N ASP 54.A O no hydrogen 2.962 N/A ALA 59.A N HIS 55.A O no hydrogen 3.068 N/A ILE 60.A N VAL 56.A O no hydrogen 3.002 N/A ARG 61.A N GLY 57.A O no hydrogen 2.824 N/A ARG 61.A NE LEU 101.A O no hydrogen 2.840 N/A SER 62.A N GLU 58.A O no hydrogen 2.845 N/A LYS 63.A N ALA 59.A O no hydrogen 3.115 N/A LYS 63.A NZ ASP 38.A OD1 no hydrogen 2.890 N/A LYS 63.A NZ ASP 38.A OD2 no hydrogen 3.017 N/A ILE 64.A N ILE 60.A O no hydrogen 2.988 N/A ALA 65.A N ARG 61.A O no hydrogen 2.860 N/A ASP 66.A N SER 62.A O no hydrogen 3.009 N/A GLY 67.A N ILE 64.A O no hydrogen 3.232 N/A THR 68.A N LYS 63.A O no hydrogen 2.859 N/A THR 68.A N ASP 66.A OD1 no hydrogen 3.102 N/A THR 68.A OG1 ASP 66.A OD1 no hydrogen 2.750 N/A VAL 69.A N LYS 63.A O no hydrogen 3.112 N/A ARG 71.A NH1 ARG 71.A O no hydrogen 2.986 N/A ARG 71.A NH1 ILE 74.A O no hydrogen 2.948 N/A ARG 71.A NH1 ASP 107.A OD1 no hydrogen 3.037 N/A ARG 71.A NH2 TYR 105.A O no hydrogen 2.914 N/A ARG 71.A NH2 ASP 107.A OD1 no hydrogen 2.945 N/A GLU 72.A N GLU 72.A OE1 no hydrogen 2.610 N/A ASP 73.A N ARG 70.A O no hydrogen 2.958 N/A ILE 74.A N ARG 71.A O no hydrogen 3.018 N/A PHE 75.A N HIS 42.A O no hydrogen 2.790 N/A TYR 76.A N ASP 107.A OD1 no hydrogen 2.846 N/A TYR 76.A OH GLU 53.A OE2 no hydrogen 2.795 N/A THR 77.A N PHE 44.A O no hydrogen 2.964 N/A SER 78.A N LEU 108.A O no hydrogen 2.930 N/A SER 78.A OG GLU 53.A OE2 no hydrogen 2.592 N/A LYS 79.A NZ ASP 45.A OD1 no hydrogen 2.744 N/A LYS 79.A NZ ASP 45.A OD2 no hydrogen 3.442 N/A LYS 79.A NZ SER 46.A O no hydrogen 2.869 N/A LYS 79.A NZ TYR 50.A OH no hydrogen 3.459 N/A VAL 80.A N LEU 110.A O no hydrogen 2.812 N/A TRP 81.A NE1 ASN 123.A O no hydrogen 2.768 N/A SER 84.A N TRP 81.A O no hydrogen 2.899 N/A GLU 88.A N GLU 88.A OE2 no hydrogen 2.535 N/A LEU 89.A N HIS 86.A O no hydrogen 2.822 N/A VAL 90.A N HIS 86.A O no hydrogen 3.306 N/A ARG 91.A NE GLU 95.A OE2 no hydrogen 3.342 N/A SER 93.A N LEU 89.A O no hydrogen 3.140 N/A LEU 94.A N VAL 90.A O no hydrogen 3.137 N/A GLU 95.A N ARG 91.A O no hydrogen 2.818 N/A ARG 96.A N ALA 92.A O no hydrogen 3.042 N/A ARG 96.A NH1 GLU 121.A OE2 no hydrogen 2.765 N/A ARG 96.A NH2 GLU 121.A OE2 no hydrogen 2.971 N/A SER 97.A N SER 93.A O no hydrogen 2.980 N/A SER 97.A OG GLU 53.A OE1 no hydrogen 2.598 N/A SER 97.A OG GLU 53.A OE2 no hydrogen 3.474 N/A SER 97.A OG SER 93.A O no hydrogen 3.493 N/A LEU 98.A N LEU 94.A O no hydrogen 2.907 N/A GLN 99.A N GLU 95.A O no hydrogen 3.031 N/A LYS 100.A N ARG 96.A O no hydrogen 3.001 N/A LEU 101.A N SER 97.A O no hydrogen 2.874 N/A GLN 102.A N LEU 98.A O no hydrogen 2.680 N/A PHE 103.A N LEU 98.A O no hydrogen 3.123 N/A VAL 106.A N LEU 154.A O no hydrogen 2.994 N/A ASP 107.A N TYR 76.A O no hydrogen 2.819 N/A LEU 108.A N TYR 76.A O no hydrogen 3.161 N/A TYR 109.A N SER 157.A O no hydrogen 3.061 N/A LEU 110.A N SER 78.A O no hydrogen 3.026 N/A ILE 111.A N GLY 159.A O no hydrogen 3.233 N/A HIS 112.A N VAL 80.A O no hydrogen 3.106 N/A LEU 117.A N CYS 82.A O no hydrogen 3.062 N/A LYS 118.A N ILE 133.A O no hydrogen 2.988 N/A PHE 124.A N GLU 122.A OE1 no hydrogen 2.916 N/A ASP 127.A N LYS 131.A O no hydrogen 2.847 N/A HIS 129.A N ASP 127.A OD1 no hydrogen 2.735 N/A GLY 130.A N ASP 127.A O no hydrogen 3.036 N/A LYS 131.A N ASP 127.A OD1 no hydrogen 3.016 N/A ILE 133.A N PRO 125.A O no hydrogen 2.877 N/A ASP 135.A N ALA 116.A O no hydrogen 3.003 N/A ARG 136.A N ASP 135.A OD1 no hydrogen 2.856 N/A CYS 140.A N ASP 138.A OD1 no hydrogen 3.064 N/A CYS 140.A SG MET 170.A O no hydrogen 3.812 N/A ALA 141.A N ASP 138.A OD1 no hydrogen 3.346 N/A THR 142.A N ASP 138.A O no hydrogen 2.907 N/A THR 142.A OG1 LEU 85.A O no hydrogen 2.731 N/A THR 142.A OG1 ASP 138.A O no hydrogen 3.275 N/A TRP 143.A N LEU 139.A O no hydrogen 2.863 N/A TRP 143.A NE1 TYR 179.A O no hydrogen 2.794 N/A GLU 144.A N CYS 140.A O no hydrogen 3.023 N/A ALA 145.A N ALA 141.A O no hydrogen 3.078 N/A MET 146.A N THR 142.A O no hydrogen 3.010 N/A GLU 147.A N TRP 143.A O no hydrogen 2.844 N/A LYS 148.A N GLU 144.A O no hydrogen 3.004 N/A CYS 149.A N ALA 145.A O no hydrogen 3.104 N/A CYS 149.A SG ALA 145.A O no hydrogen 3.462 N/A LYS 150.A N MET 146.A O no hydrogen 3.116 N/A LYS 150.A NZ ASP 7.A OD2 no hydrogen 3.273 N/A LYS 150.A NZ LYS 156.A O no hydrogen 2.760 N/A ASP 151.A N GLU 147.A O no hydrogen 2.904 N/A ALA 152.A N LYS 148.A O no hydrogen 2.863 N/A GLY 153.A N LYS 150.A O no hydrogen 2.993 N/A LEU 154.A N CYS 149.A O no hydrogen 3.050 N/A THR 155.A OG1 VAL 106.A O no hydrogen 3.542 N/A THR 155.A OG1 SER 157.A O no hydrogen 2.781 N/A LYS 156.A N VAL 106.A O no hydrogen 3.077 N/A SER 157.A N ASP 107.A O no hydrogen 3.035 N/A SER 157.A OG ASP 7.A OD1 no hydrogen 3.486 N/A SER 157.A OG ASP 7.A OD2 no hydrogen 2.642 N/A GLY 159.A N TYR 109.A O no hydrogen 3.003 N/A VAL 160.A N CYS 183.A O no hydrogen 3.047 N/A SER 161.A N ILE 111.A O no hydrogen 2.898 N/A SER 161.A OG ASN 162.A OD1 no hydrogen 3.220 N/A SER 161.A OG GLN 185.A O no hydrogen 2.747 N/A ASN 162.A N GLN 185.A O no hydrogen 2.845 N/A ASN 162.A ND2 TYR 211.A OH no hydrogen 2.633 N/A PHE 163.A N ASN 184.A OD1 no hydrogen 3.275 N/A ASN 164.A N GLN 167.A OE1 no hydrogen 2.909 N/A ASN 164.A ND2 PRO 313.A O no hydrogen 3.123 N/A TYR 165.A N TYR 318.A O no hydrogen 2.871 N/A GLN 167.A N ASN 164.A OD1 no hydrogen 2.827 N/A GLN 167.A NE2 ASN 311.A O no hydrogen 2.988 N/A LEU 168.A N ASN 164.A O no hydrogen 2.998 N/A GLU 169.A N TYR 165.A O no hydrogen 2.923 N/A MET 170.A N ARG 166.A O no hydrogen 3.043 N/A LEU 172.A N LEU 168.A O no hydrogen 2.877 N/A ASN 173.A N GLU 169.A O no hydrogen 2.761 N/A ASN 173.A ND2 GLU 169.A OE2 no hydrogen 3.502 N/A LYS 174.A N ILE 171.A O no hydrogen 3.069 N/A LYS 174.A NZ GLU 144.A OE1 no hydrogen 2.763 N/A LYS 174.A NZ PRO 175.A O no hydrogen 3.207 N/A LEU 177.A N LYS 174.A O no hydrogen 3.235 N/A LYS 178.A N GLU 147.A OE2 no hydrogen 2.873 N/A LYS 178.A NZ ASP 151.A OD1 no hydrogen 3.423 N/A LYS 178.A NZ ASP 151.A OD2 no hydrogen 2.826 N/A TYR 179.A N GLU 147.A OE2 no hydrogen 2.874 N/A TYR 179.A OH ASP 151.A OD1 no hydrogen 2.527 N/A LYS 180.A NZ LYS 204.A O no hydrogen 2.847 N/A VAL 182.A N ILE 158.A O no hydrogen 2.902 N/A ASN 184.A N VAL 207.A O no hydrogen 2.969 N/A ASN 184.A ND2 PHE 163.A O no hydrogen 2.926 N/A GLN 185.A N VAL 160.A O no hydrogen 2.889 N/A GLN 185.A NE2 ASP 45.A OD2 no hydrogen 2.938 N/A VAL 186.A N VAL 209.A O no hydrogen 2.864 N/A CYS 188.A N TYR 211.A O no hydrogen 2.905 N/A CYS 188.A SG LEU 192.A O no hydrogen 3.716 N/A CYS 188.A SG ASN 193.A O no hydrogen 3.395 N/A HIS 189.A N LEU 192.A O no hydrogen 3.209 N/A HIS 189.A NE2 MET 298.A O no hydrogen 3.121 N/A TYR 191.A OH GLU 233.A OE2 no hydrogen 2.541 N/A LEU 192.A N HIS 189.A O no hydrogen 2.947 N/A ASN 193.A N ASN 295.A OD1 no hydrogen 3.049 N/A LEU 198.A N GLN 194.A O no hydrogen 2.784 N/A ASP 199.A N MET 195.A O.A no hydrogen 3.078 N/A ASP 199.A N MET 195.A O.B no hydrogen 3.111 N/A PHE 200.A N LYS 196.A O no hydrogen 3.017 N/A CYS 201.A N LEU 197.A O no hydrogen 2.877 N/A CYS 201.A SG LEU 197.A O no hydrogen 3.368 N/A LYS 202.A N LEU 198.A O no hydrogen 2.921 N/A LYS 202.A NZ ARG 258.A O no hydrogen 2.796 N/A SER 203.A N ASP 199.A O no hydrogen 3.085 N/A SER 203.A OG PHE 200.A O no hydrogen 2.644 N/A LYS 204.A N PHE 200.A O no hydrogen 3.262 N/A LYS 204.A N CYS 201.A O no hydrogen 3.027 N/A ASP 205.A N LYS 202.A O no hydrogen 3.138 N/A ILE 206.A N CYS 201.A O no hydrogen 2.860 N/A VAL 207.A N VAL 182.A O no hydrogen 3.021 N/A VAL 209.A N ASN 184.A O no hydrogen 3.170 N/A ALA 210.A N VAL 261.A O no hydrogen 2.816 N/A TYR 211.A N VAL 186.A O no hydrogen 3.031 N/A GLY 215.A N GLY 212.A O no hydrogen 2.878 N/A THR 216.A OG1 GLY 215.A O no hydrogen 2.605 N/A GLN 217.A NE2 ALA 19.A O no hydrogen 2.918 N/A GLN 217.A NE2 TYR 219.A OH no hydrogen 3.005 N/A ARG 218.A N THR 216.A OG1 no hydrogen 2.964 N/A ARG 218.A NH1 SER 227.A O no hydrogen 3.376 N/A ARG 218.A NH1 PRO 228.A O no hydrogen 3.325 N/A ARG 218.A NH2 GLN 225.A O no hydrogen 3.021 N/A ARG 218.A NH2 SER 227.A O no hydrogen 2.815 N/A TRP 222.A N TYR 219.A O no hydrogen 3.092 N/A VAL 223.A N TYR 219.A O no hydrogen 2.934 N/A GLN 225.A NE2 ARG 218.A O no hydrogen 3.086 N/A GLN 225.A NE2 VAL 223.A O no hydrogen 2.886 N/A ASN 226.A N ASP 224.A OD1 no hydrogen 2.755 N/A SER 227.A N ASP 224.A O no hydrogen 3.064 N/A SER 227.A OG ASP 224.A O no hydrogen 2.835 N/A ASP 232.A N VAL 229.A O no hydrogen 3.005 N/A GLU 233.A N LEU 230.A O no hydrogen 2.941 N/A VAL 235.A N GLU 233.A OE1 no hydrogen 2.982 N/A LEU 236.A N GLU 233.A O no hydrogen 2.990 N/A GLY 237.A N GLU 233.A O no hydrogen 3.167 N/A SER 238.A N PRO 234.A O no hydrogen 2.831 N/A SER 238.A OG PRO 234.A O no hydrogen 3.201 N/A MET 239.A N VAL 235.A O no hydrogen 3.017 N/A ALA 240.A N LEU 236.A O no hydrogen 2.868 N/A LYS 241.A N.A GLY 237.A O no hydrogen 3.084 N/A LYS 241.A N.B GLY 237.A O no hydrogen 3.088 N/A LYS 242.A N SER 238.A O no hydrogen 3.011 N/A LYS 242.A NZ ASP 287.A OD1 no hydrogen 3.539 N/A LYS 242.A NZ ASP 287.A OD2 no hydrogen 2.792 N/A TYR 243.A N MET 239.A O no hydrogen 2.994 N/A TYR 243.A OH ASP 287.A OD2 no hydrogen 2.514 N/A ASN 244.A N LYS 241.A O.A no hydrogen 3.176 N/A ASN 244.A N LYS 241.A O.B no hydrogen 3.224 N/A ARG 245.A N ALA 240.A O no hydrogen 2.855 N/A THR 246.A OG1 GLU 274.A OE1 no hydrogen 2.872 N/A LEU 249.A N THR 246.A OG1 no hydrogen 3.221 N/A ILE 250.A N THR 246.A O no hydrogen 3.071 N/A ALA 251.A N PRO 247.A O no hydrogen 3.021 N/A LEU 252.A N ALA 248.A O no hydrogen 2.951 N/A ARG 253.A N LEU 249.A O no hydrogen 2.942 N/A ARG 253.A NH1 VAL 278.A O no hydrogen 2.947 N/A ARG 253.A NH2 GLN 282.A OE1 no hydrogen 2.820 N/A TYR 254.A N ILE 250.A O no hydrogen 2.977 N/A TYR 254.A OH ASP 292.A OD1 no hydrogen 2.695 N/A LEU 256.A N LEU 252.A O no hydrogen 3.191 N/A GLN 257.A N ARG 253.A O no hydrogen 3.018 N/A ARG 258.A N GLN 255.A O no hydrogen 2.972 N/A ARG 258.A NH1 ASN 193.A O no hydrogen 2.921 N/A ARG 258.A NH1 GLN 255.A OE1 no hydrogen 2.984 N/A ARG 258.A NH2 ASN 193.A O no hydrogen 2.796 N/A GLY 259.A N LEU 256.A O no hydrogen 3.160 N/A ILE 260.A N GLN 255.A O no hydrogen 3.233 N/A VAL 261.A N LEU 208.A O no hydrogen 3.085 N/A VAL 262.A N.A VAL 13.A O no hydrogen 2.824 N/A VAL 262.A N.B VAL 13.A O no hydrogen 2.807 N/A LEU 263.A N ALA 210.A O no hydrogen 3.045 N/A ASN 264.A N GLY 15.A O no hydrogen 2.975 N/A ASN 264.A ND2 GLY 15.A O no hydrogen 3.002 N/A THR 265.A OG1 GLY 17.A O no hydrogen 2.751 N/A SER 266.A OG LYS 268.A O no hydrogen 3.365 N/A LYS 268.A N SER 266.A OG no hydrogen 3.043 N/A ARG 271.A N LYS 268.A O no hydrogen 3.019 N/A ILE 272.A N LYS 268.A O no hydrogen 3.043 N/A LYS 273.A N GLU 269.A O no hydrogen 3.017 N/A LYS 273.A NZ GLU 269.A OE1 no hydrogen 2.892 N/A GLU 274.A N GLU 270.A O no hydrogen 2.993 N/A ASN 275.A N ARG 271.A O no hydrogen 2.924 N/A MET 276.A N LYS 273.A O no hydrogen 3.250 N/A GLN 277.A N GLU 274.A O no hydrogen 2.829 N/A VAL 278.A N ASN 275.A O no hydrogen 3.191 N/A GLU 280.A N GLN 277.A O no hydrogen 3.012 N/A SER 284.A N TYR 243.A OH no hydrogen 2.907 N/A GLU 286.A N GLU 286.A OE2 no hydrogen 2.583 N/A ASP 287.A N SER 284.A OG no hydrogen 3.099 N/A MET 288.A N SER 284.A O no hydrogen 2.979 N/A LYS 289.A N SER 285.A O no hydrogen 3.211 N/A VAL 290.A N GLU 286.A O no hydrogen 3.152 N/A LEU 291.A N ASP 287.A O no hydrogen 3.019 N/A ASP 292.A N MET 288.A O no hydrogen 2.929 N/A GLY 293.A N LYS 289.A O no hydrogen 3.195 N/A GLY 293.A N VAL 290.A O no hydrogen 3.094 N/A LEU 294.A N LEU 291.A O no hydrogen 3.215 N/A ARG 296.A N TYR 191.A O no hydrogen 2.962 N/A MET 298.A N TYR 191.A O no hydrogen 3.083 N/A TYR 300.A N GLU 187.A OE2 no hydrogen 2.710 N/A TYR 300.A OH PRO 228.A O no hydrogen 2.688 N/A ILE 301.A N GLU 187.A OE1 no hydrogen 2.971 N/A PHE 306.A N ALA 303.A O no hydrogen 2.873 N/A LYS 307.A N ALA 304.A O no hydrogen 3.024 N/A HIS 309.A N PHE 306.A O no hydrogen 2.938 N/A HIS 309.A NE2 ALA 116.A O no hydrogen 3.033 N/A ASN 311.A N HIS 309.A ND1 no hydrogen 2.948 N/A TRP 312.A N HIS 309.A O no hydrogen 2.953 N/A TRP 312.A NE1 PRO 302.A O no hydrogen 2.921 N/A