Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5d4i_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 5.A N GLU 3.A OE2 no hydrogen 3.248 N/A LEU 7.A N ILE 4.A O no hydrogen 3.078 N/A ARG 9.A NH2 GLU 77.A OE1 no hydrogen 3.014 N/A GLN 10.A N VAL 33.A O no hydrogen 2.924 N/A VAL 12.A N GLU 35.A O no hydrogen 2.957 N/A PHE 19.A N ASP 16.A O no hydrogen 3.238 N/A HIS 21.A ND1 ALA 22.A O no hydrogen 2.757 N/A HIS 23.A ND1 HIS 21.A O no hydrogen 2.857 N/A HIS 23.A NE2 TYR 167.A OH no hydrogen 2.849 N/A GLN 25.A NE2 TYR 167.A O no hydrogen 2.907 N/A ALA 27.A N ARG 154.A O.A no hydrogen 2.811 N/A ALA 27.A N ARG 154.A O.B no hydrogen 2.804 N/A LYS 32.A N ASP 74.A OD1 no hydrogen 3.184 N/A LYS 32.A NZ GLN 10.A OE1 no hydrogen 3.199 N/A LYS 32.A NZ GLU 28.A O no hydrogen 3.461 N/A VAL 33.A N PRO 8.A O no hydrogen 2.933 N/A VAL 34.A N TYR 75.A O no hydrogen 2.898 N/A GLU 35.A N GLN 10.A O no hydrogen 2.769 N/A PHE 36.A N GLU 77.A O no hydrogen 2.981 N/A MET 38.A N THR 79.A O no hydrogen 2.863 N/A VAL 39.A N ASN 60.A OD1.B no hydrogen 3.220 N/A ILE 40.A N ILE 81.A O no hydrogen 2.915 N/A GLU 41.A N ALA 58.A O no hydrogen 2.790 N/A GLU 42.A N ASN 86.A OD1 no hydrogen 3.007 N/A LYS 43.A N ALA 56.A O no hydrogen 3.013 N/A LYS 43.A NZ GLY 61.A O no hydrogen 3.255 N/A LYS 44.A NZ GLU 53.A OE2 no hydrogen 2.753 N/A LYS 44.A NZ TYR 191.A O no hydrogen 3.266 N/A ILE 45.A N VAL 54.A O no hydrogen 2.888 N/A ILE 47.A N THR 52.A O no hydrogen 2.833 N/A ALA 50.A N ASP 48.A OD1 no hydrogen 2.916 N/A GLY 51.A N ASP 48.A O no hydrogen 3.324 N/A THR 52.A N ASP 48.A OD1 no hydrogen 3.058 N/A THR 52.A OG1 ASP 48.A OD1 no hydrogen 2.923 N/A THR 52.A OG1 ASP 48.A OD2 no hydrogen 2.735 N/A VAL 54.A N ILE 45.A O no hydrogen 2.977 N/A ALA 56.A N LYS 43.A O no hydrogen 2.735 N/A MET 57.A N SER 143.A O no hydrogen 2.907 N/A ALA 58.A N GLU 41.A O no hydrogen 2.884 N/A ASN 60.A N.A VAL 39.A O no hydrogen 2.758 N/A ASN 60.A N.B VAL 39.A O no hydrogen 2.753 N/A GLY 61.A N ALA 58.A O no hydrogen 3.374 N/A THR 62.A N PHE 59.A O no hydrogen 3.380 N/A THR 62.A OG1 PRO 64.A O no hydrogen 2.722 N/A GLY 65.A N ASN 146.A O no hydrogen 2.842 N/A MET 68.A N ALA 148.A O no hydrogen 3.347 N/A VAL 69.A N HIS 21.A NE2 no hydrogen 2.881 N/A VAL 70.A N MET 150.A O no hydrogen 2.960 N/A HIS 71.A N ASP 74.A OD2 no hydrogen 2.819 N/A HIS 71.A NE2 GLN 25.A O no hydrogen 2.963 N/A GLN 72.A N LEU 152.A O no hydrogen 2.703 N/A GLN 72.A NE2 THR 122.A O no hydrogen 3.439 N/A ASP 73.A N ALA 121.A O no hydrogen 2.799 N/A ASP 74.A N HIS 71.A O no hydrogen 2.903 N/A TYR 75.A N LYS 32.A O no hydrogen 2.818 N/A LEU 76.A N PHE 119.A O no hydrogen 2.789 N/A GLU 77.A N VAL 34.A O no hydrogen 2.879 N/A LEU 78.A N LEU 117.A O no hydrogen 2.813 N/A THR 79.A N PHE 36.A O no hydrogen 2.825 N/A LEU 80.A N THR 115.A O no hydrogen 2.883 N/A ILE 81.A N MET 38.A O no hydrogen 3.037 N/A ASN 82.A N GLU 113.A O no hydrogen 2.912 N/A ASN 82.A ND2 LEU 88.A O no hydrogen 3.006 N/A ASN 82.A ND2 ILE 109.A O no hydrogen 2.890 N/A ASN 86.A N PRO 83.A O no hydrogen 3.093 N/A ASN 86.A ND2 ILE 40.A O no hydrogen 2.809 N/A ASN 86.A ND2 ASN 82.A OD1 no hydrogen 2.762 N/A THR 87.A N GLU 42.A OE1 no hydrogen 2.904 N/A THR 87.A OG1 GLU 42.A OE1 no hydrogen 3.067 N/A LEU 88.A N GLU 42.A OE2 no hydrogen 3.000 N/A HIS 90.A N ILE 109.A O no hydrogen 3.021 N/A HIS 90.A ND1 HIS 140.A ND1 no hydrogen 3.020 N/A HIS 90.A NE2 GLU 42.A OE2 no hydrogen 2.696 N/A ASN 91.A ND2 GLY 104.A O no hydrogen 3.001 N/A ASN 91.A ND2 ALA 132.A O no hydrogen 2.984 N/A ILE 92.A N THR 107.A OG1 no hydrogen 3.070 N/A ASP 93.A N HIS 130.A O no hydrogen 2.815 N/A PHE 94.A N GLY 102.A O no hydrogen 2.747 N/A HIS 95.A N VAL 128.A O no hydrogen 2.912 N/A HIS 95.A NE2 HIS 130.A NE2 no hydrogen 3.178 N/A ALA 97.A N PHE 94.A O no hydrogen 3.181 N/A GLY 102.A N GLY 99.A O no hydrogen 2.803 N/A GLY 103.A N GLY 99.A O no hydrogen 3.216 N/A GLY 103.A N ALA 100.A O no hydrogen 2.940 N/A GLY 104.A N LEU 101.A O no hydrogen 3.063 N/A GLY 105.A N ALA 100.A O no hydrogen 2.976 N/A LEU 106.A N GLY 103.A O no hydrogen 3.016 N/A THR 107.A OG1 ILE 92.A O no hydrogen 3.261 N/A THR 107.A OG1 GLY 103.A O no hydrogen 2.807 N/A ILE 109.A N HIS 90.A O no hydrogen 2.824 N/A ASN 110.A N GLU 113.A OE2 no hydrogen 2.779 N/A GLY 112.A N ASN 82.A O no hydrogen 2.678 N/A GLU 113.A N ASN 110.A O no hydrogen 3.065 N/A THR 115.A N LEU 80.A O no hydrogen 2.986 N/A LEU 117.A N LEU 78.A O no hydrogen 2.877 N/A PHE 119.A N LEU 76.A O no hydrogen 2.958 N/A ALA 121.A N ASP 74.A O no hydrogen 2.930 N/A GLY 125.A N VAL 151.A O no hydrogen 2.784 N/A VAL 126.A N GLY 263.A O no hydrogen 2.791 N/A PHE 127.A N ILE 149.A O no hydrogen 2.910 N/A TYR 129.A N GLY 147.A O no hydrogen 2.992 N/A TYR 129.A OH PRO 66.A O no hydrogen 2.736 N/A HIS 130.A N ASP 93.A O no hydrogen 2.999 N/A HIS 130.A ND1 CYS 131.A O no hydrogen 2.743 N/A CYS 131.A N MET 145.A O no hydrogen 3.106 N/A CYS 131.A SG HIS 90.A ND1 no hydrogen 3.951 N/A CYS 131.A SG ASN 91.A O no hydrogen 3.566 N/A CYS 131.A SG ASN 91.A OD1 no hydrogen 3.475 N/A CYS 131.A SG HIS 140.A ND1 no hydrogen 3.231 N/A ALA 132.A N ASN 91.A OD1 no hydrogen 2.747 N/A MET 136.A N.A PRO 133.A O no hydrogen 2.909 N/A MET 136.A N.B PRO 133.A O no hydrogen 2.858 N/A HIS 140.A N MET 136.A O.A no hydrogen 3.250 N/A VAL 141.A N VAL 137.A O no hydrogen 3.216 N/A VAL 142.A N PRO 138.A O no hydrogen 2.860 N/A SER 143.A N TRP 139.A O no hydrogen 3.062 N/A SER 143.A N HIS 140.A O no hydrogen 3.215 N/A SER 143.A OG TRP 139.A O no hydrogen 2.663 N/A GLY 144.A N VAL 141.A O no hydrogen 3.048 N/A MET 145.A N HIS 140.A O no hydrogen 3.089 N/A ASN 146.A N GLY 144.A O no hydrogen 2.954 N/A ASN 146.A ND2 VAL 141.A O no hydrogen 3.033 N/A ASN 146.A ND2 GLN 176.A OE1 no hydrogen 2.851 N/A GLY 147.A N TYR 129.A O no hydrogen 2.881 N/A ILE 149.A N PHE 127.A O no hydrogen 2.893 N/A MET 150.A N MET 68.A O no hydrogen 2.707 N/A VAL 151.A N GLY 125.A O no hydrogen 2.770 N/A LEU 152.A N VAL 70.A O no hydrogen 2.859 N/A ARG 154.A NH1.B GLN 72.A O no hydrogen 2.795 N/A ARG 154.A NH1.B ASP 74.A OD1 no hydrogen 2.965 N/A ARG 154.A NH2.A ASP 74.A OD1 no hydrogen 2.784 N/A ARG 154.A NH2.B GLY 29.A O no hydrogen 2.863 N/A GLY 156.A N PRO 153.A O no hydrogen 2.878 N/A HIS 158.A ND1 GLY 162.A O no hydrogen 2.843 N/A ASP 159.A N LYS 163.A O no hydrogen 2.730 N/A LYS 161.A N ASP 159.A OD1 no hydrogen 2.984 N/A LYS 163.A N ASP 159.A OD1 no hydrogen 3.016 N/A LYS 163.A NZ ASP 159.A OD2 no hydrogen 3.179 N/A LEU 165.A N LEU 157.A O no hydrogen 2.976 N/A TYR 167.A N GLN 25.A OE1 no hydrogen 3.038 N/A TYR 167.A OH HIS 23.A NE2 no hydrogen 2.849 N/A ASP 168.A N LYS 235.A O no hydrogen 2.722 N/A LYS 169.A N LYS 235.A O no hydrogen 3.174 N/A LYS 169.A NZ TYR 171.A OH no hydrogen 2.864 N/A LYS 169.A NZ THR 229.A O no hydrogen 3.393 N/A TYR 171.A N LEU 237.A O no hydrogen 2.929 N/A TYR 171.A OH THR 229.A O no hydrogen 2.601 N/A TYR 172.A N PRO 18.A O no hydrogen 2.885 N/A TYR 172.A OH SER 241.A OG no hydrogen 2.600 N/A VAL 173.A N VAL 239.A O no hydrogen 2.814 N/A GLU 175.A N SER 241.A O no hydrogen 3.005 N/A GLN 176.A N VAL 214.A O no hydrogen 2.867 N/A GLN 176.A NE2 VAL 141.A O no hydrogen 3.356 N/A GLN 176.A NE2 ASP 177.A O no hydrogen 3.062 N/A ASP 177.A N ASP 177.A OD1 no hydrogen 2.672 N/A PHE 178.A N HIS 212.A O no hydrogen 2.869 N/A TYR 179.A OH ASP 177.A OD2 no hydrogen 2.580 N/A VAL 180.A N THR 211.A OG1 no hydrogen 3.093 N/A ARG 182.A NE.B GLY 186.A O no hydrogen 3.400 N/A ASP 183.A N LYS 187.A O no hydrogen 2.944 N/A GLU 184.A N GLU 184.A OE1 no hydrogen 2.696 N/A ASN 185.A N ASP 183.A OD1 no hydrogen 2.930 N/A GLY 186.A N ASP 183.A O no hydrogen 3.095 N/A LYS 187.A N ASP 183.A OD1 no hydrogen 3.263 N/A LYS 189.A N PRO 181.A O no hydrogen 2.945 N/A LYS 189.A NZ ASP 200.A OD2 no hydrogen 2.800 N/A TYR 191.A OH ASP 200.A OD2 no hydrogen 2.612 N/A ASP 196.A N ALA 193.A O no hydrogen 3.244 N/A ALA 197.A N PRO 194.A O no hydrogen 2.985 N/A TYR 198.A N GLY 195.A O no hydrogen 3.294 N/A THR 201.A N ALA 197.A O no hydrogen 2.906 N/A THR 201.A OG1 ALA 197.A O no hydrogen 2.704 N/A VAL 202.A N TYR 198.A O no hydrogen 3.028 N/A LYS 203.A N GLU 199.A O no hydrogen 3.291 N/A VAL 204.A N ASP 200.A O no hydrogen 3.456 N/A MET 205.A N THR 201.A O no hydrogen 2.792 N/A ARG 206.A N VAL 202.A O no hydrogen 3.000 N/A THR 207.A N VAL 204.A O no hydrogen 3.001 N/A THR 207.A OG1 VAL 204.A O no hydrogen 2.644 N/A LEU 208.A N MET 205.A O no hydrogen 2.854 N/A THR 209.A N THR 207.A OG1 no hydrogen 3.230 N/A THR 209.A OG1 THR 207.A O no hydrogen 3.074 N/A THR 211.A N PHE 178.A O no hydrogen 2.901 N/A THR 211.A OG1 PHE 178.A O no hydrogen 3.317 N/A THR 211.A OG1 HIS 212.A ND1 no hydrogen 2.824 N/A HIS 212.A N PHE 178.A O no hydrogen 3.454 N/A HIS 212.A ND1 THR 211.A OG1 no hydrogen 2.824 N/A HIS 212.A NE2 ASP 48.A OD2 no hydrogen 2.871 N/A VAL 213.A N LEU 309.A O no hydrogen 3.022 N/A VAL 214.A N GLN 176.A O no hydrogen 2.927 N/A ASN 216.A N.A GLY 174.A O no hydrogen 3.096 N/A ASN 216.A N.B GLY 174.A O no hydrogen 3.167 N/A ASN 216.A ND2.A TYR 172.A O no hydrogen 3.595 N/A ASN 216.A ND2.B PRO 17.A O no hydrogen 3.458 N/A ALA 218.A N PHE 215.A O no hydrogen 3.537 N/A VAL 219.A N ILE 47.A O no hydrogen 2.761 N/A ALA 221.A N ALA 218.A O no hydrogen 3.213 N/A THR 223.A N GLY 220.A O no hydrogen 3.362 N/A THR 223.A OG1 GLY 220.A O no hydrogen 2.926 N/A GLY 224.A N HIS 314.A ND1 no hydrogen 3.107 N/A LYS 226.A N.A THR 223.A O no hydrogen 2.712 N/A LYS 226.A N.B THR 223.A O no hydrogen 2.768 N/A MET 228.A N HIS 314.A O no hydrogen 2.950 N/A THR 229.A N TYR 171.A OH no hydrogen 3.112 N/A ALA 230.A N LYS 316.A O no hydrogen 3.125 N/A ALA 231.A N GLU 234.A OE1 no hydrogen 2.755 N/A VAL 232.A N THR 318.A O no hydrogen 2.812 N/A GLY 233.A N PHE 290.A O no hydrogen 2.772 N/A GLU 234.A N ALA 231.A O no hydrogen 2.787 N/A LYS 235.A N ASP 168.A OD2 no hydrogen 2.756 N/A LYS 235.A NZ THR 166.A O no hydrogen 2.692 N/A VAL 236.A N TYR 288.A O no hydrogen 2.740 N/A LEU 237.A N LYS 169.A O no hydrogen 2.911 N/A ILE 238.A N ALA 286.A O no hydrogen 2.822 N/A VAL 239.A N TYR 171.A O no hydrogen 2.850 N/A HIS 240.A N GLY 284.A O no hydrogen 2.858 N/A HIS 240.A ND1 TYR 298.A OH no hydrogen 2.613 N/A HIS 240.A NE2 GLU 175.A OE1 no hydrogen 2.787 N/A SER 241.A N VAL 173.A O no hydrogen 3.126 N/A SER 241.A OG TYR 172.A OH no hydrogen 2.600 N/A GLN 242.A N ALA 282.A O no hydrogen 3.209 N/A GLN 242.A NE2 ASP 177.A OD1 no hydrogen 3.071 N/A ASN 244.A N GLN 242.A OE1 no hydrogen 2.890 N/A ASN 244.A ND2 ASP 177.A OD2 no hydrogen 2.951 N/A ARG 245.A N GLN 242.A OE1 no hydrogen 3.011 N/A ARG 245.A NH1 GLU 305.A OE1 no hydrogen 2.798 N/A ARG 245.A NH1 GLU 305.A OE2 no hydrogen 3.496 N/A ARG 245.A NH2 GLU 305.A OE2 no hydrogen 2.784 N/A THR 247.A N ILE 278.A O no hydrogen 2.948 N/A THR 247.A OG1 GLU 175.A OE1 no hydrogen 2.563 N/A THR 247.A OG1 GLU 175.A OE2 no hydrogen 3.268 N/A ARG 248.A NH2 ASN 300.A OD1 no hydrogen 2.950 N/A HIS 250.A N VAL 299.A O no hydrogen 2.860 N/A HIS 250.A ND1 GLU 274.A O no hydrogen 2.505 N/A HIS 250.A ND1 THR 275.A OG1 no hydrogen 3.009 N/A ILE 252.A N ALA 297.A O no hydrogen 2.799 N/A GLY 254.A N LEU 251.A O no hydrogen 2.953 N/A GLY 256.A N GLN 273.A O no hydrogen 2.845 N/A TYR 258.A N PHE 287.A O no hydrogen 3.313 N/A VAL 259.A N ASP 270.A O no hydrogen 2.768 N/A TRP 260.A N ALA 285.A O no hydrogen 2.875 N/A GLY 263.A N TRP 260.A O no hydrogen 2.888 N/A LYS 264.A N THR 262.A OG1 no hydrogen 3.336 N/A LYS 264.A NZ VAL 126.A O no hydrogen 2.736 N/A LYS 264.A NZ THR 262.A O no hydrogen 2.895 N/A PHE 265.A N PRO 124.A O no hydrogen 3.281 N/A THR 267.A N LYS 264.A O no hydrogen 3.073 N/A ASP 270.A N VAL 259.A O no hydrogen 2.868 N/A ASP 272.A N ASP 257.A O no hydrogen 3.077 N/A GLN 273.A N GLY 256.A O no hydrogen 2.840 N/A GLN 273.A NE2 VAL 271.A O no hydrogen 2.863 N/A THR 275.A OG1 HIS 250.A ND1 no hydrogen 3.009 N/A TRP 276.A N PRO 249.A O no hydrogen 3.146 N/A ILE 278.A N THR 247.A O no hydrogen 3.058 N/A GLY 280.A N ASP 246.A OD1 no hydrogen 2.857 N/A GLY 281.A N GLN 242.A O no hydrogen 2.787 N/A GLY 284.A N HIS 240.A O no hydrogen 2.826 N/A ALA 285.A N TRP 260.A O no hydrogen 3.182 N/A ALA 286.A N ILE 238.A O no hydrogen 2.999 N/A PHE 287.A N TYR 258.A O no hydrogen 2.734 N/A TYR 288.A N VAL 236.A O no hydrogen 2.882 N/A THR 289.A N ASP 257.A OD2 no hydrogen 3.200 N/A PHE 290.A N GLU 234.A O no hydrogen 3.087 N/A GLN 291.A NE2 PHE 290.A O no hydrogen 3.266 N/A GLN 292.A NE2 ASN 322.A O no hydrogen 2.921 N/A GLY 294.A N VAL 317.A O no hydrogen 2.809 N/A TYR 296.A N PHE 315.A O no hydrogen 2.848 N/A TYR 296.A OH GLN 292.A O no hydrogen 2.637 N/A TYR 298.A N ALA 313.A O no hydrogen 2.729 N/A TYR 298.A OH HIS 240.A ND1 no hydrogen 2.613 N/A VAL 299.A N HIS 250.A O no hydrogen 2.930 N/A ASN 300.A N ALA 311.A O no hydrogen 3.265 N/A ASN 300.A ND2 GLU 175.A OE2 no hydrogen 2.818 N/A HIS 301.A N ARG 248.A O no hydrogen 2.770 N/A HIS 301.A ND1 HIS 301.A O no hydrogen 2.651 N/A ASN 302.A N ASN 300.A OD1 no hydrogen 2.916 N/A ILE 304.A N ASN 302.A OD1 no hydrogen 3.016 N/A GLU 305.A N ASN 302.A OD1 no hydrogen 3.117 N/A ALA 306.A N ASN 302.A O no hydrogen 2.908 N/A PHE 307.A N LEU 303.A O no hydrogen 2.863 N/A GLU 308.A N ILE 304.A O no hydrogen 2.840 N/A LEU 309.A N ILE 304.A O no hydrogen 3.005 N/A ALA 311.A N GLU 305.A O no hydrogen 3.036 N/A ALA 312.A N GLY 310.A O no hydrogen 2.931 N/A ALA 313.A N TYR 298.A O no hydrogen 2.793 N/A HIS 314.A N LEU 222.A O no hydrogen 2.799 N/A PHE 315.A N TYR 296.A O no hydrogen 2.932 N/A LYS 316.A N MET 228.A O no hydrogen 2.808 N/A VAL 317.A N GLY 294.A O no hydrogen 2.983 N/A THR 318.A N ALA 230.A O no hydrogen 3.018 N/A TRP 321.A NE1 MET 326.A O no hydrogen 2.988 N/A ASN 322.A N GLN 292.A OE1 no hydrogen 2.819 N/A ASP 324.A N ASN 322.A OD1 no hydrogen 3.006 N/A LEU 325.A N ASN 322.A OD1 no hydrogen 3.351 N/A MET 326.A N ASN 322.A O no hydrogen 3.428 N/A THR 327.A OG1 ASP 323.A OD1 no hydrogen 2.999 N/A SER 333.A OG ALA 331.A O no hydrogen 3.315 N/A