Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4adi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 2.A N PHE 322.A O no hydrogen 2.989 N/A THR 4.A N LEU 320.A O no hydrogen 3.189 N/A LEU 6.A N LEU 318.A O no hydrogen 2.881 N/A THR 8.A OG1 PRO 315.A O no hydrogen 2.749 N/A CYS 12.A N ALA 9.A O no hydrogen 3.073 N/A CYS 12.A SG ALA 9.A O no hydrogen 3.286 N/A THR 14.A N VAL 20.A O no hydrogen 2.863 N/A THR 14.A OG1 VAL 20.A O no hydrogen 3.465 N/A VAL 20.A N THR 14.A O no hydrogen 3.147 N/A ARG 21.A N SER 169.A O no hydrogen 2.982 N/A LEU 22.A N CYS 12.A O no hydrogen 2.943 N/A ALA 23.A N GLN 167.A O no hydrogen 2.770 N/A GLY 24.A N GLN 167.A O no hydrogen 3.302 N/A ARG 26.A N VAL 165.A O no hydrogen 2.903 N/A GLU 28.A N ARG 163.A O no hydrogen 2.821 N/A SER 29.A OG HIS 159.A ND1 no hydrogen 2.669 N/A LYS 30.A N THR 160.A O no hydrogen 2.811 N/A ILE 31.A N ASN 383.A OD1 no hydrogen 2.838 N/A VAL 32.A N PHE 158.A O no hydrogen 2.773 N/A ASP 33.A N GLN 342.A O no hydrogen 2.816 N/A GLY 34.A N VAL 156.A O no hydrogen 2.987 N/A GLY 35.A N ASP 33.A OD1 no hydrogen 2.963 N/A CYS 36.A N SER 235.A O no hydrogen 2.811 N/A PHE 37.A N VAL 154.A O no hydrogen 2.825 N/A ALA 38.A N ARG 233.A O no hydrogen 3.104 N/A TRP 40.A N GLN 232.A OE1 no hydrogen 2.869 N/A GLU 43.A N SER 145.A O no hydrogen 2.900 N/A THR 45.A N LEU 143.A O no hydrogen 2.862 N/A GLY 46.A N THR 45.A OG1 no hydrogen 2.864 N/A ALA 47.A N PHE 141.A O no hydrogen 2.977 N/A ILE 49.A N SER 139.A O no hydrogen 2.827 N/A ILE 52.A N GLU 51.A OE1 no hydrogen 2.806 N/A SER 57.A N ASP 55.A O no hydrogen 3.201 N/A SER 57.A OG ASP 55.A OD1 no hydrogen 2.774 N/A GLY 60.A N SER 57.A OG no hydrogen 3.085 N/A LEU 61.A N SER 57.A O no hydrogen 2.913 N/A GLY 62.A N GLU 59.A O no hydrogen 3.250 N/A TRP 64.A N LEU 61.A O no hydrogen 2.938 N/A VAL 65.A N LEU 61.A O no hydrogen 2.895 N/A CYS 70.A N PRO 66.A O no hydrogen 3.046 N/A ALA 71.A N THR 67.A O no hydrogen 3.146 N/A ARG 72.A N ALA 68.A O no hydrogen 3.074 N/A ILE 73.A N PRO 69.A O no hydrogen 2.922 N/A TRP 74.A N CYS 70.A O no hydrogen 2.838 N/A ASN 75.A N ALA 71.A O no hydrogen 3.335 N/A GLY 76.A N ILE 73.A O no hydrogen 3.049 N/A THR 77.A N TYR 146.A O no hydrogen 2.887 N/A GLN 78.A NE2 PRO 246.A O no hydrogen 2.988 N/A ARG 79.A NH1 TRP 74.A O no hydrogen 2.973 N/A ALA 80.A N ALA 144.A O no hydrogen 2.806 N/A THR 82.A N ALA 142.A O no hydrogen 2.985 N/A PHE 83.A N GLU 117.A O no hydrogen 2.848 N/A TRP 84.A N VAL 140.A O no hydrogen 2.804 N/A ALA 85.A N GLU 119.A O no hydrogen 3.055 N/A VAL 86.A N MET 138.A O no hydrogen 2.863 N/A ASN 87.A N MET 138.A O no hydrogen 2.948 N/A ASN 87.A ND2 ASP 126.A OD2 no hydrogen 2.688 N/A TYR 89.A N GLN 96.A O no hydrogen 3.018 N/A TYR 89.A OH GLU 51.A OE1 no hydrogen 2.561 N/A SER 90.A OG ASP 135.A OD1 no hydrogen 2.655 N/A TYR 94.A N GLN 96.A OE1 no hydrogen 2.829 N/A GLN 96.A NE2 ILE 52.A O no hydrogen 2.760 N/A TYR 100.A N LEU 97.A O no hydrogen 3.096 N/A PHE 101.A N ALA 98.A O no hydrogen 2.967 N/A ASN 102.A ND2 SER 106.A OG no hydrogen 2.794 N/A GLY 104.A N GLU 119.A OE1 no hydrogen 2.921 N/A GLY 105.A N ASN 102.A O no hydrogen 2.781 N/A TYR 107.A N ASN 102.A OD1 no hydrogen 3.238 N/A TYR 108.A N TYR 100.A O no hydrogen 3.022 N/A TYR 108.A OH PRO 53.A O no hydrogen 2.600 N/A LYS 109.A N GLY 105.A O no hydrogen 2.957 N/A LYS 109.A NZ CYS 116.A O no hydrogen 2.994 N/A GLN 110.A N SER 106.A O no hydrogen 2.990 N/A TYR 111.A N TYR 108.A O no hydrogen 3.151 N/A HIS 112.A N TYR 108.A O no hydrogen 2.733 N/A HIS 112.A NE2 TYR 94.A O no hydrogen 2.614 N/A THR 114.A OG1 VAL 56.A O no hydrogen 2.647 N/A CYS 116.A N THR 114.A OG1 no hydrogen 3.070 N/A GLU 117.A N CYS 81.A O no hydrogen 2.883 N/A GLU 119.A N PHE 83.A O no hydrogen 2.938 N/A ALA 121.A N ALA 85.A O no hydrogen 2.757 N/A HIS 124.A N ALA 121.A O no hydrogen 3.086 N/A HIS 124.A ND1 ASP 255.A OD1 no hydrogen 2.736 N/A SER 125.A N ASP 255.A OD2 no hydrogen 2.745 N/A ALA 127.A N SER 125.A OG no hydrogen 3.372 N/A CYS 129.A N ASP 126.A O no hydrogen 3.168 N/A CYS 129.A SG VAL 137.A O no hydrogen 3.959 N/A TRP 130.A NE1 GLY 277.A O no hydrogen 2.783 N/A THR 134.A OG1 ASP 135.A OD1 no hydrogen 3.422 N/A MET 138.A N ASN 87.A O no hydrogen 2.811 N/A SER 139.A N ILE 49.A O no hydrogen 2.738 N/A SER 139.A OG GLU 51.A O no hydrogen 2.769 N/A VAL 140.A N TRP 84.A O no hydrogen 2.939 N/A PHE 141.A N ALA 47.A O no hydrogen 2.881 N/A ALA 142.A N THR 82.A O no hydrogen 2.988 N/A LEU 143.A N THR 45.A O no hydrogen 2.896 N/A ALA 144.A N ALA 80.A O no hydrogen 2.855 N/A SER 145.A N GLU 43.A O no hydrogen 3.094 N/A SER 145.A OG ILE 73.A O no hydrogen 2.650 N/A TYR 146.A N THR 77.A O no hydrogen 2.822 N/A VAL 147.A N ASP 41.A O no hydrogen 2.990 N/A GLN 148.A NE2 THR 153.A OG1 no hydrogen 3.248 N/A HIS 149.A NE2 GLU 43.A OE2 no hydrogen 2.783 N/A LYS 152.A N HIS 149.A O no hydrogen 2.895 N/A LYS 152.A NZ ASP 41.A OD1 no hydrogen 2.807 N/A LYS 152.A NZ ASP 41.A OD2 no hydrogen 3.157 N/A LYS 152.A NZ VAL 297.A O no hydrogen 2.782 N/A THR 153.A N PRO 150.A O no hydrogen 3.215 N/A THR 153.A OG1 HIS 149.A O no hydrogen 3.164 N/A VAL 154.A N PHE 37.A O no hydrogen 2.810 N/A ARG 155.A N ILE 206.A O no hydrogen 2.938 N/A ARG 155.A NH1 ASP 33.A OD1 no hydrogen 2.710 N/A ARG 155.A NH1 GLY 35.A O no hydrogen 3.075 N/A ARG 155.A NH2 ASP 33.A OD1 no hydrogen 3.486 N/A ARG 155.A NH2 ASP 33.A OD2 no hydrogen 2.889 N/A VAL 156.A N GLY 35.A O no hydrogen 2.981 N/A LYS 157.A N GLU 204.A O no hydrogen 3.016 N/A LYS 157.A NZ GLN 342.A OE1 no hydrogen 2.986 N/A PHE 158.A N VAL 32.A O no hydrogen 2.734 N/A HIS 159.A N LEU 202.A O no hydrogen 2.840 N/A HIS 159.A ND1 SER 29.A OG no hydrogen 2.669 N/A HIS 159.A NE2 GLU 204.A OE1 no hydrogen 2.749 N/A THR 160.A N LYS 30.A O no hydrogen 2.998 N/A THR 160.A OG1 LYS 30.A O no hydrogen 2.771 N/A THR 162.A OG1.A GLY 200.A O no hydrogen 3.031 N/A THR 162.A OG1.B GLY 200.A O no hydrogen 2.484 N/A ARG 163.A N GLU 28.A O no hydrogen 2.804 N/A ARG 163.A NH1 THR 162.A O no hydrogen 3.101 N/A ARG 163.A NH2 GLU 161.A OE1 no hydrogen 3.083 N/A THR 164.A N ASP 198.A OD1 no hydrogen 3.004 N/A VAL 165.A N ARG 26.A O no hydrogen 2.766 N/A TRP 166.A N VAL 177.A O no hydrogen 2.862 N/A GLN 167.A N GLY 24.A O no hydrogen 2.891 N/A LEU 168.A N CYS 175.A O no hydrogen 2.780 N/A SER 169.A N ARG 21.A O no hydrogen 2.965 N/A VAL 170.A N VAL 173.A O no hydrogen 2.784 N/A ALA 171.A N PRO 19.A O no hydrogen 2.904 N/A VAL 173.A N VAL 170.A O no hydrogen 2.903 N/A CYS 175.A N LEU 168.A O no hydrogen 2.946 N/A CYS 175.A SG PHE 183.A O no hydrogen 3.551 N/A VAL 177.A N TRP 166.A O no hydrogen 2.985 N/A THR 178.A N HIS 181.A O no hydrogen 3.207 N/A THR 179.A OG1 ASP 198.A OD2 no hydrogen 2.633 N/A GLU 180.A N THR 178.A OG1 no hydrogen 3.107 N/A HIS 181.A N THR 178.A OG1 no hydrogen 2.976 N/A CYS 184.A N LEU 191.A O no hydrogen 2.817 N/A THR 186.A N GLY 189.A O no hydrogen 2.928 N/A GLN 190.A N LYS 323.A O no hydrogen 3.016 N/A LEU 191.A N CYS 184.A O no hydrogen 2.723 N/A GLU 192.A N LYS 321.A O no hydrogen 2.875 N/A VAL 193.A N PRO 182.A O no hydrogen 2.850 N/A GLN 194.A N GLY 319.A O no hydrogen 2.727 N/A LEU 202.A N HIS 159.A O no hydrogen 2.974 N/A VAL 203.A N GLY 215.A O no hydrogen 2.863 N/A GLU 204.A N LYS 157.A O no hydrogen 2.845 N/A TYR 205.A N ARG 213.A O no hydrogen 2.793 N/A TYR 205.A OH SER 228.A OG no hydrogen 3.017 N/A ILE 206.A N ARG 155.A O no hydrogen 2.734 N/A MET 207.A N GLN 211.A O no hydrogen 3.085 N/A GLN 210.A N ASN 209.A O no hydrogen 2.273 N/A GLN 211.A N MET 207.A O no hydrogen 2.981 N/A SER 212.A OG GLU 204.A OE2 no hydrogen 2.656 N/A ARG 213.A N TYR 205.A O no hydrogen 2.812 N/A ARG 213.A NE THR 307.A OG1 no hydrogen 2.896 N/A ARG 213.A NH2 THR 307.A O no hydrogen 3.033 N/A TRP 214.A N THR 308.A O no hydrogen 2.842 N/A GLY 215.A N VAL 203.A O no hydrogen 2.793 N/A GLY 217.A N ASP 201.A O no hydrogen 2.897 N/A HIS 222.A N ASN 220.A OD1 no hydrogen 2.957 N/A GLY 223.A N ASN 220.A O no hydrogen 3.380 N/A TRP 226.A N GLY 223.A O no hydrogen 3.063 N/A SER 228.A N ASP 225.A O no hydrogen 2.998 N/A SER 228.A OG TYR 205.A OH no hydrogen 3.017 N/A VAL 230.A N SER 228.A OG no hydrogen 3.235 N/A CYS 231.A N SER 228.A O no hydrogen 2.922 N/A CYS 231.A SG ASP 225.A O no hydrogen 3.926 N/A GLN 232.A N PRO 229.A O no hydrogen 2.942 N/A GLN 232.A NE2 SER 228.A O no hydrogen 3.572 N/A ARG 233.A N ALA 38.A O no hydrogen 2.987 N/A ARG 233.A NH2 THR 77.A OG1 no hydrogen 2.841 N/A HIS 234.A NE2 GLY 34.A O no hydrogen 2.754 N/A SER 235.A N CYS 36.A O no hydrogen 2.837 N/A SER 235.A OG.A ASP 237.A OD1 no hydrogen 3.531 N/A SER 235.A OG.A ARG 240.A O no hydrogen 2.875 N/A SER 235.A OG.B CYS 36.A O no hydrogen 3.202 N/A CYS 238.A N SER 235.A O no hydrogen 3.184 N/A SER 239.A N SER 235.A OG.A no hydrogen 2.802 N/A SER 239.A N ASP 237.A OD1 no hydrogen 3.247 N/A ARG 240.A N ASP 237.A OD1 no hydrogen 2.790 N/A ARG 240.A NE ASP 237.A OD2 no hydrogen 2.886 N/A ARG 240.A NH2 ASP 237.A OD2 no hydrogen 3.261 N/A VAL 242.A N HIS 234.A O no hydrogen 3.121 N/A THR 245.A OG1 GLY 243.A O no hydrogen 3.078 N/A ARG 248.A NH1 ARG 79.A O no hydrogen 2.782 N/A ARG 250.A N GLY 268.A O no hydrogen 2.973 N/A ARG 252.A N VAL 270.A O no hydrogen 2.891 N/A VAL 254.A N VAL 272.A O no hydrogen 2.861 N/A ASP 258.A N ASP 255.A O no hydrogen 3.000 N/A LEU 260.A N ASP 258.A OD1 no hydrogen 2.992 N/A LEU 261.A N ASP 258.A O no hydrogen 3.030 N/A ARG 262.A N PRO 259.A O no hydrogen 3.044 N/A THR 263.A N LEU 260.A O no hydrogen 2.975 N/A THR 263.A OG1 LEU 260.A O no hydrogen 2.670 N/A GLY 266.A N GLU 269.A OE1 no hydrogen 2.763 N/A GLY 268.A N GLY 290.A O no hydrogen 2.830 N/A GLU 269.A N GLY 266.A O no hydrogen 3.023 N/A VAL 270.A N ARG 250.A O no hydrogen 2.941 N/A TRP 271.A N ARG 288.A O no hydrogen 2.802 N/A VAL 272.A N ARG 252.A O no hydrogen 2.890 N/A THR 273.A N HIS 286.A O no hydrogen 2.788 N/A THR 273.A OG1 VAL 254.A O no hydrogen 2.677 N/A VAL 275.A N GLY 284.A O no hydrogen 2.752 N/A GLY 277.A N ALA 128.A O no hydrogen 3.316 N/A ARG 281.A N TRP 130.A O no hydrogen 2.748 N/A ARG 281.A NH1 GLY 131.A O no hydrogen 2.975 N/A GLY 284.A N VAL 275.A O no hydrogen 2.913 N/A HIS 286.A N THR 273.A O no hydrogen 2.816 N/A ARG 288.A N TRP 271.A O no hydrogen 2.875 N/A GLY 290.A N GLU 269.A O no hydrogen 2.929 N/A HIS 294.A N PRO 291.A O no hydrogen 3.139 N/A GLU 301.A N GLU 301.A OE1 no hydrogen 2.803 N/A TRP 302.A N GLU 298.A O no hydrogen 2.815 N/A ILE 303.A N MET 299.A O no hydrogen 2.971 N/A HIS 304.A N PRO 300.A O no hydrogen 2.956 N/A ALA 305.A N GLU 301.A O no hydrogen 3.245 N/A HIS 306.A N TRP 302.A O no hydrogen 2.858 N/A HIS 306.A ND1 ASP 225.A OD1 no hydrogen 2.728 N/A THR 307.A OG1 ILE 303.A O no hydrogen 2.525 N/A THR 308.A N TRP 214.A O no hydrogen 2.923 N/A THR 308.A OG1 TRP 214.A O no hydrogen 3.460 N/A THR 308.A OG1 ASP 310.A O no hydrogen 2.698 N/A SER 309.A OG ASP 310.A OD2 no hydrogen 3.124 N/A HIS 313.A ND1 PRO 314.A O no hydrogen 2.800 N/A LEU 318.A N LEU 6.A O no hydrogen 2.874 N/A GLY 319.A N GLN 194.A O no hydrogen 2.897 N/A LEU 320.A N THR 4.A O no hydrogen 2.805 N/A LYS 321.A N GLU 192.A O no hydrogen 2.892 N/A PHE 322.A N ALA 2.A O no hydrogen 2.824 N/A LYS 323.A N GLN 190.A O no hydrogen 2.856 N/A LYS 323.A NZ GLU 192.A OE1 no hydrogen 2.667 N/A ARG 326.A NH2 PRO 187.A O no hydrogen 3.567 N/A ARG 333.A N LEU 352.A O no hydrogen 2.824 N/A ARG 336.A N GLU 350.A O no hydrogen 2.796 N/A VAL 337.A N SER 400.A O no hydrogen 2.859 N/A THR 338.A N LEU 348.A O no hydrogen 2.913 N/A GLY 339.A N ARG 402.A O no hydrogen 3.114 N/A CYS 340.A SG THR 345.A O no hydrogen 4.027 N/A TYR 341.A N ILE 404.A O no hydrogen 3.324 N/A GLN 342.A N LEU 382.A O no hydrogen 2.803 N/A GLN 342.A NE2 ASN 383.A O no hydrogen 2.766 N/A CYS 343.A SG THR 345.A O no hydrogen 3.536 N/A ALA 347.A N ALA 380.A O no hydrogen 2.734 N/A LEU 348.A N THR 338.A O no hydrogen 2.779 N/A VAL 349.A N THR 378.A O no hydrogen 2.819 N/A GLU 350.A N ARG 336.A O no hydrogen 2.992 N/A GLY 351.A N PHE 376.A O no hydrogen 3.127 N/A LEU 352.A N ARG 333.A O no hydrogen 2.757 N/A ALA 353.A N GLY 374.A O no hydrogen 2.736 N/A CYS 359.A N PHE 371.A O no hydrogen 2.801 N/A LEU 361.A N GLY 369.A O no hydrogen 2.963 N/A THR 362.A N SER 391.A O no hydrogen 3.000 N/A VAL 363.A N GLU 366.A O.A no hydrogen 2.989 N/A VAL 363.A N GLU 366.A O.B no hydrogen 2.980 N/A ASN 364.A N GLN 389.A O no hydrogen 2.820 N/A ASN 364.A ND2 THR 384.A OG1 no hydrogen 3.100 N/A ASN 364.A ND2 PRO 387.A O no hydrogen 3.026 N/A GLU 366.A N.A VAL 363.A O no hydrogen 2.949 N/A GLU 366.A N.B VAL 363.A O no hydrogen 2.948 N/A VAL 368.A N LEU 361.A O no hydrogen 3.122 N/A GLY 369.A N ASP 367.A OD1 no hydrogen 3.051 N/A PHE 371.A N CYS 359.A O no hydrogen 2.943 N/A GLY 374.A N ALA 353.A O no hydrogen 2.871 N/A PHE 376.A N GLY 351.A O no hydrogen 2.931 N/A THR 378.A N VAL 349.A O no hydrogen 2.849 N/A ALA 380.A N ALA 347.A O no hydrogen 2.843 N/A ASN 383.A N GLU 366.A OE1.A no hydrogen 2.704 N/A ASN 383.A N GLU 366.A OE1.B no hydrogen 2.729 N/A ASN 383.A ND2 SER 29.A O no hydrogen 2.780 N/A ASN 383.A ND2 GLU 366.A OE2.A no hydrogen 3.354 N/A THR 384.A OG1 GLU 366.A OE2.B no hydrogen 2.688 N/A TYR 388.A OH THR 384.A O no hydrogen 2.710 N/A GLN 389.A N ASN 364.A OD1 no hydrogen 2.835 N/A VAL 390.A N ASP 397.A O no hydrogen 2.818 N/A SER 391.A N THR 362.A O no hydrogen 3.210 N/A SER 391.A OG GLY 394.A O no hydrogen 3.218 N/A SER 391.A OG GLU 395.A O no hydrogen 3.384 N/A CYS 392.A SG ALA 330.A O no hydrogen 3.385 N/A GLY 393.A N SER 391.A OG no hydrogen 3.008 N/A ASP 397.A N VAL 390.A O no hydrogen 2.935 N/A ALA 399.A N TYR 388.A O no hydrogen 2.913 N/A SER 400.A N VAL 335.A O no hydrogen 2.806 N/A ARG 402.A N VAL 337.A O no hydrogen 2.942 N/A ILE 404.A N GLY 339.A O no hydrogen 2.928 N/A ALA 408.A N ASP 405.A OD1 no hydrogen 2.859 N/A GLN 409.A N ASP 405.A O no hydrogen 2.950 N/A SER 410.A N PRO 406.A O no hydrogen 3.019 N/A SER 410.A OG PRO 406.A O no hydrogen 2.812 N/A PHE 411.A N ALA 408.A O no hydrogen 3.115 N/A THR 412.A N GLN 409.A O no hydrogen 3.076 N/A THR 412.A OG1 ALA 408.A O no hydrogen 2.633 N/A TYR 416.A OH LEU 241.A O no hydrogen 2.665 N/A