Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1suj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N ASP 352.A O no hydrogen 2.889 N/A LYS 2.A NZ GLU 356.A OE1 no hydrogen 2.960 N/A VAL 3.A N ILE 354.A O no hydrogen 3.069 N/A TYR 4.A N LEU 17.A O no hydrogen 2.781 N/A LYS 5.A N GLU 356.A O no hydrogen 2.992 N/A LYS 5.A NZ THR 7.A OG1 no hydrogen 3.124 N/A LYS 6.A N ILE 15.A O no hydrogen 3.000 N/A LYS 6.A NZ GLN 158.A O no hydrogen 2.975 N/A CYS 8.A N LEU 13.A O no hydrogen 2.809 N/A CYS 8.A SG ASN 10.A OD1 no hydrogen 2.974 N/A CYS 8.A SG LEU 13.A O no hydrogen 3.375 N/A CYS 8.A SG ARG 154.A O no hydrogen 4.013 N/A ASN 10.A N ARG 154.A O no hydrogen 3.415 N/A ALA 11.A N CYS 8.A O no hydrogen 2.943 N/A LYS 12.A N ASN 10.A OD1 no hydrogen 2.942 N/A LYS 12.A NZ ASP 39.A OD2 no hydrogen 3.212 N/A SER 14.A N LEU 37.A O no hydrogen 3.344 N/A ILE 15.A N LYS 6.A O no hydrogen 2.827 N/A TYR 16.A N VAL 35.A O no hydrogen 2.818 N/A LEU 17.A N TYR 4.A O no hydrogen 2.850 N/A ARG 20.A NE PHE 358.A O no hydrogen 2.636 N/A ARG 20.A NH2 GLU 356.A OE2 no hydrogen 3.217 N/A ARG 20.A NH2 GLU 357.A O no hydrogen 3.114 N/A ARG 20.A NH2 PHE 358.A O no hydrogen 3.133 N/A PHE 22.A N ARG 162.A O no hydrogen 2.795 N/A ASP 24.A N VAL 164.A O no hydrogen 2.611 N/A HIS 25.A N HIS 28.A O no hydrogen 3.029 N/A GLU 30.A N VAL 23.A O no hydrogen 3.134 N/A VAL 32.A N PHE 110.A O no hydrogen 2.679 N/A ASP 33.A N ASP 33.A OD1 no hydrogen 2.649 N/A GLY 34.A N PHE 108.A O no hydrogen 3.122 N/A VAL 35.A N TYR 16.A O no hydrogen 3.149 N/A VAL 36.A N TYR 106.A O no hydrogen 2.933 N/A LEU 37.A N SER 14.A O no hydrogen 2.932 N/A ILE 38.A N HIS 104.A O no hydrogen 2.674 N/A TYR 42.A N ASP 39.A OD1 no hydrogen 2.965 N/A LEU 43.A N ASP 39.A O no hydrogen 2.726 N/A LYS 44.A N TYR 42.A O no hydrogen 2.593 N/A ARG 46.A NH1 TYR 42.A O no hydrogen 3.458 N/A LYS 47.A N ALA 144.A O no hydrogen 3.052 N/A LYS 47.A NZ GLU 145.A O no hydrogen 2.914 N/A VAL 48.A N TYR 82.A O no hydrogen 2.693 N/A PHE 49.A N PHE 142.A O no hydrogen 2.991 N/A VAL 50.A N THR 79.A O no hydrogen 2.868 N/A THR 51.A N LYS 140.A O no hydrogen 2.804 N/A LEU 52.A N LEU 77.A O no hydrogen 2.761 N/A THR 53.A N GLU 138.A O no hydrogen 2.771 N/A CYS 54.A N TYR 75.A O no hydrogen 2.689 N/A CYS 54.A SG ASP 136.A O no hydrogen 3.932 N/A ALA 55.A N ASP 136.A O no hydrogen 2.861 N/A PHE 56.A N LYS 72.A O no hydrogen 2.920 N/A ARG 57.A N GLY 134.A O no hydrogen 2.881 N/A ARG 57.A NE ASP 136.A OD2 no hydrogen 3.521 N/A TYR 58.A N PHE 70.A O no hydrogen 2.867 N/A TYR 58.A OH ASP 240.A OD2 no hydrogen 2.551 N/A GLY 59.A N SER 132.A O no hydrogen 2.647 N/A PHE 70.A N TYR 58.A O no hydrogen 3.012 N/A ARG 71.A NH1 ASP 73.A OD1 no hydrogen 2.498 N/A LYS 72.A N PHE 56.A O no hydrogen 2.943 N/A LEU 74.A N CYS 54.A O no hydrogen 2.914 N/A LEU 77.A N LEU 52.A O no hydrogen 2.810 N/A THR 79.A N VAL 50.A O no hydrogen 2.985 N/A GLN 80.A NE2 PRO 83.A O no hydrogen 2.761 N/A VAL 81.A N VAL 48.A O no hydrogen 2.807 N/A TYR 82.A N VAL 48.A O no hydrogen 3.181 N/A THR 91.A N GLN 94.A OE1 no hydrogen 2.783 N/A THR 91.A OG1 ASP 33.A OD2 no hydrogen 2.735 N/A GLN 94.A N THR 91.A OG1 no hydrogen 3.368 N/A GLN 94.A NE2 GLY 34.A O no hydrogen 3.133 N/A GLU 95.A N THR 91.A O no hydrogen 2.862 N/A LYS 96.A N PRO 92.A O no hydrogen 3.134 N/A LEU 97.A N LEU 93.A O no hydrogen 2.900 N/A MET 98.A N GLN 94.A O no hydrogen 3.092 N/A LYS 99.A N GLU 95.A O no hydrogen 3.103 N/A LYS 100.A N LYS 96.A O no hydrogen 2.894 N/A LYS 100.A N LEU 97.A O no hydrogen 3.242 N/A LEU 101.A N LEU 97.A O no hydrogen 2.698 N/A GLY 102.A N MET 98.A O no hydrogen 3.228 N/A TYR 106.A N VAL 36.A O no hydrogen 2.853 N/A PHE 108.A N GLY 34.A O no hydrogen 3.146 N/A PHE 110.A N VAL 32.A O no hydrogen 2.785 N/A GLY 113.A N TYR 75.A OH no hydrogen 3.304 N/A ASN 115.A ND2 THR 114.A OG1 no hydrogen 3.080 N/A CYS 118.A SG GLN 165.A OE1 no hydrogen 3.297 N/A SER 119.A N LYS 163.A O no hydrogen 3.055 N/A VAL 120.A N VAL 135.A O no hydrogen 3.210 N/A THR 121.A N LEU 282.A O no hydrogen 2.720 N/A LEU 122.A N CYS 133.A O no hydrogen 2.945 N/A GLY 125.A N ASP 128.A OD2 no hydrogen 2.897 N/A ASP 128.A N GLY 125.A O no hydrogen 2.896 N/A LYS 131.A N TYR 58.A OH no hydrogen 3.123 N/A CYS 133.A N LEU 122.A O no hydrogen 3.146 N/A GLY 134.A N ARG 57.A O no hydrogen 2.999 N/A VAL 135.A N VAL 120.A O no hydrogen 2.679 N/A ASP 136.A N ALA 55.A O no hydrogen 2.787 N/A GLU 138.A N THR 53.A O no hydrogen 2.825 N/A VAL 139.A N LEU 159.A O no hydrogen 2.620 N/A LYS 140.A N THR 51.A O no hydrogen 2.872 N/A ALA 141.A N VAL 157.A O no hydrogen 2.980 N/A PHE 142.A N PHE 49.A O no hydrogen 3.084 N/A CYS 143.A N ASN 155.A O no hydrogen 3.411 N/A CYS 143.A SG ASN 155.A O no hydrogen 3.947 N/A ALA 144.A N LYS 47.A O no hydrogen 2.961 N/A GLU 145.A N GLU 149.A OE1 no hydrogen 2.357 N/A GLU 149.A N ASN 146.A O no hydrogen 3.204 N/A GLU 149.A N ASN 146.A OD1 no hydrogen 3.043 N/A ASN 155.A ND2 TYR 42.A OH no hydrogen 3.329 N/A SER 156.A OG HIS 152.A O no hydrogen 3.029 N/A VAL 157.A N ALA 141.A O no hydrogen 2.881 N/A LEU 159.A N VAL 139.A O no hydrogen 2.703 N/A ILE 161.A N PHE 137.A O no hydrogen 3.007 N/A ARG 162.A N ARG 20.A O no hydrogen 3.172 N/A ARG 162.A NE ASP 21.A OD1 no hydrogen 2.660 N/A ARG 162.A NH1 ASP 283.A OD1 no hydrogen 3.103 N/A ARG 162.A NH1 ASP 290.A O no hydrogen 2.695 N/A ARG 162.A NH2 ASP 21.A OD1 no hydrogen 3.011 N/A ARG 162.A NH2 ASP 21.A OD2 no hydrogen 2.588 N/A ARG 162.A NH2 ASP 290.A O no hydrogen 3.542 N/A LYS 163.A N SER 119.A OG no hydrogen 3.053 N/A LYS 163.A NZ ASP 24.A OD2 no hydrogen 2.654 N/A LYS 163.A NZ LEU 116.A O no hydrogen 2.984 N/A VAL 164.A N PHE 22.A O no hydrogen 2.967 N/A GLN 165.A NE2 ASP 24.A OD1 no hydrogen 3.228 N/A GLN 165.A NE2 HIS 25.A O no hydrogen 2.865 N/A GLN 165.A NE2 PHE 166.A O no hydrogen 3.152 N/A PHE 166.A N ASP 24.A O no hydrogen 2.864 N/A ILE 179.A N ALA 194.A O no hydrogen 2.781 N/A ARG 181.A N LEU 192.A O no hydrogen 3.098 N/A ARG 181.A NH1 THR 180.A O no hydrogen 3.228 N/A PHE 183.A N LEU 190.A O no hydrogen 2.976 N/A LEU 185.A N ARG 188.A O no hydrogen 2.975 N/A ARG 188.A N LEU 185.A O no hydrogen 3.226 N/A ARG 188.A NE THR 216.A O no hydrogen 2.974 N/A ARG 188.A NH2 THR 216.A O no hydrogen 2.694 N/A LEU 190.A N PHE 183.A O no hydrogen 2.940 N/A HIS 191.A N ASN 214.A O no hydrogen 2.926 N/A LEU 192.A N ARG 181.A O no hydrogen 3.101 N/A GLU 193.A N LYS 212.A O no hydrogen 2.705 N/A ALA 194.A N ILE 179.A O no hydrogen 2.776 N/A SER 195.A N ASN 210.A O no hydrogen 2.991 N/A SER 195.A OG ASN 210.A OD1 no hydrogen 3.080 N/A LEU 196.A N THR 177.A O no hydrogen 2.893 N/A ASP 197.A N ASP 197.A OD1 no hydrogen 2.529 N/A LYS 198.A N TYR 201.A OH no hydrogen 2.891 N/A TYR 201.A N THR 343.A O no hydrogen 2.957 N/A TYR 201.A OH ASP 197.A OD1 no hydrogen 2.540 N/A HIS 203.A N MET 345.A O no hydrogen 3.124 N/A HIS 203.A ND1 HIS 346.A ND1 no hydrogen 2.894 N/A GLU 205.A N TYR 202.A O no hydrogen 2.912 N/A ILE 207.A N VAL 267.A O no hydrogen 2.726 N/A VAL 209.A N PHE 265.A O no hydrogen 2.725 N/A ASN 210.A N SER 195.A O no hydrogen 2.908 N/A ASN 210.A ND2 THR 264.A OG1 no hydrogen 2.727 N/A VAL 211.A N LYS 263.A O no hydrogen 2.789 N/A LYS 212.A N GLU 193.A O no hydrogen 2.885 N/A ILE 213.A N LEU 261.A O no hydrogen 2.775 N/A ASN 214.A N HIS 191.A O no hydrogen 3.029 N/A ASN 215.A N SER 259.A O no hydrogen 2.921 N/A ASN 215.A ND2 LYS 219.A O no hydrogen 2.930 N/A ASN 215.A ND2 VAL 255.A O no hydrogen 3.291 N/A THR 216.A N PRO 189.A O no hydrogen 3.122 N/A THR 216.A OG1 PRO 189.A O no hydrogen 2.591 N/A THR 217.A N ASN 215.A OD1 no hydrogen 2.800 N/A THR 217.A OG1 ASN 215.A OD1 no hydrogen 2.708 N/A THR 217.A OG1 LYS 219.A O no hydrogen 3.531 N/A LYS 219.A N THR 217.A OG1 no hydrogen 2.905 N/A LYS 219.A NZ SER 186.A OG no hydrogen 3.239 N/A VAL 221.A N VAL 255.A O no hydrogen 3.129 N/A LYS 222.A N VAL 321.A O no hydrogen 2.895 N/A LYS 222.A NZ ILE 327.A O no hydrogen 3.520 N/A LYS 223.A NZ GLU 250.A OE2 no hydrogen 2.719 N/A LYS 225.A N HIS 319.A O no hydrogen 2.719 N/A ILE 226.A N GLU 249.A O no hydrogen 3.232 N/A ILE 227.A N LYS 317.A O no hydrogen 2.965 N/A VAL 228.A N CYS 247.A O no hydrogen 2.844 N/A GLU 229.A N LYS 315.A O no hydrogen 2.722 N/A GLN 230.A N LYS 244.A O no hydrogen 2.632 N/A GLN 230.A NE2 ALA 281.A O no hydrogen 3.022 N/A GLN 230.A NE2 TYR 314.A OH no hydrogen 2.962 N/A VAL 231.A N SER 313.A O no hydrogen 2.877 N/A THR 232.A N TYR 242.A O no hydrogen 2.751 N/A ASP 233.A N LEU 311.A O no hydrogen 2.742 N/A VAL 234.A N ASP 240.A O no hydrogen 3.050 N/A VAL 235.A N GLY 309.A O no hydrogen 2.941 N/A SER 238.A OG ASP 240.A OD1 no hydrogen 2.488 N/A ASP 240.A N SER 238.A O no hydrogen 2.814 N/A TYR 242.A N THR 232.A O no hydrogen 2.932 N/A LYS 244.A N GLN 230.A O no hydrogen 2.801 N/A LYS 244.A NZ ASP 128.A OD1 no hydrogen 2.678 N/A LYS 244.A NZ ASP 128.A OD2 no hydrogen 3.061 N/A LYS 244.A NZ GLY 279.A O no hydrogen 3.562 N/A VAL 246.A N VAL 228.A O no hydrogen 2.788 N/A GLU 249.A N ILE 226.A O no hydrogen 2.772 N/A THR 251.A N ILE 224.A O no hydrogen 3.316 N/A THR 251.A OG1 ASP 253.A OD1 no hydrogen 3.011 N/A ASN 252.A N THR 251.A OG1 no hydrogen 2.721 N/A VAL 255.A N VAL 221.A O no hydrogen 2.882 N/A ASN 258.A N THR 217.A O no hydrogen 3.326 N/A SER 259.A N ASN 215.A O no hydrogen 3.086 N/A SER 259.A OG ALA 257.A O no hydrogen 2.868 N/A LEU 261.A N ILE 213.A O no hydrogen 2.738 N/A LYS 263.A N VAL 211.A O no hydrogen 2.877 N/A LYS 263.A NZ ASP 253.A OD1 no hydrogen 2.454 N/A PHE 265.A N VAL 209.A O no hydrogen 2.830 N/A SER 266.A OG ASN 208.A OD1 no hydrogen 2.567 N/A VAL 267.A N ILE 207.A O no hydrogen 2.918 N/A ASN 273.A N MET 270.A O no hydrogen 2.793 N/A ASN 274.A N LEU 271.A O no hydrogen 3.147 N/A ASN 274.A ND2 VAL 246.A O no hydrogen 3.105 N/A ASN 274.A ND2 MET 270.A O no hydrogen 3.068 N/A LYS 277.A NZ LEU 271.A O no hydrogen 2.888 N/A LYS 277.A NZ ASN 274.A O no hydrogen 3.275 N/A ARG 278.A N GLU 276.A OE1 no hydrogen 3.140 N/A ARG 278.A NE GLU 276.A OE1 no hydrogen 3.103 N/A ARG 278.A NH2 GLU 276.A OE2 no hydrogen 2.574 N/A GLY 279.A N GLN 123.A O no hydrogen 2.708 N/A LEU 280.A N LYS 277.A O no hydrogen 3.430 N/A ALA 281.A N GLN 230.A OE1 no hydrogen 2.699 N/A LEU 282.A N THR 121.A O no hydrogen 2.839 N/A ASP 283.A N ASN 292.A O no hydrogen 2.966 N/A HIS 288.A N LYS 285.A O no hydrogen 3.138 N/A GLU 289.A N GLN 361.A O no hydrogen 3.364 N/A THR 291.A OG1 LYS 285.A O no hydrogen 2.778 N/A ASN 292.A N ASP 283.A OD1 no hydrogen 2.903 N/A ASN 292.A ND2 ASP 283.A OD2 no hydrogen 2.945 N/A ALA 294.A N ALA 281.A O no hydrogen 2.872 N/A THR 296.A N LEU 344.A O no hydrogen 2.758 N/A THR 296.A OG1 LEU 342.A O no hydrogen 3.566 N/A THR 296.A OG1 LEU 344.A O no hydrogen 3.470 N/A THR 297.A N VAL 312.A O no hydrogen 2.750 N/A THR 297.A OG1 ILE 310.A O no hydrogen 3.515 N/A GLU 306.A N ASP 304.A OD1 no hydrogen 2.752 N/A VAL 307.A N ASP 304.A O no hydrogen 3.414 N/A LEU 308.A N LYS 305.A O no hydrogen 3.089 N/A GLY 309.A N GLU 306.A O no hydrogen 3.067 N/A ILE 310.A N LEU 308.A O no hydrogen 2.748 N/A LEU 311.A N ASP 233.A O no hydrogen 2.716 N/A VAL 312.A N THR 297.A OG1 no hydrogen 2.859 N/A SER 313.A N VAL 231.A O no hydrogen 3.011 N/A TYR 314.A OH ALA 294.A O no hydrogen 2.484 N/A LYS 315.A N GLU 229.A O no hydrogen 2.925 N/A LYS 315.A NZ GLU 339.A OE2 no hydrogen 3.197 N/A VAL 316.A N LEU 340.A O no hydrogen 2.886 N/A LYS 317.A N ILE 227.A O no hydrogen 2.841 N/A LYS 317.A NZ GLU 229.A OE1 no hydrogen 3.002 N/A LYS 317.A NZ GLU 229.A OE2 no hydrogen 2.844 N/A VAL 318.A N VAL 338.A O no hydrogen 3.057 N/A HIS 319.A N LYS 225.A O no hydrogen 2.853 N/A HIS 319.A ND1 ASP 335.A OD1 no hydrogen 2.905 N/A LEU 320.A N VAL 336.A O no hydrogen 2.914 N/A VAL 321.A N LYS 223.A O no hydrogen 2.964 N/A VAL 322.A N SER 334.A O no hydrogen 2.774 N/A ALA 323.A N ILE 220.A O no hydrogen 3.194 N/A GLY 326.A N ALA 323.A O no hydrogen 3.047 N/A SER 334.A N VAL 322.A O no hydrogen 2.591 N/A SER 334.A OG VAL 322.A O no hydrogen 3.295 N/A VAL 336.A N LEU 320.A O no hydrogen 3.175 N/A VAL 338.A N VAL 318.A O no hydrogen 3.245 N/A LEU 340.A N VAL 316.A O no hydrogen 3.009 N/A LEU 342.A N TYR 314.A O no hydrogen 2.941 N/A LEU 344.A N THR 296.A OG1 no hydrogen 2.762 N/A MET 345.A N TYR 201.A O no hydrogen 2.842 N/A HIS 346.A N GLN 165.A O no hydrogen 2.761 N/A HIS 346.A ND1 HIS 203.A ND1 no hydrogen 2.894 N/A LYS 348.A NZ PRO 349.A O no hydrogen 3.212 N/A ILE 354.A N SER 1.A O no hydrogen 2.791 N/A GLU 356.A N VAL 3.A O no hydrogen 2.865 N/A PHE 358.A N LYS 5.A O no hydrogen 3.027 N/A ARG 360.A NH1 ASP 21.A OD1 no hydrogen 3.034 N/A ARG 360.A NH1 ASP 290.A OD2 no hydrogen 2.571 N/A ARG 360.A NH2 ARG 20.A O no hydrogen 3.273 N/A ARG 360.A NH2 ASP 21.A OD1 no hydrogen 3.146 N/A ARG 360.A NH2 VAL 160.A O no hydrogen 3.529 N/A