Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3j0c_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 5.A N THR 2.A O no hydrogen 3.176 N/A PHE 6.A N THR 2.A O no hydrogen 2.989 N/A ASN 7.A N GLU 3.A O no hydrogen 2.978 N/A GLU 8.A N GLU 8.A OE1 no hydrogen 2.599 N/A TYR 9.A OH ASP 56.A O no hydrogen 2.721 N/A LYS 10.A N ASN 7.A O no hydrogen 3.311 N/A LEU 11.A N GLU 8.A O no hydrogen 2.631 N/A THR 12.A N GLU 8.A O no hydrogen 2.716 N/A THR 12.A N TYR 9.A O no hydrogen 3.289 N/A THR 12.A OG1 GLU 8.A O no hydrogen 3.179 N/A THR 12.A OG1 TYR 9.A O no hydrogen 3.049 N/A THR 12.A OG1 GLN 52.A OE1 no hydrogen 3.000 N/A ARG 13.A N GLN 52.A OE1 no hydrogen 3.089 N/A ARG 13.A NH1 GLN 232.A OE1 no hydrogen 2.944 N/A TYR 15.A N SER 50.A O no hydrogen 2.928 N/A TYR 15.A OH GLU 34.A OE1 no hydrogen 2.854 N/A ALA 17.A N SER 29.A O no hydrogen 2.909 N/A ARG 18.A NH1 SER 26.A OG no hydrogen 2.776 N/A CYS 19.A N CYS 27.A O no hydrogen 2.892 N/A ARG 21.A NH1 ILE 20.A O no hydrogen 2.879 N/A CYS 22.A N GLY 25.A O no hydrogen 2.925 N/A CYS 22.A SG CYS 19.A O no hydrogen 3.872 N/A CYS 22.A SG CYS 27.A O no hydrogen 3.839 N/A CYS 27.A SG HIS 121.A NE2 no hydrogen 3.578 N/A ILE 31.A N SER 29.A OG no hydrogen 3.063 N/A ALA 32.A N SER 29.A O no hydrogen 3.249 N/A GLU 34.A N GLN 48.A O no hydrogen 2.626 N/A ALA 35.A N GLN 48.A O no hydrogen 2.997 N/A LYS 37.A N ARG 46.A O no hydrogen 2.833 N/A ASP 39.A N TYR 154.A OH no hydrogen 2.841 N/A HIS 41.A N GLN 152.A O no hydrogen 2.801 N/A TYR 44.A N ASP 42.A OD1 no hydrogen 2.932 N/A VAL 45.A N ALA 102.A O no hydrogen 2.796 N/A ARG 46.A N LYS 37.A O no hydrogen 2.855 N/A ARG 46.A NH1 PHE 259.A O no hydrogen 2.798 N/A LEU 47.A N LEU 100.A O no hydrogen 2.836 N/A GLN 48.A N ALA 35.A O no hydrogen 2.815 N/A THR 49.A N TYR 98.A O no hydrogen 2.903 N/A THR 49.A OG1 SER 51.A O no hydrogen 2.725 N/A THR 49.A OG1 TYR 98.A O no hydrogen 3.201 N/A SER 50.A N ALA 32.A O no hydrogen 2.987 N/A SER 50.A OG TYR 15.A O no hydrogen 2.802 N/A SER 50.A OG PRO 30.A O no hydrogen 2.746 N/A SER 50.A OG ALA 32.A O no hydrogen 3.301 N/A SER 51.A OG PRO 30.A O no hydrogen 3.532 N/A GLN 52.A N ARG 67.A O no hydrogen 3.176 N/A GLN 52.A NE2 THR 12.A OG1 no hydrogen 2.837 N/A TYR 53.A N GLY 97.A O no hydrogen 2.953 N/A TYR 53.A OH ASP 94.A O no hydrogen 3.369 N/A GLY 54.A N THR 65.A O no hydrogen 3.513 N/A ASP 56.A N ASN 60.A O no hydrogen 2.907 N/A SER 57.A OG GLU 76.A OE2 no hydrogen 3.541 N/A SER 58.A N ASP 56.A OD1 no hydrogen 2.849 N/A SER 58.A OG ASP 56.A OD1 no hydrogen 2.757 N/A SER 58.A OG ASP 56.A OD2 no hydrogen 3.387 N/A GLY 59.A N ASP 56.A O no hydrogen 2.875 N/A ASN 60.A N ASP 56.A OD1 no hydrogen 2.861 N/A LYS 62.A N GLY 54.A O no hydrogen 2.767 N/A THR 65.A N LYS 62.A O no hydrogen 3.346 N/A THR 65.A OG1 LYS 62.A O no hydrogen 3.246 N/A MET 66.A N ILE 77.A O no hydrogen 2.737 N/A ARG 67.A N GLN 52.A O no hydrogen 2.789 N/A ARG 67.A NH1 TYR 9.A OH no hydrogen 2.957 N/A TYR 68.A N LYS 75.A O no hydrogen 2.796 N/A THR 73.A N MET 70.A O no hydrogen 2.886 N/A THR 73.A OG1 MET 70.A O no hydrogen 3.200 N/A LYS 75.A N TYR 68.A O no hydrogen 2.824 N/A ILE 77.A N MET 66.A O no hydrogen 2.865 N/A LEU 79.A N ARG 64.A O no hydrogen 2.774 N/A VAL 82.A N LEU 79.A O no hydrogen 2.669 N/A SER 83.A N GLU 113.A O no hydrogen 2.792 N/A TYR 85.A N THR 111.A O no hydrogen 2.882 N/A THR 86.A N ARG 88.A O no hydrogen 3.317 N/A THR 86.A OG1 PRO 105.A O no hydrogen 2.935 N/A THR 86.A OG1 ALA 106.A O no hydrogen 3.365 N/A SER 87.A N THR 86.A OG1 no hydrogen 2.647 N/A SER 87.A OG ALA 106.A O no hydrogen 2.730 N/A ARG 88.A NH1 SER 87.A O no hydrogen 2.768 N/A CYS 90.A N LEU 84.A O no hydrogen 2.994 N/A CYS 90.A SG LEU 84.A O no hydrogen 3.637 N/A CYS 90.A SG ARG 88.A O no hydrogen 3.860 N/A HIS 91.A N ARG 103.A O no hydrogen 2.980 N/A VAL 93.A N LEU 101.A O no hydrogen 2.956 N/A ASP 94.A N LEU 101.A O no hydrogen 2.920 N/A GLY 95.A N ASP 94.A OD1 no hydrogen 2.746 N/A HIS 96.A N PHE 99.A O no hydrogen 3.089 N/A TYR 98.A OH ARG 13.A O no hydrogen 2.787 N/A PHE 99.A N HIS 96.A O no hydrogen 3.089 N/A LEU 100.A N LEU 47.A O no hydrogen 2.601 N/A LEU 101.A N ASP 94.A O no hydrogen 2.745 N/A ALA 102.A N VAL 45.A O no hydrogen 3.312 N/A ARG 103.A N HIS 91.A O no hydrogen 2.837 N/A GLY 107.A N VAL 129.A O no hydrogen 2.889 N/A ILE 110.A N VAL 125.A O no hydrogen 2.935 N/A THR 111.A N TYR 85.A O no hydrogen 2.898 N/A THR 111.A OG1 SER 124.A OG no hydrogen 2.835 N/A MET 112.A N CYS 123.A O no hydrogen 2.995 N/A GLU 113.A N SER 83.A O no hydrogen 2.849 N/A PHE 114.A N HIS 121.A O no hydrogen 2.973 N/A HIS 121.A N PHE 114.A O no hydrogen 2.970 N/A CYS 123.A N MET 112.A O no hydrogen 2.822 N/A SER 124.A OG THR 111.A OG1 no hydrogen 2.835 N/A VAL 125.A N ILE 110.A O no hydrogen 2.891 N/A VAL 129.A N GLY 107.A O no hydrogen 3.011 N/A ARG 136.A NE GLY 331.A O no hydrogen 2.825 N/A ARG 136.A NH2 GLY 331.A O no hydrogen 2.879 N/A LEU 138.A N PRO 292.A O no hydrogen 2.869 N/A VAL 147.A N VAL 268.A O no hydrogen 2.666 N/A GLN 149.A N CYS 266.A O no hydrogen 2.926 N/A CYS 151.A N GLY 264.A O no hydrogen 2.925 N/A CYS 151.A SG GLN 149.A O no hydrogen 3.997 N/A CYS 151.A SG GLY 264.A O no hydrogen 3.341 N/A GLN 152.A N HIS 41.A ND1 no hydrogen 2.903 N/A GLN 152.A NE2 ASP 263.A OD1 no hydrogen 2.965 N/A VAL 153.A N ALA 262.A O no hydrogen 2.833 N/A TYR 154.A OH ASP 39.A OD2 no hydrogen 2.884 N/A ALA 155.A N LEU 260.A O no hydrogen 2.913 N/A GLN 159.A N ASP 157.A OD1 no hydrogen 2.916 N/A ASN 160.A ND2 ALA 158.A O no hydrogen 2.882 N/A ARG 161.A NH1 ASN 160.A O no hydrogen 2.840 N/A ARG 161.A NH2 GLU 4.A OE1 no hydrogen 3.063 N/A VAL 165.A N LEU 255.A O no hydrogen 2.850 N/A MET 167.A N GLY 253.A O no hydrogen 3.016 N/A HIS 168.A N VAL 237.A O no hydrogen 2.865 N/A HIS 168.A ND1 LEU 169.A O no hydrogen 2.771 N/A LEU 169.A N LEU 251.A O no hydrogen 3.023 N/A GLU 173.A N ARG 230.A O no hydrogen 3.107 N/A ASP 175.A N ALA 228.A O no hydrogen 3.084 N/A SER 177.A N ASP 175.A OD1 no hydrogen 2.879 N/A LEU 178.A N ASP 175.A O no hydrogen 3.149 N/A VAL 179.A N SER 176.A O no hydrogen 3.097 N/A SER 180.A N THR 187.A O no hydrogen 2.929 N/A SER 182.A N SER 185.A O no hydrogen 2.948 N/A SER 185.A OG SER 182.A O no hydrogen 3.444 N/A THR 187.A N SER 180.A O no hydrogen 2.824 N/A VAL 188.A N LYS 215.A O no hydrogen 2.952 N/A THR 189.A N LEU 178.A O no hydrogen 2.902 N/A THR 189.A OG1 LEU 178.A O no hydrogen 3.485 N/A SER 195.A N LEU 231.A O no hydrogen 3.110 N/A ALA 196.A N THR 210.A O no hydrogen 3.044 N/A LEU 197.A N TYR 229.A O no hydrogen 3.093 N/A VAL 198.A N SER 208.A O no hydrogen 2.829 N/A GLU 199.A N ARG 227.A O no hydrogen 3.105 N/A CYS 200.A SG THR 205.A O no hydrogen 3.501 N/A GLU 201.A N GLN 225.A O no hydrogen 3.087 N/A CYS 202.A SG GLN 225.A OE1 no hydrogen 3.182 N/A SER 208.A OG ILE 207.A O no hydrogen 2.221 N/A SER 208.A OG THR 210.A OG1 no hydrogen 2.724 N/A THR 210.A N ALA 196.A O no hydrogen 3.139 N/A THR 210.A OG1 SER 208.A OG no hydrogen 2.724 N/A ASN 212.A ND2 ASP 192.A OD2 no hydrogen 3.231 N/A LYS 215.A N VAL 188.A O no hydrogen 3.072 N/A LYS 215.A NZ THR 210.A OG1 no hydrogen 3.071 N/A PHE 217.A N VAL 186.A O no hydrogen 2.887 N/A CYS 220.A SG SER 218.A O no hydrogen 3.051 N/A GLN 225.A N LYS 222.A O no hydrogen 3.008 N/A CYS 226.A N LYS 223.A O no hydrogen 3.098 N/A CYS 226.A SG LYS 222.A O no hydrogen 3.795 N/A ARG 227.A N GLU 199.A O no hydrogen 2.864 N/A ARG 227.A NH2 GLU 199.A OE1 no hydrogen 2.845 N/A TYR 229.A N LEU 197.A O no hydrogen 2.853 N/A ARG 230.A N GLU 173.A O no hydrogen 2.750 N/A ARG 230.A NE THR 194.A OG1 no hydrogen 3.361 N/A ARG 230.A NH1 GLY 72.A O no hydrogen 2.969 N/A ARG 230.A NH2 THR 194.A OG1 no hydrogen 2.947 N/A LEU 231.A N SER 195.A O no hydrogen 2.896 N/A GLN 232.A NE2 THR 194.A OG1 no hydrogen 3.299 N/A LYS 235.A NZ LYS 10.A O no hydrogen 2.940 N/A TRP 236.A N LEU 11.A O no hydrogen 2.960 N/A VAL 237.A N HIS 168.A O no hydrogen 2.793 N/A ASN 239.A N GLU 166.A O no hydrogen 3.087 N/A ASN 239.A ND2 GLU 166.A OE2 no hydrogen 2.882 N/A SER 240.A N TYR 238.A O no hydrogen 2.693 N/A SER 240.A OG GLU 34.A OE1 no hydrogen 3.389 N/A SER 240.A OG GLU 34.A OE2 no hydrogen 2.861 N/A LYS 242.A N SER 240.A OG no hydrogen 3.132 N/A LYS 242.A NZ ARG 18.A O no hydrogen 2.889 N/A LEU 243.A N SER 240.A O no hydrogen 3.464 N/A GLY 253.A N MET 167.A O no hydrogen 2.930 N/A LYS 254.A NZ GLU 166.A OE1 no hydrogen 3.437 N/A LEU 255.A N VAL 165.A O no hydrogen 2.961 N/A HIS 256.A ND1 ALA 163.A O no hydrogen 3.079 N/A VAL 257.A N ALA 163.A O no hydrogen 2.900 N/A PHE 259.A N ASP 157.A O no hydrogen 3.305 N/A ALA 262.A N VAL 153.A O no hydrogen 2.862 N/A GLY 264.A N CYS 151.A O no hydrogen 2.772 N/A CYS 266.A N GLN 149.A O no hydrogen 2.884 N/A VAL 268.A N VAL 147.A O no hydrogen 2.907 N/A THR 277.A N SER 284.A O no hydrogen 2.957 N/A ARG 281.A NH2 GLU 323.A OE2 no hydrogen 2.852 N/A SER 282.A N GLY 279.A O no hydrogen 3.498 N/A SER 282.A OG PHE 319.A O no hydrogen 3.344 N/A VAL 283.A N PHE 319.A O no hydrogen 2.849 N/A SER 284.A N THR 277.A O no hydrogen 2.835 N/A SER 284.A OG ASN 318.A OD1 no hydrogen 2.848 N/A LEU 285.A N ARG 317.A O no hydrogen 3.015 N/A LYS 286.A N MET 275.A O no hydrogen 3.054 N/A LEU 287.A N ALA 315.A O no hydrogen 2.933 N/A HIS 288.A ND1 HIS 288.A O no hydrogen 2.592 N/A THR 293.A N ILE 311.A O no hydrogen 2.839 N/A THR 293.A OG1 ASN 291.A O no hydrogen 2.904 N/A THR 293.A OG1 ASN 291.A OD1 no hydrogen 3.478 N/A TYR 294.A N ARG 136.A O no hydrogen 2.849 N/A LEU 295.A N GLU 309.A O no hydrogen 2.806 N/A ILE 296.A N VAL 329.A O no hydrogen 3.224 N/A THR 297.A N THR 307.A O no hydrogen 2.916 N/A THR 297.A OG1 THR 307.A O no hydrogen 3.257 N/A ARG 298.A N GLU 327.A O no hydrogen 3.426 N/A ARG 298.A NE GLU 327.A OE1 no hydrogen 2.881 N/A ARG 298.A NH2 GLU 327.A OE1 no hydrogen 3.021 N/A GLN 299.A N PRO 304.A O no hydrogen 2.894 N/A LEU 300.A N GLY 325.A O no hydrogen 2.872 N/A THR 307.A N THR 297.A O no hydrogen 3.065 N/A THR 307.A OG1 HIS 305.A O no hydrogen 2.910 N/A GLU 309.A N LEU 295.A O no hydrogen 2.814 N/A ILE 311.A N THR 293.A O no hydrogen 2.926 N/A ALA 315.A N LEU 287.A O no hydrogen 2.956 N/A ARG 317.A N LEU 285.A O no hydrogen 3.062 N/A PHE 319.A N VAL 283.A O no hydrogen 2.876 N/A VAL 321.A N ARG 281.A O no hydrogen 2.952 N/A THR 322.A OG1 GLY 325.A O no hydrogen 3.333 N/A GLY 325.A N THR 322.A O no hydrogen 2.925 N/A TRP 326.A N PHE 338.A O no hydrogen 3.078 N/A GLU 327.A N ARG 298.A O no hydrogen 2.795 N/A PHE 328.A N LYS 336.A O no hydrogen 2.864 N/A VAL 329.A N ILE 296.A O no hydrogen 3.166 N/A GLY 331.A N TYR 294.A O no hydrogen 3.247 N/A ASN 332.A ND2 GLU 137.A OE2 no hydrogen 2.815 N/A ASN 332.A ND2 PRO 269.A O no hydrogen 2.666 N/A HIS 333.A N TRP 330.A O no hydrogen 3.023 N/A HIS 333.A ND1 PRO 334.A O no hydrogen 2.831 N/A LYS 336.A N PHE 328.A O no hydrogen 3.014 N/A ARG 337.A NE GLU 327.A OE1 no hydrogen 2.979 N/A ARG 337.A NH2 GLU 327.A OE1 no hydrogen 3.186 N/A PHE 338.A N TRP 326.A O no hydrogen 3.261 N/A THR 343.A OG1 GLN 341.A O no hydrogen 3.061 N/A ASN 347.A N GLU 342.A OE2 no hydrogen 2.930 N/A ILE 356.A N HIS 353.A O no hydrogen 2.891 N/A THR 357.A N GLU 354.A O no hydrogen 2.739 N/A THR 357.A OG1 GLU 354.A O no hydrogen 2.547 N/A HIS 358.A N GLU 354.A O no hydrogen 3.277 N/A TYR 359.A N VAL 355.A O no hydrogen 2.773 N/A HIS 361.A N HIS 358.A O no hydrogen 3.187 N/A LEU 369.A N SER 366.A O no hydrogen 3.006 N/A LEU 371.A N THR 367.A O no hydrogen 3.028 N/A SER 372.A N ILE 368.A O no hydrogen 2.896 N/A SER 372.A OG ILE 368.A O no hydrogen 3.227 N/A ILE 373.A N LEU 369.A O no hydrogen 3.008 N/A CYS 374.A N GLY 370.A O no hydrogen 3.034 N/A CYS 374.A SG GLY 370.A O no hydrogen 3.071 N/A ALA 375.A N LEU 371.A O no hydrogen 3.029 N/A ALA 376.A N SER 372.A O no hydrogen 2.948 N/A ILE 377.A N ILE 373.A O no hydrogen 3.041 N/A ALA 378.A N CYS 374.A O no hydrogen 3.019 N/A THR 379.A N ALA 375.A O no hydrogen 3.039 N/A THR 379.A OG1 ALA 375.A O no hydrogen 3.117 N/A VAL 380.A N ALA 376.A O no hydrogen 2.975 N/A SER 381.A N ILE 377.A O no hydrogen 2.914 N/A SER 381.A OG ILE 377.A O no hydrogen 2.979 N/A VAL 382.A N ALA 378.A O no hydrogen 2.972 N/A ALA 383.A N THR 379.A O no hydrogen 2.960 N/A ALA 384.A N VAL 380.A O no hydrogen 2.854 N/A SER 385.A N SER 381.A O no hydrogen 2.971 N/A SER 385.A OG SER 381.A O no hydrogen 3.130 N/A THR 386.A N VAL 382.A O no hydrogen 2.965 N/A THR 386.A OG1 VAL 382.A O no hydrogen 3.158 N/A TRP 387.A N ALA 383.A O no hydrogen 2.972 N/A LEU 388.A N ALA 384.A O no hydrogen 2.856 N/A PHE 389.A N SER 385.A O no hydrogen 2.801 N/A CYS 390.A N THR 386.A O no hydrogen 2.914 N/A CYS 390.A SG THR 386.A O no hydrogen 2.954 N/A ARG 391.A N TRP 387.A O no hydrogen 3.065 N/A SER 392.A N LEU 388.A O no hydrogen 2.870 N/A SER 392.A OG LEU 388.A O no hydrogen 2.957 N/A ARG 393.A N PHE 389.A O no hydrogen 2.810 N/A VAL 394.A N CYS 390.A O no hydrogen 2.923 N/A ALA 395.A N ARG 391.A O no hydrogen 2.811 N/A CYS 396.A N SER 392.A O no hydrogen 2.974 N/A CYS 396.A SG SER 392.A O no hydrogen 3.366 N/A LEU 397.A N ARG 393.A O no hydrogen 3.040 N/A THR 398.A N VAL 394.A O no hydrogen 2.710 N/A THR 398.A OG1 VAL 394.A O no hydrogen 2.524 N/A ARG 401.A N THR 398.A O no hydrogen 3.100 N/A ALA 406.A N THR 403.A O no hydrogen 2.727 N/A ARG 407.A NH1 ALA 406.A O no hydrogen 2.856 N/A LEU 412.A N ILE 408.A O no hydrogen 3.232 N/A ALA 413.A N PRO 409.A O no hydrogen 2.977 N/A VAL 414.A N PHE 410.A O no hydrogen 3.030 N/A LEU 415.A N CYS 411.A O no hydrogen 3.039 N/A CYS 416.A SG LEU 412.A O no hydrogen 3.060 N/A CYS 416.A SG ALA 413.A O no hydrogen 2.992 N/A