Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8dgs_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N VAL 15.A O no hydrogen 2.633 N/A ARG 4.A NH2 GLY 63.A O no hydrogen 3.474 N/A VAL 5.A N THR 13.A O no hydrogen 2.663 N/A PHE 6.A N LEU 66.A O no hydrogen 2.577 N/A LEU 7.A N GLN 11.A O no hydrogen 2.791 N/A GLN 11.A N LEU 7.A O no hydrogen 3.218 N/A GLN 11.A N PRO 8.A O no hydrogen 3.313 N/A THR 13.A N VAL 5.A O no hydrogen 2.841 N/A VAL 15.A N VAL 3.A O no hydrogen 2.860 N/A ALA 17.A N PRO 1.A O no hydrogen 2.497 N/A GLY 20.A N ASP 57.A OD2 no hydrogen 3.030 N/A VAL 21.A N ARG 18.A O no hydrogen 3.333 N/A VAL 23.A N THR 56.A O no hydrogen 2.924 N/A ARG 24.A N TRP 54.A O no hydrogen 2.944 N/A ASP 25.A N THR 22.A OG1 no hydrogen 3.099 N/A SER 26.A N THR 22.A O no hydrogen 3.012 N/A SER 26.A OG THR 22.A O no hydrogen 2.713 N/A LEU 27.A N VAL 23.A O no hydrogen 2.911 N/A LEU 31.A N LEU 27.A O no hydrogen 2.909 N/A MET 32.A N LYS 28.A O no hydrogen 2.890 N/A MET 33.A N LYS 29.A O no hydrogen 2.902 N/A ARG 34.A N LEU 31.A O no hydrogen 2.990 N/A ARG 34.A NH2 ARG 12.A O no hydrogen 3.099 N/A GLY 35.A N MET 32.A O no hydrogen 3.370 N/A LEU 36.A N LEU 31.A O no hydrogen 2.739 N/A GLU 39.A N GLU 39.A OE1 no hydrogen 2.690 N/A CYS 40.A N ILE 37.A O no hydrogen 3.381 N/A CYS 40.A SG ILE 37.A O no hydrogen 3.230 N/A CYS 41.A N PRO 38.A O no hydrogen 3.190 N/A CYS 41.A SG ILE 37.A O no hydrogen 3.435 N/A ALA 42.A N GLU 69.A O no hydrogen 2.492 N/A TYR 44.A N HIS 67.A O no hydrogen 2.735 N/A ARG 45.A N LYS 50.A O no hydrogen 2.787 N/A ILE 46.A N GLU 65.A O no hydrogen 3.079 N/A GLN 47.A N GLU 48.A O no hydrogen 3.097 N/A LYS 50.A N ARG 45.A O no hydrogen 2.771 N/A ILE 52.A N VAL 43.A O no hydrogen 3.117 N/A TRP 54.A NE1 CYS 41.A O no hydrogen 2.928 N/A THR 56.A N GLY 53.A O no hydrogen 3.259 N/A THR 56.A OG1 GLY 53.A O no hydrogen 2.861 N/A ILE 58.A N VAL 21.A O no hydrogen 2.818 N/A SER 59.A N ASP 57.A OD1 no hydrogen 3.013 N/A LEU 61.A N ILE 58.A O no hydrogen 3.112 N/A THR 62.A N SER 59.A O no hydrogen 3.338 N/A THR 62.A OG1 SER 59.A O no hydrogen 2.520 N/A GLY 63.A N ILE 2.A O no hydrogen 3.364 N/A GLU 64.A N LEU 61.A O no hydrogen 3.083 N/A LEU 66.A N ARG 4.A O no hydrogen 3.046 N/A HIS 67.A N TYR 44.A O no hydrogen 2.845 N/A VAL 68.A N PHE 6.A O no hydrogen 3.148 N/A GLU 69.A N ALA 42.A O no hydrogen 2.775 N/A LEU 71.A N CYS 40.A O no hydrogen 2.633 N/A THR 77.A OG1 LEU 76.A O no hydrogen 2.544 N/A THR 77.A OG1 LEU 122.A O no hydrogen 2.550 N/A THR 78.A OG1 HIS 79.A O no hydrogen 3.163 N/A HIS 79.A NE2 PRO 121.A O no hydrogen 3.221 N/A ASN 80.A N THR 107.A OG1 no hydrogen 3.199 N/A ASN 80.A ND2 SER 419.A O no hydrogen 3.649 N/A ASN 80.A ND2 LEU 420.A O no hydrogen 2.846 N/A VAL 82.A N ARG 104.A O no hydrogen 2.767 N/A THR 85.A OG1 PHE 100.A O no hydrogen 3.267 N/A THR 88.A OG1 LEU 89.A O no hydrogen 3.554 N/A CYS 92.A N LYS 97.A O no hydrogen 3.409 N/A CYS 92.A SG LYS 111.A O no hydrogen 3.931 N/A ASP 93.A N LYS 111.A O no hydrogen 2.788 N/A CYS 95.A SG HIS 113.A ND1 no hydrogen 2.684 N/A ARG 96.A N CYS 92.A O no hydrogen 3.174 N/A ARG 96.A NH1 ASP 93.A OD1 no hydrogen 3.158 N/A ARG 96.A NH2 GLU 383.A OE1 no hydrogen 3.459 N/A LEU 99.A N ALA 90.A O no hydrogen 3.257 N/A PHE 103.A N PHE 112.A O no hydrogen 3.020 N/A ARG 104.A N VAL 82.A O no hydrogen 3.161 N/A CYS 105.A N TYR 110.A O no hydrogen 2.963 N/A CYS 105.A SG HIS 79.A ND1 no hydrogen 3.442 N/A CYS 105.A SG ASN 80.A O no hydrogen 3.724 N/A GLN 106.A N ASN 80.A O no hydrogen 2.655 N/A CYS 108.A SG HIS 79.A ND1 no hydrogen 3.804 N/A GLY 109.A N CYS 105.A O no hydrogen 3.078 N/A PHE 112.A N PHE 103.A O no hydrogen 3.289 N/A HIS 113.A NE2 LEU 98.A O no hydrogen 2.839 N/A CYS 116.A N HIS 113.A O no hydrogen 3.289 N/A CYS 116.A SG HIS 113.A ND1 no hydrogen 3.782 N/A GLU 119.A N CYS 116.A O no hydrogen 3.197 N/A VAL 120.A N SER 117.A O no hydrogen 3.179 N/A CYS 124.A SG HIS 79.A ND1 no hydrogen 3.200 N/A SER 130.A OG SER 131.A O no hydrogen 3.341 N/A ILE 140.A N TYR 207.A O no hydrogen 2.900 N/A GLY 143.A N ASP 142.A OD1 no hydrogen 2.606 N/A THR 146.A N LYS 163.A O no hydrogen 3.134 N/A THR 146.A OG1 LYS 163.A O no hydrogen 3.058 N/A ILE 151.A N VAL 159.A O no hydrogen 2.810 N/A GLY 154.A N GLY 157.A O no hydrogen 3.044 N/A THR 158.A N MET 172.A O no hydrogen 2.726 N/A VAL 159.A N GLY 152.A O no hydrogen 2.835 N/A TYR 160.A N VAL 170.A O no hydrogen 2.906 N/A LYS 161.A NZ ASP 167.A OD2 no hydrogen 3.520 N/A LYS 161.A NZ GLU 221.A OE2 no hydrogen 3.364 N/A GLY 162.A N VAL 168.A O no hydrogen 3.097 N/A TRP 164.A N GLY 166.A O no hydrogen 2.686 N/A TRP 164.A NE1 GLN 144.A OE1 no hydrogen 3.106 N/A VAL 168.A N GLY 162.A O no hydrogen 2.864 N/A ALA 169.A N THR 217.A O no hydrogen 2.555 N/A VAL 170.A N TYR 160.A O no hydrogen 3.026 N/A LYS 171.A N ILE 215.A O no hydrogen 2.668 N/A LYS 171.A NZ ASP 282.A OD1 no hydrogen 3.217 N/A MET 172.A N THR 158.A O no hydrogen 2.537 N/A ASN 174.A N PHE 156.A O no hydrogen 2.861 N/A THR 179.A OG1 GLN 181.A OE1 no hydrogen 2.665 N/A GLN 182.A N THR 179.A OG1 no hydrogen 2.745 N/A GLN 182.A NE2 THR 287.A O no hydrogen 3.113 N/A LEU 183.A N THR 179.A O no hydrogen 2.584 N/A GLN 184.A N PRO 180.A O no hydrogen 2.891 N/A ALA 185.A N GLN 181.A O no hydrogen 2.923 N/A PHE 186.A N GLN 182.A O no hydrogen 2.877 N/A LYS 187.A N LEU 183.A O no hydrogen 2.884 N/A ASN 188.A N GLN 184.A O no hydrogen 2.901 N/A ASN 188.A ND2 GLN 184.A OE1 no hydrogen 2.797 N/A GLU 189.A N ALA 185.A O no hydrogen 2.926 N/A VAL 190.A N PHE 186.A O no hydrogen 2.905 N/A GLY 191.A N LYS 187.A O no hydrogen 2.893 N/A VAL 192.A N ASN 188.A O no hydrogen 2.929 N/A LEU 193.A N GLU 189.A O no hydrogen 2.922 N/A ARG 194.A N VAL 190.A O no hydrogen 2.886 N/A THR 196.A OG1 LEU 193.A O no hydrogen 2.364 N/A ARG 197.A N TYR 254.A OH no hydrogen 3.465 N/A ASN 200.A N HIS 198.A ND1 no hydrogen 2.976 N/A LEU 202.A N ILE 280.A O no hydrogen 2.855 N/A LEU 203.A N GLN 218.A OE1 no hydrogen 3.305 N/A MET 205.A N VAL 216.A O no hydrogen 3.291 N/A THR 209.A OG1 GLU 139.A OE1 no hydrogen 2.893 N/A THR 209.A OG1 GLU 139.A OE2 no hydrogen 2.920 N/A GLN 212.A N LYS 210.A O no hydrogen 2.904 N/A ILE 215.A N LYS 171.A O no hydrogen 2.938 N/A VAL 216.A N GLY 206.A O no hydrogen 3.304 N/A THR 217.A N ALA 169.A O no hydrogen 2.458 N/A THR 217.A OG1 ALA 169.A O no hydrogen 3.385 N/A GLN 218.A N LEU 203.A O no hydrogen 3.299 N/A CYS 220.A SG GLU 221.A O no hydrogen 3.166 N/A GLU 221.A N HIS 273.A NE2 no hydrogen 3.082 N/A SER 224.A OG SER 267.A O no hydrogen 3.289 N/A SER 224.A OG ASN 268.A O no hydrogen 3.380 N/A LEU 225.A N ILE 270.A O no hydrogen 2.824 N/A TYR 226.A N SER 224.A OG no hydrogen 2.835 N/A HIS 228.A ND1 SER 224.A O no hydrogen 2.622 N/A LEU 229.A N LEU 225.A O no hydrogen 2.927 N/A HIS 230.A N TYR 226.A O no hydrogen 2.940 N/A HIS 230.A N HIS 227.A O no hydrogen 3.317 N/A HIS 230.A NE2 GLU 336.A OE2 no hydrogen 2.304 N/A ILE 231.A N HIS 227.A O no hydrogen 2.591 N/A ILE 232.A N HIS 227.A O no hydrogen 3.354 N/A THR 234.A N HIS 228.A O no hydrogen 3.268 N/A LYS 240.A NZ ASP 275.A O no hydrogen 3.021 N/A LEU 241.A N GLU 237.A O no hydrogen 2.711 N/A ILE 242.A N MET 238.A O no hydrogen 2.916 N/A ASP 243.A N ILE 239.A O no hydrogen 2.907 N/A ILE 244.A N LYS 240.A O no hydrogen 2.909 N/A ALA 245.A N LEU 241.A O no hydrogen 2.952 N/A ARG 246.A N ILE 242.A O no hydrogen 2.848 N/A GLN 247.A N ASP 243.A O no hydrogen 2.899 N/A GLN 247.A NE2 ASP 243.A OD1 no hydrogen 2.641 N/A GLN 247.A NE2 LEU 276.A O no hydrogen 3.253 N/A THR 248.A N ILE 244.A O no hydrogen 2.906 N/A THR 248.A OG1 ILE 244.A O no hydrogen 2.836 N/A ALA 249.A N ALA 245.A O no hydrogen 2.916 N/A GLN 250.A N ARG 246.A O no hydrogen 2.876 N/A GLN 250.A N GLN 247.A O no hydrogen 2.884 N/A GLY 251.A N GLN 247.A O no hydrogen 3.425 N/A ASP 253.A N ALA 249.A O no hydrogen 3.330 N/A LEU 255.A N GLY 251.A O no hydrogen 2.947 N/A HIS 256.A N MET 252.A O no hydrogen 2.911 N/A HIS 256.A ND1 MET 252.A O no hydrogen 3.230 N/A ALA 257.A N ASP 253.A O no hydrogen 2.841 N/A LYS 258.A N TYR 254.A O no hydrogen 2.986 N/A LYS 258.A NZ TYR 254.A OH no hydrogen 2.412 N/A SER 259.A N HIS 256.A O no hydrogen 2.796 N/A ILE 260.A N LEU 255.A O no hydrogen 3.165 N/A HIS 262.A N ASP 326.A OD2 no hydrogen 3.035 N/A ARG 263.A N ASP 326.A OD1 no hydrogen 3.073 N/A ASP 264.A N HIS 262.A ND1 no hydrogen 3.039 N/A ASN 269.A N LYS 266.A O no hydrogen 2.661 N/A ASN 269.A ND2 ASP 264.A O no hydrogen 3.371 N/A PHE 271.A N LYS 279.A O no hydrogen 2.901 N/A LEU 272.A N SER 223.A O no hydrogen 3.403 N/A HIS 273.A N THR 277.A O no hydrogen 2.984 N/A LEU 276.A N HIS 273.A O no hydrogen 3.178 N/A THR 277.A N HIS 273.A O no hydrogen 3.058 N/A VAL 278.A N GLN 247.A OE1 no hydrogen 2.619 N/A LYS 279.A N PHE 271.A O no hydrogen 3.093 N/A LYS 279.A NZ HIS 273.A ND1 no hydrogen 2.949 N/A ALA 286.A N GLU 189.A OE2 no hydrogen 3.094 N/A LYS 289.A NZ GLY 284.A O no hydrogen 2.671 N/A LYS 289.A NZ LEU 285.A O no hydrogen 3.380 N/A SER 290.A OG LYS 289.A O no hydrogen 2.390 N/A SER 290.A OG SER 290.A O no hydrogen 2.577 N/A SER 290.A OG GLN 297.A O no hydrogen 3.480 N/A SER 295.A OG HIS 296.A ND1 no hydrogen 2.999 N/A MET 308.A N ILE 305.A O no hydrogen 3.457 N/A ILE 313.A N ALA 309.A O no hydrogen 3.254 N/A ARG 314.A N PRO 310.A O no hydrogen 2.944 N/A ARG 314.A NE GLN 316.A OE1 no hydrogen 2.637 N/A ARG 314.A NH1 GLY 358.A O no hydrogen 3.079 N/A MET 315.A N GLU 311.A O no hydrogen 3.214 N/A ASN 319.A N ASP 317.A OD2 no hydrogen 2.862 N/A SER 322.A OG GLN 324.A OE1 no hydrogen 2.524 N/A GLN 324.A N GLN 324.A OE1 no hydrogen 2.356 N/A GLN 324.A NE2 ARG 389.A O no hydrogen 3.547 N/A SER 325.A N SER 322.A O no hydrogen 2.848 N/A SER 325.A OG SER 322.A O no hydrogen 2.628 N/A SER 325.A OG ASP 326.A OD1 no hydrogen 3.441 N/A VAL 327.A N PHE 323.A O no hydrogen 2.969 N/A TYR 328.A N GLN 324.A O no hydrogen 2.895 N/A ALA 329.A N SER 325.A O no hydrogen 2.946 N/A PHE 330.A N ASP 326.A O no hydrogen 2.905 N/A GLY 331.A N VAL 327.A O no hydrogen 2.926 N/A ILE 332.A N TYR 328.A O no hydrogen 2.982 N/A VAL 333.A N ALA 329.A O no hydrogen 2.921 N/A LEU 334.A N PHE 330.A O no hydrogen 2.903 N/A TYR 335.A N GLY 331.A O no hydrogen 2.969 N/A GLU 336.A N ILE 332.A O no hydrogen 2.880 N/A LEU 337.A N VAL 333.A O no hydrogen 2.947 N/A MET 338.A N LEU 334.A O no hydrogen 2.912 N/A THR 339.A N TYR 335.A O no hydrogen 2.931 N/A THR 339.A OG1 TYR 335.A O no hydrogen 2.388 N/A THR 339.A OG1 GLN 341.A O no hydrogen 3.509 N/A GLY 340.A N GLU 336.A O no hydrogen 2.962 N/A ASP 351.A N ASN 349.A OD1 no hydrogen 2.926 N/A ILE 353.A N ASN 349.A O no hydrogen 3.008 N/A ILE 354.A N ARG 350.A O no hydrogen 2.917 N/A PHE 355.A N ASP 351.A O no hydrogen 2.914 N/A MET 356.A N GLN 352.A O no hydrogen 2.872 N/A VAL 357.A N ILE 353.A O no hydrogen 2.933 N/A GLY 358.A N ILE 354.A O no hydrogen 2.930 N/A ARG 359.A N PHE 355.A O no hydrogen 3.144 N/A GLY 360.A N VAL 357.A O no hydrogen 3.095 N/A LEU 362.A N MET 356.A O no hydrogen 3.079 N/A SER 363.A OG PRO 364.A O no hydrogen 3.323 N/A LYS 368.A N ASP 365.A OD1 no hydrogen 2.399 N/A LYS 368.A NZ GLN 341.A OE1 no hydrogen 2.290 N/A SER 371.A OG SER 371.A O no hydrogen 2.569 N/A CYS 373.A SG PRO 374.A O no hydrogen 3.621 N/A MET 377.A N PRO 374.A O no hydrogen 3.178 N/A ARG 379.A N LYS 375.A O no hydrogen 2.914 N/A LEU 380.A N ALA 376.A O no hydrogen 2.926 N/A MET 381.A N MET 377.A O no hydrogen 2.899 N/A ALA 382.A N LYS 378.A O no hydrogen 2.884 N/A GLU 383.A N ARG 379.A O no hydrogen 2.897 N/A CYS 384.A N LEU 380.A O no hydrogen 2.954 N/A CYS 384.A SG LEU 380.A O no hydrogen 3.193 N/A LEU 385.A N ALA 382.A O no hydrogen 3.251 N/A LYS 386.A NZ GLU 391.A OE1 no hydrogen 2.561 N/A ARG 389.A NH2 ASP 317.A OD1 no hydrogen 3.353 N/A ARG 392.A NE LYS 388.A O no hydrogen 2.857 N/A ARG 392.A NH1 GLN 324.A O no hydrogen 3.358 N/A ARG 392.A NH2 LYS 387.A O no hydrogen 2.803 N/A GLN 397.A N LEU 394.A O no hydrogen 2.970 N/A LEU 399.A N PHE 395.A O no hydrogen 2.894 N/A ALA 400.A N PRO 396.A O no hydrogen 2.955 N/A SER 401.A N GLN 397.A O no hydrogen 2.888 N/A SER 401.A OG GLN 397.A O no hydrogen 3.270 N/A SER 401.A OG ILE 398.A O no hydrogen 2.917 N/A ILE 402.A N ILE 398.A O no hydrogen 2.878 N/A GLU 403.A N LEU 399.A O no hydrogen 2.918 N/A LEU 404.A N ALA 400.A O no hydrogen 2.903 N/A LEU 405.A N SER 401.A O no hydrogen 2.920 N/A ALA 406.A N ILE 402.A O no hydrogen 2.855 N/A ARG 407.A N GLU 403.A O no hydrogen 2.924 N/A SER 408.A N LEU 404.A O no hydrogen 2.919 N/A SER 408.A OG LEU 404.A O no hydrogen 3.215 N/A SER 408.A OG LEU 405.A O no hydrogen 2.857 N/A LEU 409.A N ALA 406.A O no hydrogen 3.095 N/A ILE 412.A N LEU 409.A O no hydrogen 3.217 N/A ARG 414.A NE LYS 411.A O no hydrogen 3.297 N/A SER 415.A OG ALA 416.A O no hydrogen 3.318 N/A ALA 423.A N ASN 421.A OD1 no hydrogen 2.685 N/A