Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4lit_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 2.A OH ILE 31.A O no hydrogen 2.689 N/A THR 5.A N GLY 26.A O no hydrogen 2.915 N/A THR 5.A OG1 ARG 25.A O no hydrogen 2.858 N/A THR 5.A OG1 GLY 26.A O no hydrogen 3.253 N/A ASP 10.A N ASN 7.A OD1 no hydrogen 2.994 N/A PHE 11.A N ASN 7.A O no hydrogen 2.977 N/A LEU 12.A N TRP 8.A O no hydrogen 2.880 N/A GLU 13.A N PRO 9.A O no hydrogen 2.914 N/A ARG 14.A N ASP 10.A O no hydrogen 2.900 N/A HIS 15.A N PHE 11.A O no hydrogen 2.806 N/A HIS 15.A ND1 ARG 19.A O no hydrogen 2.937 N/A TRP 16.A N PHE 11.A O no hydrogen 2.973 N/A GLN 17.A N TYR 168.A OH no hydrogen 2.524 N/A GLN 17.A NE2 ASP 129.A OD1 no hydrogen 2.692 N/A GLN 17.A NE2 ASP 129.A OD2 no hydrogen 3.357 N/A LYS 18.A N HIS 15.A O no hydrogen 2.711 N/A LYS 18.A NZ LEU 12.A O no hydrogen 2.566 N/A LYS 18.A NZ TRP 16.A O no hydrogen 2.789 N/A ARG 19.A N HIS 15.A O no hydrogen 2.837 N/A VAL 21.A N TYR 168.A O no hydrogen 2.966 N/A LEU 23.A N ILE 166.A O no hydrogen 2.605 N/A LYS 24.A NZ GLU 162.A OE1 no hydrogen 2.988 N/A LYS 24.A NZ ASP 165.A OD2 no hydrogen 2.804 N/A ARG 25.A N ASP 165.A OD1 no hydrogen 2.856 N/A GLY 26.A N LEU 23.A O no hydrogen 3.276 N/A PHE 27.A N GLY 164.A O no hydrogen 3.043 N/A SER 35.A N GLU 38.A OE2 no hydrogen 2.754 N/A GLU 38.A N SER 35.A OG no hydrogen 3.075 N/A LEU 39.A N SER 35.A O no hydrogen 2.907 N/A ALA 40.A N PRO 36.A O no hydrogen 2.910 N/A GLY 41.A N ASP 37.A O no hydrogen 2.897 N/A LEU 42.A N GLU 38.A O no hydrogen 2.893 N/A ALA 43.A N LEU 39.A O no hydrogen 2.909 N/A MET 44.A N ALA 40.A O no hydrogen 2.964 N/A MET 44.A N GLY 41.A O no hydrogen 2.906 N/A GLU 45.A N LEU 42.A O no hydrogen 2.972 N/A SER 46.A OG GLU 47.A OE1 no hydrogen 3.166 N/A GLU 47.A N GLU 47.A OE1 no hydrogen 2.572 N/A VAL 48.A N GLU 45.A O no hydrogen 3.380 N/A ARG 51.A N LEU 81.A O no hydrogen 2.884 N/A LEU 52.A N SER 63.A O no hydrogen 2.859 N/A VAL 53.A N SER 79.A O no hydrogen 2.894 N/A SER 54.A N GLN 61.A O no hydrogen 2.879 N/A HIS 55.A N ASN 77.A O no hydrogen 3.238 N/A HIS 55.A NE2 GLY 118.A O no hydrogen 2.786 N/A GLN 56.A N LYS 59.A O no hydrogen 3.137 N/A LYS 59.A N GLN 56.A O no hydrogen 3.006 N/A LYS 59.A NZ GLN 56.A O no hydrogen 3.183 N/A GLN 61.A N SER 54.A O no hydrogen 2.896 N/A SER 63.A N LEU 52.A O no hydrogen 2.913 N/A GLY 65.A N SER 50.A O no hydrogen 2.956 N/A PHE 67.A N ALA 43.A O no hydrogen 3.375 N/A TYR 70.A OH ALA 40.A O no hydrogen 2.757 N/A ASN 77.A N PRO 117.A O no hydrogen 3.000 N/A ASN 77.A ND2 HIS 55.A O no hydrogen 3.660 N/A TRP 78.A NE1 GLY 74.A O no hydrogen 2.845 N/A SER 79.A N VAL 53.A O no hydrogen 2.918 N/A SER 79.A OG PHE 114.A O no hydrogen 2.965 N/A LEU 80.A N PHE 114.A O no hydrogen 2.876 N/A LEU 81.A N ARG 51.A O no hydrogen 2.876 N/A VAL 82.A N ILE 112.A O no hydrogen 2.871 N/A GLN 83.A N ASP 49.A O no hydrogen 2.891 N/A VAL 85.A N LEU 110.A O no hydrogen 2.922 N/A ASN 86.A ND2 ASP 109.A OD1 no hydrogen 3.097 N/A HIS 87.A N ALA 84.A O no hydrogen 2.860 N/A HIS 87.A ND1 GLU 266.A O no hydrogen 2.638 N/A HIS 87.A NE2 ASP 109.A OD1 no hydrogen 2.824 N/A HIS 87.A NE2 ASP 109.A OD2 no hydrogen 3.066 N/A TRP 88.A N VAL 85.A O no hydrogen 2.823 N/A HIS 89.A NE2 PRO 33.A O no hydrogen 3.186 N/A ALA 93.A N HIS 89.A O no hydrogen 3.249 N/A ALA 94.A N GLU 90.A O no hydrogen 2.995 N/A LEU 95.A N THR 92.A O no hydrogen 2.961 N/A MET 96.A N ALA 93.A O no hydrogen 2.992 N/A PHE 99.A N MET 96.A O no hydrogen 3.073 N/A ARG 100.A N ARG 97.A O no hydrogen 2.906 N/A ARG 100.A NE ASP 104.A OD1 no hydrogen 3.106 N/A ARG 100.A NH1 SER 326.A O no hydrogen 2.885 N/A ARG 100.A NH2 ASP 104.A OD2 no hydrogen 2.854 N/A ARG 100.A NH2 SER 326.A O no hydrogen 2.859 N/A LEU 102.A N PHE 99.A O no hydrogen 3.026 N/A ARG 106.A N PRO 103.A O no hydrogen 3.003 N/A ARG 106.A NE ARG 191.A O no hydrogen 3.123 N/A ARG 106.A NH2 ARG 191.A O no hydrogen 2.965 N/A ILE 107.A N ASP 104.A O no hydrogen 3.046 N/A ASP 108.A N GLY 189.A O no hydrogen 2.793 N/A LEU 110.A N ASN 86.A OD1 no hydrogen 3.008 N/A MET 111.A N SER 187.A O no hydrogen 2.921 N/A ILE 112.A N VAL 82.A O no hydrogen 2.910 N/A SER 113.A N ASN 185.A O no hydrogen 2.938 N/A PHE 114.A N LEU 80.A O no hydrogen 2.883 N/A SER 115.A N ALA 183.A O no hydrogen 2.916 N/A VAL 116.A N TRP 78.A O no hydrogen 3.328 N/A GLY 118.A N ALA 179.A O no hydrogen 2.891 N/A GLY 119.A N VAL 116.A O no hydrogen 2.739 N/A HIS 124.A N HIS 175.A O no hydrogen 3.025 N/A HIS 124.A ND1 GLY 122.A O no hydrogen 2.930 N/A LEU 125.A N LEU 148.A O no hydrogen 2.869 N/A VAL 130.A N ILE 169.A O no hydrogen 3.046 N/A PHE 131.A N VAL 188.A O no hydrogen 2.933 N/A ILE 132.A N LEU 167.A O no hydrogen 2.866 N/A ILE 133.A N TYR 186.A O no hydrogen 2.821 N/A GLN 134.A N ASP 165.A O no hydrogen 2.817 N/A GLN 134.A NE2 GLY 135.A O no hydrogen 2.727 N/A GLY 135.A N MET 184.A O no hydrogen 2.813 N/A THR 136.A N ASP 32.A OD2 no hydrogen 3.026 N/A ARG 138.A NH1 GLY 137.A O no hydrogen 3.261 N/A ARG 139.A NH1 ASN 185.A OD1 no hydrogen 2.987 N/A ARG 139.A NH2 GLY 119.A O no hydrogen 2.960 N/A ARG 140.A N TYR 178.A O no hydrogen 2.862 N/A ARG 140.A NE ASP 158.A OD1 no hydrogen 2.814 N/A ARG 140.A NH1 TYR 178.A OH no hydrogen 2.852 N/A TRP 141.A N GLU 159.A O no hydrogen 2.889 N/A TRP 141.A NE1 ASN 185.A OD1 no hydrogen 3.028 N/A ARG 142.A N GLU 176.A O no hydrogen 2.854 N/A ARG 142.A NH2 PHE 153.A O no hydrogen 2.876 N/A VAL 143.A N ILE 157.A O no hydrogen 2.840 N/A GLY 144.A N PRO 174.A O no hydrogen 2.963 N/A LYS 146.A N GLU 145.A OE1 no hydrogen 3.335 N/A VAL 150.A N PRO 123.A O no hydrogen 3.267 N/A ILE 156.A N VAL 143.A O no hydrogen 2.634 N/A ILE 157.A N VAL 143.A O no hydrogen 2.989 N/A GLU 159.A N TRP 141.A O no hydrogen 2.902 N/A LEU 161.A N ARG 139.A O no hydrogen 2.873 N/A GLU 162.A N ASP 165.A OD2 no hydrogen 2.649 N/A GLY 164.A N GLN 134.A O no hydrogen 2.823 N/A ASP 165.A N GLU 162.A O no hydrogen 2.819 N/A ILE 166.A N LEU 23.A O no hydrogen 3.037 N/A LEU 167.A N ILE 132.A O no hydrogen 2.862 N/A TYR 168.A N VAL 21.A O no hydrogen 2.867 N/A TYR 168.A OH ASP 129.A OD2 no hydrogen 2.722 N/A ILE 169.A N VAL 130.A O no hydrogen 2.956 N/A GLY 172.A N ASP 126.A O no hydrogen 3.053 N/A HIS 175.A N HIS 124.A O no hydrogen 2.784 N/A HIS 175.A ND1 PHE 173.A O no hydrogen 2.890 N/A GLU 176.A N ARG 142.A O no hydrogen 2.907 N/A TYR 178.A N ARG 140.A O no hydrogen 2.960 N/A ALA 179.A N GLY 119.A O no hydrogen 3.090 N/A LEU 180.A N ARG 138.A O no hydrogen 2.808 N/A GLU 181.A N ARG 138.A O no hydrogen 3.385 N/A ALA 183.A N SER 115.A O no hydrogen 2.853 N/A MET 184.A N THR 136.A O no hydrogen 3.017 N/A ASN 185.A N SER 113.A O no hydrogen 2.885 N/A ASN 185.A ND2 GLN 134.A OE1 no hydrogen 2.953 N/A ASN 185.A ND2 MET 184.A O no hydrogen 2.886 N/A TYR 186.A N ILE 133.A O no hydrogen 2.889 N/A TYR 186.A OH ASP 32.A OD2 no hydrogen 2.613 N/A SER 187.A N MET 111.A O no hydrogen 2.815 N/A VAL 188.A N PHE 131.A O no hydrogen 2.862 N/A GLY 189.A N ASP 109.A O no hydrogen 2.951 N/A PHE 190.A N ASP 129.A O no hydrogen 2.882 N/A ARG 191.A N ARG 106.A O no hydrogen 2.771 N/A ARG 191.A NH1 GLN 262.A O no hydrogen 2.884 N/A ARG 191.A NH2 GLN 262.A O no hydrogen 3.171 N/A ASN 194.A N GLU 197.A OE1 no hydrogen 2.890 N/A GLU 197.A N ASN 194.A OD1 no hydrogen 2.820 N/A LEU 198.A N ASN 194.A O no hydrogen 3.068 N/A ILE 199.A N THR 195.A O no hydrogen 2.908 N/A SER 200.A N ARG 196.A O no hydrogen 2.934 N/A GLY 201.A N GLU 197.A O no hydrogen 2.916 N/A PHE 202.A N LEU 198.A O no hydrogen 2.898 N/A ALA 203.A N ILE 199.A O no hydrogen 2.902 N/A ASP 204.A N SER 200.A O no hydrogen 2.916 N/A TYR 205.A N GLY 201.A O no hydrogen 2.924 N/A VAL 206.A N PHE 202.A O no hydrogen 2.904 N/A LEU 207.A N ALA 203.A O no hydrogen 2.924 N/A GLN 208.A N ASP 204.A O no hydrogen 2.893 N/A ARG 209.A N TYR 205.A O no hydrogen 2.919 N/A ARG 209.A NH1 GLU 258.A OE2 no hydrogen 3.552 N/A ARG 209.A NH2 GLU 258.A OE2 no hydrogen 3.380 N/A GLU 210.A N LEU 207.A O no hydrogen 3.181 N/A LEU 211.A N VAL 206.A O no hydrogen 3.038 N/A ASP 220.A N ASP 220.A OD1 no hydrogen 2.555 N/A VAL 221.A N ASP 218.A O no hydrogen 2.965 N/A ARG 224.A NH1 ASP 229.A O no hydrogen 2.855 N/A ARG 224.A NH1 GLU 234.A OE1 no hydrogen 2.963 N/A ARG 224.A NH1 GLU 234.A OE2 no hydrogen 3.439 N/A ARG 224.A NH2 PRO 222.A O no hydrogen 3.063 N/A ARG 224.A NH2 GLU 234.A OE2 no hydrogen 2.731 N/A ASP 229.A N HIS 226.A O no hydrogen 3.006 N/A LEU 231.A N GLU 234.A OE1 no hydrogen 2.818 N/A GLU 234.A N LEU 231.A O no hydrogen 3.140 N/A MET 235.A N LEU 231.A O no hydrogen 3.186 N/A ASP 236.A N PRO 232.A O no hydrogen 2.854 N/A LYS 237.A N GLN 233.A O no hydrogen 2.964 N/A LYS 237.A NZ SER 217.A O no hydrogen 2.914 N/A LEU 238.A N GLU 234.A O no hydrogen 2.938 N/A ARG 239.A N MET 235.A O no hydrogen 2.911 N/A ARG 239.A NH1 ASP 236.A OD1 no hydrogen 2.494 N/A ARG 239.A NH2 ASP 236.A OD1 no hydrogen 3.186 N/A GLU 240.A N ASP 236.A O no hydrogen 2.892 N/A MET 241.A N LYS 237.A O no hydrogen 2.932 N/A MET 242.A N LEU 238.A O no hydrogen 2.999 N/A LEU 243.A N ARG 239.A O no hydrogen 2.916 N/A GLU 244.A N GLU 240.A O no hydrogen 2.899 N/A LEU 245.A N MET 241.A O no hydrogen 2.939 N/A ILE 246.A N MET 242.A O no hydrogen 2.986 N/A ASN 247.A N LEU 243.A O no hydrogen 2.887 N/A GLN 248.A N LEU 245.A O no hydrogen 3.429 N/A HIS 251.A ND1 GLN 248.A OE1 no hydrogen 3.152 N/A PHE 252.A N GLN 248.A O no hydrogen 2.965 N/A LYS 253.A N PRO 249.A O no hydrogen 2.924 N/A GLN 254.A N GLU 250.A O no hydrogen 2.922 N/A GLN 254.A NE2 TYR 205.A OH no hydrogen 3.164 N/A TRP 255.A N HIS 251.A O no hydrogen 2.909 N/A PHE 256.A N PHE 252.A O no hydrogen 2.926 N/A GLY 257.A N LYS 253.A O no hydrogen 2.896 N/A GLU 258.A N GLN 254.A O no hydrogen 2.959 N/A PHE 259.A N TRP 255.A O no hydrogen 2.886 N/A ILE 260.A N PHE 256.A O no hydrogen 2.873 N/A SER 261.A N GLY 257.A O no hydrogen 3.377 N/A SER 261.A OG GLY 257.A O no hydrogen 2.811 N/A SER 261.A OG GLU 258.A O no hydrogen 3.505 N/A GLN 262.A N PHE 259.A O no hydrogen 3.356 N/A SER 263.A OG HIS 265.A O no hydrogen 3.304 N/A ARG 264.A NH1.A ASP 108.A OD1 no hydrogen 3.274 N/A HIS 265.A N SER 263.A OG no hydrogen 3.322 N/A HIS 265.A ND1 ASP 109.A OD2 no hydrogen 2.758 N/A TYR 276.A N ASN 353.A OD1 no hydrogen 2.564 N/A GLN 277.A N GLU 280.A OE2 no hydrogen 3.064 N/A GLU 280.A N GLN 277.A O no hydrogen 2.909 N/A ILE 281.A N GLN 277.A O no hydrogen 3.395 N/A TYR 282.A N PRO 278.A O no hydrogen 2.938 N/A TYR 282.A OH GLU 340.A OE2 no hydrogen 3.211 N/A ASP 283.A N ASP 279.A O no hydrogen 2.888 N/A ALA 284.A N GLU 280.A O no hydrogen 2.875 N/A LEU 285.A N ILE 281.A O no hydrogen 2.961 N/A LYS 286.A N TYR 282.A O no hydrogen 2.889 N/A LYS 286.A NZ GLU 340.A OE2 no hydrogen 3.254 N/A GLN 287.A N ASP 283.A O no hydrogen 2.852 N/A GLN 287.A N ALA 284.A O no hydrogen 3.271 N/A GLY 288.A N LEU 285.A O no hydrogen 3.017 N/A GLU 289.A N ALA 284.A O no hydrogen 3.033 N/A VAL 290.A N GLU 360.A OE2 no hydrogen 3.059 N/A LEU 291.A N LEU 330.A O no hydrogen 2.810 N/A VAL 292.A N PHE 358.A O no hydrogen 2.854 N/A ARG 293.A N ILE 328.A O no hydrogen 2.849 N/A ARG 293.A NH1 LEU 297.A O no hydrogen 3.496 N/A ARG 293.A NH2 LEU 324.A O no hydrogen 3.256 N/A ARG 293.A NH2 ALA 325.A O no hydrogen 2.552 N/A LEU 294.A N TYR 356.A O no hydrogen 2.943 N/A LEU 297.A N LEU 294.A O no hydrogen 3.089 N/A ARG 298.A NE ILE 260.A O no hydrogen 2.861 N/A ARG 298.A NH1 ILE 107.A O no hydrogen 2.653 N/A ARG 298.A NH2 TRP 105.A O no hydrogen 2.988 N/A ARG 298.A NH2 ILE 260.A O no hydrogen 2.822 N/A LEU 300.A N TYR 307.A O no hydrogen 2.915 N/A ILE 302.A N ASP 305.A O no hydrogen 2.920 N/A ASP 305.A N ILE 302.A O no hydrogen 3.210 N/A VAL 306.A N ILE 313.A O no hydrogen 2.956 N/A TYR 307.A N LEU 300.A O no hydrogen 2.849 N/A ALA 308.A N GLU 311.A O no hydrogen 2.926 N/A ASN 309.A N ARG 298.A O no hydrogen 3.033 N/A ASN 309.A ND2 TYR 356.A OH no hydrogen 3.094 N/A GLY 310.A N SER 261.A OG no hydrogen 2.905 N/A GLU 311.A N ALA 308.A O no hydrogen 2.798 N/A LYS 312.A NZ GLN 254.A OE1 no hydrogen 2.540 N/A ILE 313.A N VAL 306.A O no hydrogen 2.793 N/A HIS 317.A N SER 315.A OG no hydrogen 3.379 N/A HIS 317.A NE2 ASP 341.A OD2 no hydrogen 2.583 N/A LEU 321.A N HIS 317.A O no hydrogen 3.263 N/A ASP 322.A N ARG 318.A O no hydrogen 2.902 N/A ALA 323.A N PRO 319.A O no hydrogen 2.898 N/A LEU 324.A N ALA 320.A O no hydrogen 2.949 N/A ALA 325.A N LEU 321.A O no hydrogen 2.977 N/A SER 326.A N ASP 322.A O no hydrogen 2.898 N/A SER 326.A OG ASP 322.A O no hydrogen 2.622 N/A SER 326.A OG ASN 327.A OD1 no hydrogen 3.249 N/A ASN 327.A N ALA 323.A O no hydrogen 2.999 N/A LEU 330.A N LEU 291.A O no hydrogen 2.767 N/A THR 331.A N ASN 334.A OD1 no hydrogen 2.949 N/A THR 331.A OG1 GLU 333.A OE1 no hydrogen 3.163 N/A ASN 334.A N THR 331.A O no hydrogen 2.870 N/A PHE 335.A N ALA 332.A O no hydrogen 2.960 N/A GLY 336.A N ALA 332.A O no hydrogen 2.945 N/A ALA 338.A N PHE 335.A O no hydrogen 3.302 N/A LEU 339.A N GLY 336.A O no hydrogen 3.395 N/A GLU 340.A N ASP 337.A O no hydrogen 2.800 N/A ASP 341.A N ALA 338.A O no hydrogen 2.983 N/A SER 343.A N ASP 341.A OD1 no hydrogen 3.113 N/A LEU 345.A N ASP 341.A O no hydrogen 3.002 N/A ALA 346.A N PRO 342.A O no hydrogen 2.875 N/A MET 347.A N SER 343.A O no hydrogen 2.975 N/A LEU 348.A N PHE 344.A O no hydrogen 2.926 N/A ALA 349.A N LEU 345.A O no hydrogen 2.877 N/A ALA 350.A N ALA 346.A O no hydrogen 2.898 N/A LEU 351.A N MET 347.A O no hydrogen 2.956 N/A VAL 352.A N LEU 348.A O no hydrogen 2.901 N/A ASN 353.A N ALA 349.A O no hydrogen 2.875 N/A ASN 353.A ND2 TYR 276.A O no hydrogen 2.934 N/A SER 354.A N ALA 350.A O no hydrogen 2.972 N/A SER 354.A OG ALA 350.A O no hydrogen 3.095 N/A GLY 355.A N VAL 352.A O no hydrogen 2.760 N/A TYR 356.A N LEU 351.A O no hydrogen 3.048 N/A PHE 358.A N VAL 292.A O no hydrogen 2.924 N/A GLU 360.A N VAL 290.A O no hydrogen 2.997 N/A GLY 361.A N PHE 359.A O no hydrogen 2.497 N/A