Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3f8u_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 5.A N LEU 17.A O no hydrogen 2.788 N/A CYS 7.A N GLY 15.A O no hydrogen 2.870 N/A TRP 8.A N CYS 57.A O no hydrogen 3.145 N/A PHE 9.A N ARG 13.A O no hydrogen 2.819 N/A VAL 10.A N MET 59.A O no hydrogen 3.005 N/A ARG 13.A N PHE 9.A O no hydrogen 3.027 N/A GLY 15.A N CYS 7.A O no hydrogen 2.712 N/A ALA 16.A N LEU 30.A O no hydrogen 2.928 N/A LEU 17.A N ILE 5.A O no hydrogen 2.900 N/A LEU 18.A N LEU 32.A O no hydrogen 2.693 N/A LEU 19.A N ALA 3.A O no hydrogen 2.862 N/A ARG 23.A NH1 GLU 6.A OE2 no hydrogen 2.922 N/A ARG 23.A NH1 ASP 25.A OD2 no hydrogen 2.952 N/A ARG 23.A NH2 GLU 6.A OE1 no hydrogen 2.652 N/A ARG 23.A NH2 GLU 6.A OE2 no hydrogen 2.810 N/A LEU 26.A N ARG 23.A O no hydrogen 3.003 N/A GLU 29.A N ASP 27.A OD2 no hydrogen 2.652 N/A TYR 31.A N PRO 28.A O no hydrogen 3.305 N/A TYR 31.A OH PRO 21.A O no hydrogen 2.616 N/A LEU 32.A N ALA 16.A O no hydrogen 2.910 N/A SER 33.A N THR 119.A O no hydrogen 2.942 N/A VAL 34.A N LEU 18.A O no hydrogen 3.059 N/A HIS 35.A N ALA 121.A O no hydrogen 2.942 N/A GLY 39.A N ASP 36.A OD1 no hydrogen 2.931 N/A GLN 42.A N ASP 36.A OD2 no hydrogen 3.030 N/A ALA 43.A N GLY 39.A O no hydrogen 2.860 N/A ALA 44.A N ALA 40.A O no hydrogen 3.017 N/A ARG 46.A N ALA 43.A O no hydrogen 3.314 N/A TYR 48.A OH SER 96.A OG no hydrogen 2.866 N/A ALA 52.A N PRO 49.A O no hydrogen 3.235 N/A HIS 56.A N SER 95.A O no hydrogen 2.907 N/A GLU 58.A N SER 93.A O no hydrogen 2.895 N/A MET 59.A N TRP 8.A O no hydrogen 2.822 N/A SER 60.A N MET 91.A O no hydrogen 2.970 N/A SER 60.A OG MET 91.A O no hydrogen 3.520 N/A PHE 62.A N TRP 89.A O no hydrogen 3.085 N/A LEU 65.A N TYR 237.A O no hydrogen 2.983 N/A ALA 72.A N ALA 69.A O no hydrogen 3.387 N/A SER 73.A N LYS 70.A O no hydrogen 3.103 N/A SER 73.A OG LYS 70.A O no hydrogen 2.753 N/A LEU 75.A N ALA 72.A O no hydrogen 2.849 N/A THR 76.A N SER 73.A O no hydrogen 2.946 N/A LEU 85.A N PRO 82.A O no hydrogen 3.361 N/A ASP 86.A N ARG 83.A O no hydrogen 2.864 N/A TRP 89.A NE1 LEU 85.A O no hydrogen 3.151 N/A LEU 90.A N LEU 105.A O no hydrogen 2.866 N/A MET 91.A N SER 60.A O no hydrogen 2.722 N/A VAL 92.A N SER 103.A O no hydrogen 2.688 N/A SER 93.A N GLU 58.A O no hydrogen 2.739 N/A ILE 94.A N LEU 101.A O no hydrogen 2.810 N/A SER 95.A N HIS 56.A O no hydrogen 2.917 N/A SER 96.A N LEU 99.A O no hydrogen 2.802 N/A SER 96.A OG TYR 48.A OH no hydrogen 2.866 N/A SER 96.A OG LEU 99.A O no hydrogen 3.329 N/A VAL 98.A N SER 96.A OG no hydrogen 3.031 N/A LEU 99.A N SER 96.A OG no hydrogen 3.173 N/A SER 100.A N THR 129.A O no hydrogen 3.156 N/A SER 100.A OG THR 243.A O no hydrogen 3.457 N/A LEU 101.A N ILE 94.A O no hydrogen 2.646 N/A SER 102.A N VAL 127.A O no hydrogen 2.784 N/A SER 103.A N VAL 92.A O no hydrogen 2.756 N/A SER 103.A OG THR 126.A OG1 no hydrogen 2.852 N/A LEU 104.A N LEU 125.A O no hydrogen 2.924 N/A LEU 105.A N LEU 90.A O no hydrogen 2.694 N/A ARG 106.A N THR 122.A O no hydrogen 2.778 N/A GLN 108.A N MET 120.A O no hydrogen 2.651 N/A GLU 110.A N GLU 110.A OE1 no hydrogen 2.779 N/A THR 119.A N TYR 31.A O no hydrogen 2.950 N/A THR 119.A OG1 PRO 28.A O no hydrogen 2.653 N/A ALA 121.A N SER 33.A O no hydrogen 3.106 N/A THR 122.A N ARG 106.A O no hydrogen 2.921 N/A VAL 123.A N HIS 35.A O no hydrogen 2.851 N/A VAL 124.A N LEU 104.A O no hydrogen 2.880 N/A THR 126.A N ALA 149.A O no hydrogen 2.835 N/A THR 126.A OG1 SER 103.A OG no hydrogen 2.852 N/A VAL 127.A N SER 102.A O no hydrogen 2.864 N/A LEU 128.A N SER 147.A O no hydrogen 2.741 N/A THR 129.A N SER 100.A O no hydrogen 3.056 N/A THR 129.A OG1 ASP 145.A O no hydrogen 2.720 N/A HIS 130.A N ASP 145.A OD1 no hydrogen 2.853 N/A THR 131.A N THR 129.A OG1 no hydrogen 3.271 N/A VAL 136.A N ALA 247.A O no hydrogen 3.011 N/A LEU 138.A N TYR 249.A O no hydrogen 2.797 N/A GLY 139.A N VAL 221.A O no hydrogen 2.828 N/A GLN 140.A N ARG 137.A O no hydrogen 2.838 N/A ALA 142.A N LEU 218.A O no hydrogen 2.738 N/A LEU 144.A N PHE 216.A O no hydrogen 2.845 N/A ASP 145.A N THR 131.A OG1 no hydrogen 3.069 N/A SER 147.A N LEU 128.A O no hydrogen 2.782 N/A PHE 148.A N GLY 212.A O no hydrogen 2.962 N/A ALA 149.A N THR 126.A O no hydrogen 2.900 N/A TYR 150.A N TRP 210.A O no hydrogen 2.808 N/A MET 151.A N VAL 124.A O no hydrogen 2.805 N/A GLU 156.A N PRO 153.A O no hydrogen 3.203 N/A GLY 163.A N HIS 234.A O no hydrogen 2.830 N/A LEU 164.A N ALA 180.A O no hydrogen 2.764 N/A GLU 165.A N THR 232.A O no hydrogen 2.947 N/A TRP 166.A N LEU 178.A O no hydrogen 2.918 N/A TRP 166.A NE1 GLY 214.A O no hydrogen 2.974 N/A ARG 167.A N LEU 230.A O no hydrogen 2.993 N/A ARG 167.A NE GLU 165.A OE1 no hydrogen 2.891 N/A ARG 167.A NH2 GLU 165.A OE1 no hydrogen 3.303 N/A ARG 168.A N HIS 175.A O no hydrogen 2.995 N/A ARG 168.A NH1 GLU 193.A OE1 no hydrogen 3.352 N/A ARG 168.A NH1 GLU 193.A OE2 no hydrogen 2.850 N/A ARG 168.A NH1 TYR 229.A OH no hydrogen 3.009 N/A ARG 168.A NH2 GLU 193.A OE1 no hydrogen 2.536 N/A GLN 169.A N THR 228.A O no hydrogen 2.714 N/A HIS 170.A N LYS 173.A O no hydrogen 2.861 N/A LYS 173.A N HIS 170.A O no hydrogen 2.983 N/A HIS 175.A N ARG 168.A O no hydrogen 2.870 N/A LEU 177.A N TRP 166.A O no hydrogen 2.877 N/A LEU 178.A N TRP 166.A O no hydrogen 3.213 N/A ALA 180.A N LEU 164.A O no hydrogen 2.962 N/A THR 181.A OG1 THR 181.A O no hydrogen 2.522 N/A THR 181.A OG1 LEU 184.A O no hydrogen 2.870 N/A LEU 184.A N THR 181.A O no hydrogen 3.018 N/A GLN 192.A N LEU 177.A O no hydrogen 2.696 N/A ALA 195.A N GLN 192.A O no hydrogen 2.957 N/A VAL 196.A N TRP 217.A O no hydrogen 3.208 N/A PHE 198.A N THR 215.A O no hydrogen 3.030 N/A ALA 200.A N ASN 213.A O no hydrogen 2.978 N/A TRP 201.A NE1 PRO 160.A O no hydrogen 2.714 N/A ASP 202.A N THR 211.A O no hydrogen 2.658 N/A GLU 205.A N ASP 203.A OD2 no hydrogen 3.110 N/A TRP 210.A N TYR 150.A O no hydrogen 2.948 N/A TRP 210.A NE1 GLU 205.A O no hydrogen 2.847 N/A THR 211.A OG1 ASP 202.A OD2 no hydrogen 2.354 N/A GLY 212.A N PHE 148.A O no hydrogen 2.724 N/A ASN 213.A N ALA 200.A O no hydrogen 2.780 N/A GLY 214.A N LEU 146.A O no hydrogen 2.955 N/A THR 215.A N ASN 213.A OD1 no hydrogen 2.888 N/A PHE 216.A N LEU 144.A O no hydrogen 2.961 N/A TRP 217.A N VAL 196.A O no hydrogen 2.860 N/A TRP 217.A NE1 ASP 141.A OD2 no hydrogen 3.000 N/A LEU 218.A N ALA 142.A O no hydrogen 2.853 N/A ARG 220.A N ASP 141.A OD1 no hydrogen 2.691 N/A VAL 221.A N GLN 140.A O no hydrogen 2.760 N/A GLN 222.A N GLN 225.A OE1 no hydrogen 2.892 N/A GLN 225.A N GLN 222.A O no hydrogen 3.009 N/A GLN 225.A NE2 GLU 193.A OE2 no hydrogen 2.804 N/A GLU 226.A N PRO 223.A O no hydrogen 3.070 N/A GLY 227.A N LEU 246.A O no hydrogen 2.968 N/A THR 228.A OG1 GLU 245.A OE1 no hydrogen 2.709 N/A THR 228.A OG1 GLU 245.A OE2 no hydrogen 3.540 N/A TYR 229.A N LEU 244.A O no hydrogen 2.825 N/A TYR 229.A OH GLN 225.A O no hydrogen 2.603 N/A LEU 230.A N ARG 167.A O no hydrogen 2.865 N/A ALA 231.A N VAL 242.A O no hydrogen 2.988 N/A THR 232.A N GLU 165.A O no hydrogen 2.829 N/A ILE 233.A N GLY 240.A O no hydrogen 3.000 N/A HIS 234.A N GLY 163.A O no hydrogen 2.627 N/A LEU 235.A N LEU 238.A O no hydrogen 2.733 N/A TYR 237.A OH ASN 80.A O no hydrogen 2.884 N/A LEU 238.A N LEU 235.A O no hydrogen 2.643 N/A GLN 239.A NE2 LEU 65.A O no hydrogen 3.608 N/A GLY 240.A N ILE 233.A O no hydrogen 3.098 N/A VAL 242.A N ALA 231.A O no hydrogen 3.010 N/A LEU 244.A N TYR 229.A O no hydrogen 2.819 N/A GLU 245.A N PRO 132.A O no hydrogen 2.792 N/A LEU 246.A N GLY 227.A O no hydrogen 2.905 N/A ALA 247.A N PRO 134.A O no hydrogen 2.907 N/A VAL 248.A N GLU 226.A OE1 no hydrogen 2.825 N/A TYR 249.A N VAL 136.A O no hydrogen 3.208 N/A LYS 250.A N TYR 281.A O no hydrogen 2.961 N/A LYS 253.A N SER 278.A O no hydrogen 3.105 N/A SER 255.A N LEU 276.A O no hydrogen 3.182 N/A MET 257.A N LEU 274.A O no hydrogen 2.981 N/A GLY 267.A N VAL 331.A O no hydrogen 3.018 N/A GLU 268.A N ALA 265.A O no hydrogen 3.091 N/A LEU 273.A N LEU 326.A O no hydrogen 2.822 N/A LEU 274.A N MET 257.A O no hydrogen 2.763 N/A CYS 275.A N GLY 324.A O no hydrogen 2.729 N/A LEU 276.A N SER 255.A O no hydrogen 2.788 N/A VAL 277.A N LEU 322.A O no hydrogen 2.916 N/A SER 278.A N LYS 253.A O no hydrogen 2.932 N/A HIS 279.A N SER 321.A OG no hydrogen 2.918 N/A PHE 280.A N VAL 320.A O no hydrogen 2.826 N/A TYR 281.A N LYS 250.A O no hydrogen 2.923 N/A TYR 281.A OH GLU 226.A OE2 no hydrogen 2.692 N/A GLU 287.A N HIS 345.A O no hydrogen 2.928 N/A GLU 289.A N ARG 343.A O no hydrogen 2.934 N/A GLU 291.A N ALA 341.A O no hydrogen 2.766 N/A LEU 292.A N GLN 301.A O no hydrogen 2.812 N/A ARG 293.A N ARG 339.A O no hydrogen 2.708 N/A ARG 293.A NE GLU 291.A OE1 no hydrogen 2.856 N/A ARG 293.A NH1 GLU 291.A OE1 no hydrogen 2.868 N/A ARG 293.A NH1 SER 355.A OG no hydrogen 2.939 N/A ARG 293.A NH2 GLU 357.A OE1 no hydrogen 3.120 N/A ALA 303.A N TRP 290.A O no hydrogen 3.108 N/A GLN 306.A N GLN 327.A O no hydrogen 3.160 N/A ARG 307.A NH1 ALA 303.A O no hydrogen 3.382 N/A ARG 307.A NH2 ALA 303.A O no hydrogen 2.783 N/A ARG 307.A NH2 GLY 305.A O no hydrogen 3.090 N/A TRP 308.A N HIS 325.A O no hydrogen 3.106 N/A SER 310.A N SER 323.A O no hydrogen 2.896 N/A SER 310.A OG ALA 311.A O no hydrogen 2.833 N/A SER 310.A OG SER 323.A O no hydrogen 3.559 N/A ARG 313.A N SER 321.A O no hydrogen 2.832 N/A ARG 313.A NH1 SER 323.A OG no hydrogen 3.188 N/A ARG 313.A NH2 SER 323.A OG no hydrogen 2.919 N/A HIS 315.A N SER 319.A O no hydrogen 3.164 N/A HIS 315.A NE2 SER 321.A OG no hydrogen 2.820 N/A GLY 318.A N HIS 315.A O no hydrogen 2.994 N/A SER 319.A N ASP 317.A OD1 no hydrogen 2.903 N/A SER 319.A OG ASP 317.A OD1 no hydrogen 2.638 N/A SER 319.A OG ASP 317.A OD2 no hydrogen 3.471 N/A VAL 320.A N PHE 280.A O no hydrogen 2.828 N/A SER 321.A N ARG 313.A O no hydrogen 2.894 N/A SER 321.A OG HIS 315.A NE2 no hydrogen 2.820 N/A LEU 322.A N VAL 277.A O no hydrogen 3.062 N/A SER 323.A N SER 310.A OG no hydrogen 2.733 N/A GLY 324.A N CYS 275.A O no hydrogen 2.908 N/A HIS 325.A N TRP 308.A O no hydrogen 3.001 N/A LEU 326.A N LEU 273.A O no hydrogen 3.036 N/A GLN 327.A N GLN 306.A O no hydrogen 2.699 N/A VAL 331.A N GLU 268.A O no hydrogen 2.673 N/A GLN 335.A N THR 332.A O no hydrogen 3.215 N/A HIS 336.A N THR 333.A O no hydrogen 3.223 N/A GLY 337.A N LEU 360.A O no hydrogen 3.092 N/A ALA 338.A N GLN 335.A O no hydrogen 2.776 N/A ARG 339.A N ARG 293.A O no hydrogen 2.898 N/A ARG 339.A NE GLU 357.A OE1 no hydrogen 3.490 N/A ARG 339.A NE GLU 357.A OE2 no hydrogen 3.167 N/A ARG 339.A NH2 GLU 357.A OE1 no hydrogen 3.228 N/A TYR 340.A N VAL 358.A O no hydrogen 2.799 N/A ALA 341.A N GLU 291.A O no hydrogen 2.965 N/A CYS 342.A N ALA 356.A O no hydrogen 2.967 N/A ARG 343.A N GLU 289.A O no hydrogen 2.651 N/A ARG 343.A NE GLU 291.A OE2 no hydrogen 2.937 N/A ARG 343.A NH2 GLU 291.A OE2 no hydrogen 3.047 N/A ILE 344.A N ARG 354.A O no hydrogen 2.750 N/A HIS 345.A N GLU 287.A O no hydrogen 3.002 N/A HIS 346.A ND1 SER 348.A OG no hydrogen 2.618 N/A HIS 346.A NE2 PRO 282.A O no hydrogen 2.819 N/A SER 348.A N HIS 346.A ND1 no hydrogen 3.212 N/A SER 348.A OG HIS 346.A ND1 no hydrogen 2.618 N/A LEU 349.A N HIS 346.A O no hydrogen 2.563 N/A GLY 353.A N PRO 350.A O no hydrogen 3.043 N/A ARG 354.A N ILE 344.A O no hydrogen 3.023 N/A ARG 354.A NE PRO 252.A O no hydrogen 3.371 N/A ARG 354.A NH2 PRO 252.A O no hydrogen 3.336 N/A ALA 356.A N CYS 342.A O no hydrogen 3.338 N/A VAL 358.A N TYR 340.A O no hydrogen 2.826 N/A LEU 360.A N ALA 338.A O no hydrogen 2.911 N/A