Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4bru_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A N ASP 5.A OD2 no hydrogen 3.430 N/A ASP 5.A N THR 2.A O no hydrogen 3.312 N/A LYS 9.A N GLU 61.A OE1 no hydrogen 2.988 N/A LEU 13.A N LYS 9.A O no hydrogen 3.143 N/A MET 14.A N ARG 10.A O no hydrogen 2.892 N/A GLY 15.A N GLU 11.A O no hydrogen 2.917 N/A ILE 16.A N LEU 12.A O no hydrogen 2.910 N/A PHE 17.A N LEU 13.A O no hydrogen 2.915 N/A GLU 18.A N MET 14.A O no hydrogen 2.904 N/A ALA 19.A N GLY 15.A O no hydrogen 2.928 N/A GLY 20.A N ILE 16.A O no hydrogen 2.948 N/A GLY 20.A N PHE 17.A O no hydrogen 3.172 N/A SER 25.A N GLN 28.A OE1 no hydrogen 3.038 N/A GLN 28.A N SER 25.A O no hydrogen 2.973 N/A GLN 28.A NE2 GLY 50.A O no hydrogen 2.713 N/A GLU 29.A N SER 25.A O no hydrogen 3.107 N/A GLU 30.A N PRO 26.A O no hydrogen 2.929 N/A ALA 31.A N ILE 27.A O no hydrogen 2.922 N/A ILE 32.A N GLN 28.A O no hydrogen 2.937 N/A ALA 35.A N ALA 31.A O no hydrogen 2.789 N/A ILE 36.A N ILE 32.A O no hydrogen 3.130 N/A THR 37.A N VAL 34.A O no hydrogen 3.450 N/A THR 37.A OG1 VAL 34.A O no hydrogen 2.651 N/A GLY 38.A N ALA 35.A O no hydrogen 3.182 N/A ARG 39.A NE LYS 198.A O no hydrogen 2.833 N/A ILE 41.A N SER 177.A O no hydrogen 3.052 N/A LEU 42.A N TYR 200.A O no hydrogen 3.425 N/A ALA 43.A N LEU 179.A O no hydrogen 2.983 N/A ARG 44.A N ILE 202.A O no hydrogen 2.858 N/A ARG 44.A NE ALA 182.A O no hydrogen 2.927 N/A ARG 44.A NH1 GLU 206.A O no hydrogen 2.855 N/A ARG 44.A NH2 GLU 206.A O no hydrogen 3.131 N/A ALA 45.A N SER 181.A O no hydrogen 3.161 N/A LYS 46.A NZ GLU 320.A OE2 no hydrogen 3.029 N/A ASN 47.A N GLU 356.A O no hydrogen 2.718 N/A ASN 47.A ND2 GLU 151.A OE2 no hydrogen 3.187 N/A ASN 47.A ND2 GLN 355.A O no hydrogen 3.083 N/A LYS 51.A NZ ASP 150.A OD1 no hydrogen 2.552 N/A THR 52.A N GLY 48.A O no hydrogen 3.015 N/A THR 52.A OG1 GLY 48.A O no hydrogen 3.506 N/A ALA 53.A N THR 49.A O no hydrogen 2.900 N/A ALA 54.A N GLY 50.A O no hydrogen 2.912 N/A PHE 55.A N LYS 51.A O no hydrogen 2.998 N/A VAL 56.A N THR 52.A O no hydrogen 2.855 N/A ILE 57.A N ALA 53.A O no hydrogen 2.913 N/A THR 59.A N PHE 55.A O no hydrogen 3.162 N/A THR 59.A OG1 PHE 55.A O no hydrogen 2.908 N/A LEU 60.A N VAL 56.A O no hydrogen 2.899 N/A GLU 61.A N ILE 57.A O no hydrogen 3.056 N/A LYS 62.A N PRO 58.A O no hydrogen 2.896 N/A VAL 63.A N THR 59.A O no hydrogen 3.061 N/A LYS 64.A N GLN 71.A OE1 no hydrogen 2.680 N/A LEU 67.A N LYS 64.A O no hydrogen 3.324 N/A LYS 69.A NZ ASP 140.A OD2 no hydrogen 2.551 N/A GLN 71.A N HIS 121.A O no hydrogen 2.754 N/A GLN 71.A NE2 LYS 64.A O no hydrogen 2.898 N/A GLN 71.A NE2 LEU 67.A O no hydrogen 2.922 N/A LEU 73.A N LEU 146.A O no hydrogen 2.891 N/A ILE 74.A N LEU 123.A O no hydrogen 2.788 N/A MET 75.A N ILE 148.A O no hydrogen 2.675 N/A VAL 76.A N GLY 125.A O no hydrogen 3.175 N/A LEU 81.A N THR 78.A OG1 no hydrogen 3.334 N/A ALA 82.A N THR 78.A O no hydrogen 3.300 N/A LEU 83.A N ARG 79.A O no hydrogen 2.888 N/A GLN 84.A N GLU 80.A O no hydrogen 2.936 N/A THR 85.A N LEU 81.A O no hydrogen 2.904 N/A THR 85.A OG1 LEU 81.A O no hydrogen 2.712 N/A SER 86.A N ALA 82.A O no hydrogen 2.936 N/A SER 86.A OG ALA 82.A O no hydrogen 3.004 N/A SER 86.A OG LEU 83.A O no hydrogen 2.795 N/A GLN 87.A N LEU 83.A O no hydrogen 2.887 N/A VAL 88.A N GLN 84.A O no hydrogen 2.980 N/A VAL 89.A N THR 85.A O no hydrogen 2.897 N/A ARG 90.A N SER 86.A O no hydrogen 2.896 N/A THR 91.A N GLN 87.A O no hydrogen 2.918 N/A THR 91.A OG1 GLN 87.A O no hydrogen 2.722 N/A THR 91.A OG1 GLN 87.A OE1 no hydrogen 3.027 N/A LEU 92.A N VAL 88.A O no hydrogen 2.922 N/A GLY 93.A N VAL 89.A O no hydrogen 2.854 N/A LYS 94.A N THR 91.A O no hydrogen 3.244 N/A LYS 94.A NZ GLU 18.A OE1 no hydrogen 2.698 N/A CYS 96.A N GLY 93.A O no hydrogen 3.450 N/A SER 99.A N HIS 121.A ND1 no hydrogen 3.013 N/A SER 99.A OG THR 119.A O no hydrogen 2.886 N/A CYS 100.A SG ILE 122.A O no hydrogen 3.602 N/A MET 101.A N ILE 122.A O no hydrogen 3.134 N/A THR 103.A N VAL 124.A O no hydrogen 2.923 N/A THR 103.A OG1 ASP 112.A OD2 no hydrogen 3.130 N/A THR 107.A OG1 THR 104.A O no hydrogen 3.038 N/A THR 107.A OG1 ASP 112.A OD2 no hydrogen 2.788 N/A ARG 110.A N ASN 108.A OD1 no hydrogen 3.135 N/A ASP 112.A N ASN 108.A O no hydrogen 3.282 N/A ASP 112.A N LEU 109.A O no hydrogen 3.216 N/A ILE 113.A N LEU 109.A O no hydrogen 2.931 N/A LEU 114.A N ARG 110.A O no hydrogen 2.920 N/A ARG 115.A N ASP 111.A O no hydrogen 2.920 N/A ARG 115.A NH1 ARG 115.A O no hydrogen 3.263 N/A ARG 115.A NH1 THR 119.A O no hydrogen 3.395 N/A ARG 115.A NH2 SER 99.A OG no hydrogen 2.984 N/A LEU 116.A N ASP 112.A O no hydrogen 2.912 N/A ASN 117.A N LEU 114.A O no hydrogen 3.273 N/A ASN 117.A ND2 LEU 114.A O no hydrogen 3.426 N/A GLU 118.A N ARG 115.A O no hydrogen 3.112 N/A HIS 121.A N SER 99.A O no hydrogen 2.930 N/A HIS 121.A NE2 PRO 65.A O no hydrogen 3.031 N/A ILE 122.A N SER 99.A O no hydrogen 3.088 N/A LEU 123.A N ALA 72.A O no hydrogen 2.846 N/A VAL 124.A N MET 101.A O no hydrogen 2.899 N/A GLY 125.A N ILE 74.A O no hydrogen 3.235 N/A THR 126.A N THR 103.A O no hydrogen 3.411 N/A ARG 129.A NE THR 104.A O no hydrogen 2.448 N/A ARG 129.A NH2 THR 104.A O no hydrogen 3.321 N/A ARG 129.A NH2 GLY 105.A O no hydrogen 3.526 N/A VAL 130.A N THR 126.A O no hydrogen 3.045 N/A LEU 131.A N PRO 127.A O no hydrogen 2.932 N/A ASP 132.A N GLY 128.A O no hydrogen 2.913 N/A LEU 133.A N ARG 129.A O no hydrogen 2.935 N/A ALA 134.A N VAL 130.A O no hydrogen 2.897 N/A SER 135.A N LEU 131.A O no hydrogen 2.910 N/A ARG 136.A N ASP 132.A O no hydrogen 2.987 N/A LYS 137.A N ALA 134.A O no hydrogen 3.119 N/A ALA 139.A N LEU 133.A O no hydrogen 3.223 N/A SER 142.A N ASP 140.A OD1 no hydrogen 2.990 N/A SER 142.A OG ASP 140.A OD1 no hydrogen 2.707 N/A SER 142.A OG ASP 140.A OD2 no hydrogen 3.357 N/A CYS 144.A N LEU 141.A O no hydrogen 3.304 N/A CYS 144.A SG LEU 146.A O no hydrogen 3.698 N/A SER 145.A OG ASP 143.A O no hydrogen 3.438 N/A PHE 147.A N GLN 176.A O no hydrogen 2.778 N/A ILE 148.A N LEU 73.A O no hydrogen 2.830 N/A MET 149.A N LEU 178.A O no hydrogen 2.768 N/A ASP 150.A N MET 75.A O no hydrogen 3.154 N/A GLU 151.A N ASP 150.A OD1 no hydrogen 2.754 N/A ALA 152.A N PHE 180.A O no hydrogen 2.889 N/A LYS 154.A N GLU 151.A O no hydrogen 2.960 N/A LYS 154.A NZ GLU 151.A OE1 no hydrogen 2.682 N/A LYS 154.A NZ ASP 153.A OD1 no hydrogen 2.896 N/A LYS 154.A NZ ASP 153.A OD2 no hydrogen 3.318 N/A LYS 154.A NZ GLY 358.A O no hydrogen 3.241 N/A MET 155.A N ALA 152.A O no hydrogen 2.927 N/A SER 157.A OG ASP 159.A OD1 no hydrogen 2.590 N/A LYS 161.A N SER 157.A O no hydrogen 3.070 N/A ILE 164.A N PHE 160.A O no hydrogen 2.875 N/A GLU 165.A N LYS 161.A O no hydrogen 2.939 N/A GLN 166.A N THR 162.A O no hydrogen 2.907 N/A ILE 167.A N ILE 163.A O no hydrogen 2.903 N/A LEU 168.A N ILE 164.A O no hydrogen 2.911 N/A PHE 170.A N ILE 167.A O no hydrogen 3.004 N/A HIS 175.A ND1 PRO 172.A O no hydrogen 2.815 N/A GLN 176.A N SER 145.A O no hydrogen 2.886 N/A GLN 176.A NE2 ALA 35.A O no hydrogen 2.829 N/A GLN 176.A NE2 ARG 39.A O no hydrogen 2.946 N/A SER 177.A N ASP 40.A OD1 no hydrogen 3.229 N/A LEU 178.A N PHE 147.A O no hydrogen 2.791 N/A LEU 179.A N ILE 41.A O no hydrogen 2.961 N/A PHE 180.A N MET 149.A O no hydrogen 2.749 N/A SER 181.A N ALA 43.A O no hydrogen 3.101 N/A SER 181.A OG ASP 153.A OD2 no hydrogen 2.793 N/A SER 181.A OG THR 183.A O no hydrogen 3.232 N/A THR 183.A N SER 181.A OG no hydrogen 3.235 N/A GLU 190.A N GLU 190.A OE1 no hydrogen 2.703 N/A ASP 193.A N ASP 189.A O no hydrogen 2.870 N/A LYS 194.A N GLU 190.A O no hydrogen 2.948 N/A HIS 195.A N PHE 191.A O no hydrogen 2.900 N/A HIS 195.A NE2 GLU 165.A OE1 no hydrogen 3.313 N/A LEU 196.A N MET 192.A O no hydrogen 2.812 N/A HIS 197.A N ASP 40.A OD2 no hydrogen 3.289 N/A TYR 200.A N ASP 40.A O no hydrogen 2.920 N/A TYR 200.A OH GLU 30.A OE1 no hydrogen 3.305 N/A ILE 202.A N LEU 42.A O no hydrogen 2.938 N/A LEU 204.A N ARG 44.A O no hydrogen 2.867 N/A MET 205.A N ASN 203.A OD1 no hydrogen 3.211 N/A GLU 207.A N GLU 207.A OE1 no hydrogen 2.573 N/A THR 209.A N ARG 328.A O no hydrogen 2.834 N/A LYS 211.A N THR 209.A OG1 no hydrogen 2.950 N/A ILE 213.A N LEU 210.A O no hydrogen 3.186 N/A THR 214.A N GLY 336.A O no hydrogen 2.939 N/A TYR 216.A N ALA 338.A O no hydrogen 2.868 N/A TYR 217.A N ALA 362.A O no hydrogen 2.965 N/A ALA 218.A N ASN 340.A O no hydrogen 2.887 N/A VAL 220.A N ILE 342.A O no hydrogen 3.163 N/A GLN 224.A N GLU 221.A O no hydrogen 3.108 N/A LYS 225.A NZ GLU 222.A OE1 no hydrogen 3.106 N/A LYS 225.A NZ PHE 313.A O no hydrogen 3.197 N/A LYS 225.A NZ ASP 314.A OD1 no hydrogen 3.097 N/A CYS 228.A N GLN 224.A O no hydrogen 3.152 N/A LEU 229.A N LYS 225.A O no hydrogen 2.888 N/A ASN 230.A N LEU 226.A O no hydrogen 2.924 N/A THR 231.A N HIS 227.A O no hydrogen 2.921 N/A THR 231.A OG1 HIS 227.A O no hydrogen 2.819 N/A LEU 232.A N CYS 228.A O no hydrogen 2.923 N/A PHE 233.A N LEU 229.A O no hydrogen 2.914 N/A SER 234.A N ASN 230.A O no hydrogen 2.915 N/A SER 234.A OG ASN 230.A O no hydrogen 2.706 N/A SER 234.A OG ASN 230.A OD1 no hydrogen 3.328 N/A LYS 235.A N THR 231.A O no hydrogen 2.917 N/A LYS 235.A N LEU 232.A O no hydrogen 3.097 N/A LEU 236.A N LEU 232.A O no hydrogen 2.813 N/A GLN 237.A N TYR 373.A OH no hydrogen 3.466 N/A GLN 240.A N ASN 308.A OD1 no hydrogen 3.493 N/A GLN 240.A NE2 PHE 284.A O no hydrogen 2.502 N/A ALA 241.A N ARG 290.A O no hydrogen 3.293 N/A ILE 242.A N VAL 309.A O no hydrogen 3.139 N/A ILE 243.A N LEU 292.A O no hydrogen 2.624 N/A PHE 244.A N ILE 311.A O no hydrogen 2.780 N/A ASN 246.A N ASP 314.A OD2 no hydrogen 2.983 N/A ASN 246.A ND2 PHE 315.A O no hydrogen 2.999 N/A ARG 250.A NE ASP 314.A OD2 no hydrogen 3.007 N/A ARG 250.A NH1 GLU 222.A OE2 no hydrogen 3.355 N/A ARG 250.A NH2 GLU 222.A OE2 no hydrogen 2.799 N/A ARG 250.A NH2 ASP 314.A OD1 no hydrogen 3.035 N/A VAL 251.A N SER 247.A O no hydrogen 2.872 N/A GLU 252.A N THR 248.A O no hydrogen 2.911 N/A LEU 253.A N ASN 249.A O no hydrogen 2.908 N/A LEU 254.A N ARG 250.A O no hydrogen 2.913 N/A ALA 255.A N VAL 251.A O no hydrogen 2.906 N/A LYS 256.A N GLU 252.A O no hydrogen 2.912 N/A LYS 257.A N LEU 253.A O no hydrogen 2.920 N/A ILE 258.A N LEU 254.A O no hydrogen 2.875 N/A THR 259.A N ALA 255.A O no hydrogen 2.935 N/A THR 259.A OG1 ALA 255.A O no hydrogen 3.181 N/A THR 259.A OG1 LYS 256.A O no hydrogen 2.680 N/A ASP 260.A N LYS 256.A O no hydrogen 2.917 N/A LEU 261.A N LYS 257.A O no hydrogen 2.923 N/A GLY 262.A N ILE 258.A O no hydrogen 3.161 N/A TYR 263.A N ILE 258.A O no hydrogen 3.229 N/A CYS 265.A SG ALA 255.A O no hydrogen 3.308 N/A CYS 265.A SG TYR 263.A O no hydrogen 4.022 N/A TYR 266.A N THR 291.A O no hydrogen 3.046 N/A SER 268.A N VAL 293.A O no hydrogen 3.120 N/A MET 272.A N HIS 269.A O no hydrogen 3.317 N/A ARG 277.A N LYS 273.A O no hydrogen 2.983 N/A ASN 278.A N GLN 274.A O no hydrogen 2.926 N/A ASN 278.A ND2 GLN 274.A O no hydrogen 2.381 N/A LYS 279.A N GLN 275.A O no hydrogen 2.902 N/A VAL 280.A N GLU 276.A O no hydrogen 2.916 N/A PHE 281.A N ARG 277.A O no hydrogen 2.891 N/A HIS 282.A N ASN 278.A O no hydrogen 2.931 N/A GLU 283.A N LYS 279.A O no hydrogen 2.878 N/A PHE 284.A N VAL 280.A O no hydrogen 2.898 N/A ARG 285.A N PHE 281.A O no hydrogen 2.919 N/A GLN 286.A N HIS 282.A O no hydrogen 2.920 N/A GLY 287.A N GLU 283.A O no hydrogen 3.378 N/A ARG 290.A N SER 264.A O no hydrogen 3.259 N/A LEU 292.A N ALA 241.A O no hydrogen 2.958 N/A VAL 293.A N TYR 266.A O no hydrogen 3.036 N/A CYS 294.A N ILE 243.A O no hydrogen 2.955 N/A CYS 294.A SG ILE 243.A O no hydrogen 3.992 N/A SER 295.A N SER 268.A O no hydrogen 3.225 N/A LEU 298.A N ASP 296.A OD2 no hydrogen 3.022 N/A ASN 308.A N GLN 240.A O no hydrogen 3.136 N/A ASN 308.A ND2 GLN 237.A O no hydrogen 3.135 N/A ASN 308.A ND2 TYR 373.A O no hydrogen 2.686 N/A VAL 310.A N LEU 337.A O no hydrogen 2.718 N/A ILE 311.A N ILE 242.A O no hydrogen 2.980 N/A ASN 312.A N ILE 339.A O no hydrogen 2.863 N/A ASN 312.A ND2 ASN 340.A OD1 no hydrogen 2.963 N/A ASP 314.A N PHE 244.A O no hydrogen 3.292 N/A THR 318.A OG1 THR 321.A OG1 no hydrogen 2.980 N/A GLU 320.A N GLU 320.A OE1 no hydrogen 2.815 N/A THR 321.A OG1 THR 318.A OG1 no hydrogen 2.980 N/A TYR 322.A N THR 318.A O no hydrogen 3.133 N/A LEU 323.A N ALA 319.A O no hydrogen 2.910 N/A HIS 324.A N GLU 320.A O no hydrogen 2.930 N/A HIS 324.A NE2 LEU 297.A O no hydrogen 2.744 N/A ARG 325.A N THR 321.A O no hydrogen 2.913 N/A ARG 325.A NH1 ASN 246.A OD1 no hydrogen 3.129 N/A ARG 325.A NH1 ASN 312.A OD1 no hydrogen 2.848 N/A ARG 325.A NH1 ASP 314.A O no hydrogen 3.052 N/A ARG 325.A NH2 ASN 246.A OD1 no hydrogen 2.835 N/A ILE 326.A N TYR 322.A O no hydrogen 2.890 N/A GLY 327.A N LEU 323.A O no hydrogen 2.642 N/A ARG 328.A N THR 209.A O no hydrogen 3.077 N/A HIS 334.A N PHE 332.A O no hydrogen 2.488 N/A ALA 338.A N THR 214.A O no hydrogen 2.916 N/A ILE 339.A N VAL 310.A O no hydrogen 2.883 N/A ASN 340.A N TYR 216.A O no hydrogen 2.891 N/A ASN 340.A ND2 TYR 216.A O no hydrogen 3.428 N/A ASN 340.A ND2 TYR 322.A OH no hydrogen 3.509 N/A LEU 341.A N ASN 312.A O no hydrogen 2.914 N/A ILE 342.A N ALA 218.A O no hydrogen 2.915 N/A ASN 343.A N ASP 346.A OD2 no hydrogen 3.410 N/A TRP 344.A N ASN 343.A OD1 no hydrogen 2.424 N/A ASN 345.A N ASN 343.A OD1 no hydrogen 3.445 N/A ASP 346.A N ASN 343.A O no hydrogen 3.175 N/A LEU 350.A N ASP 346.A O no hydrogen 2.847 N/A TYR 351.A N ARG 347.A O no hydrogen 3.468 N/A LYS 352.A N PHE 348.A O no hydrogen 2.788 N/A LYS 352.A NZ LYS 317.A O no hydrogen 3.144 N/A LYS 352.A NZ ASN 349.A OD1 no hydrogen 3.483 N/A ILE 353.A N ASN 349.A O no hydrogen 3.005 N/A GLU 354.A N LEU 350.A O no hydrogen 3.016 N/A GLN 355.A N TYR 351.A O no hydrogen 3.148 N/A GLN 355.A N LYS 352.A O no hydrogen 2.905 N/A GLU 356.A N LYS 352.A O no hydrogen 2.797 N/A LEU 357.A N ILE 353.A O no hydrogen 3.028 N/A GLY 358.A N GLN 355.A O no hydrogen 3.187 N/A THR 359.A N GLU 354.A O no hydrogen 3.203 N/A THR 359.A OG1 GLN 215.A OE1 no hydrogen 2.839 N/A ALA 362.A N GLN 215.A O no hydrogen 3.238 N/A ILE 364.A N TYR 217.A O no hydrogen 3.035 N/A SER 371.A N ASP 369.A OD1 no hydrogen 2.763 N/A LEU 372.A N ASP 369.A O no hydrogen 3.248 N/A