Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8yy8_R.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 1.A N GLU 18.A OE1 no hydrogen 3.427 N/A CYS 1.A SG ARG 19.A O no hydrogen 3.218 N/A ARG 3.A NH1 ASP 113.A OD2 no hydrogen 3.389 N/A LEU 5.A N PRO 2.A O no hydrogen 3.336 N/A VAL 7.A N ASP 20.A O no hydrogen 2.700 N/A LEU 11.A N PRO 8.A O no hydrogen 3.322 N/A TYR 13.A OH GLN 120.A O no hydrogen 3.273 N/A ARG 14.A N GLN 120.A OE1 no hydrogen 2.848 N/A ARG 14.A NH2 GLY 17.A O no hydrogen 3.332 N/A PHE 15.A N GLU 18.A O no hydrogen 3.049 N/A GLU 18.A N PHE 15.A O no hydrogen 3.075 N/A ASP 20.A N TYR 13.A O no hydrogen 2.591 N/A CYS 25.A N ARG 116.A O no hydrogen 2.602 N/A GLU 26.A N GLY 32.A O no hydrogen 2.820 N/A ARG 29.A NH2 GLU 26.A OE1 no hydrogen 2.952 N/A LYS 37.A N GLU 40.A OE1 no hydrogen 2.917 N/A ARG 41.A N LYS 37.A O no hydrogen 2.932 N/A ARG 41.A NH2 ASP 102.A OD2 no hydrogen 3.103 N/A ARG 41.A NH2 LEU 197.A O no hydrogen 3.302 N/A ARG 42.A N GLU 38.A O no hydrogen 2.935 N/A ARG 42.A NE GLU 38.A OE2 no hydrogen 3.350 N/A ARG 42.A NH2 GLU 38.A OE2 no hydrogen 2.874 N/A PHE 43.A N GLU 39.A O no hydrogen 2.928 N/A ALA 44.A N GLU 40.A O no hydrogen 2.875 N/A ARG 45.A N ARG 41.A O no hydrogen 2.899 N/A ARG 45.A NH2 ASP 102.A OD1 no hydrogen 3.129 N/A LEU 46.A N ARG 42.A O no hydrogen 2.976 N/A TRP 47.A N PHE 43.A O no hydrogen 2.906 N/A VAL 48.A N ALA 44.A O no hydrogen 2.919 N/A GLY 49.A N ARG 45.A O no hydrogen 2.913 N/A VAL 50.A N LEU 46.A O no hydrogen 2.965 N/A TRP 51.A N TRP 47.A O no hydrogen 3.003 N/A SER 52.A N VAL 48.A O no hydrogen 2.863 N/A SER 52.A OG VAL 48.A O no hydrogen 2.343 N/A VAL 53.A N GLY 49.A O no hydrogen 2.931 N/A LEU 54.A N VAL 50.A O no hydrogen 3.013 N/A CYS 55.A N TRP 51.A O no hydrogen 2.921 N/A CYS 56.A N SER 52.A O no hydrogen 2.860 N/A CYS 56.A SG SER 52.A O no hydrogen 3.420 N/A CYS 56.A SG PHE 88.A O no hydrogen 3.887 N/A ALA 57.A N VAL 53.A O no hydrogen 2.934 N/A SER 58.A N LEU 54.A O no hydrogen 2.993 N/A SER 58.A OG ILE 316.A O no hydrogen 3.508 N/A THR 59.A N CYS 55.A O no hydrogen 2.948 N/A THR 59.A OG1 CYS 55.A O no hydrogen 2.429 N/A THR 59.A OG1 CYS 56.A O no hydrogen 3.317 N/A LEU 60.A N CYS 56.A O no hydrogen 2.854 N/A PHE 61.A N ALA 57.A O no hydrogen 2.942 N/A THR 62.A N SER 58.A O no hydrogen 3.007 N/A THR 62.A OG1 SER 58.A O no hydrogen 3.134 N/A VAL 63.A N THR 59.A O no hydrogen 2.918 N/A LEU 64.A N LEU 60.A O no hydrogen 2.892 N/A THR 65.A N PHE 61.A O no hydrogen 2.898 N/A THR 65.A OG1 PHE 61.A O no hydrogen 2.581 N/A TYR 66.A N THR 62.A O no hydrogen 2.995 N/A LEU 67.A N VAL 63.A O no hydrogen 2.916 N/A VAL 68.A N LEU 64.A O no hydrogen 2.901 N/A VAL 68.A N THR 65.A O no hydrogen 3.209 N/A ASP 69.A N THR 65.A O no hydrogen 3.314 N/A ARG 71.A N ASP 69.A OD1 no hydrogen 2.684 N/A ARG 72.A N ASP 69.A OD1 no hydrogen 3.208 N/A GLU 77.A N SER 74.A O no hydrogen 2.700 N/A ARG 78.A N SER 74.A O no hydrogen 2.647 N/A ARG 78.A NE PHE 73.A O no hydrogen 3.103 N/A ARG 78.A NH2 MET 70.A O no hydrogen 3.376 N/A PHE 82.A N ARG 78.A O no hydrogen 3.400 N/A LEU 83.A N PRO 79.A O no hydrogen 2.711 N/A SER 84.A N ILE 80.A O no hydrogen 2.670 N/A SER 84.A OG ILE 80.A O no hydrogen 3.306 N/A SER 84.A OG THR 318.A OG1 no hydrogen 2.906 N/A GLY 85.A N ILE 81.A O no hydrogen 2.752 N/A CYS 86.A N LEU 83.A O no hydrogen 2.991 N/A CYS 86.A SG PHE 82.A O no hydrogen 3.328 N/A TYR 87.A N LEU 83.A O no hydrogen 2.891 N/A TYR 87.A OH TYR 269.A OH no hydrogen 2.955 N/A PHE 88.A N SER 84.A O no hydrogen 3.006 N/A VAL 90.A N CYS 86.A O no hydrogen 3.200 N/A ALA 91.A N TYR 87.A O no hydrogen 2.856 N/A VAL 92.A N PHE 88.A O no hydrogen 2.676 N/A ALA 93.A N MET 89.A O no hydrogen 2.831 N/A HIS 94.A N VAL 90.A O no hydrogen 3.147 N/A VAL 95.A N ALA 91.A O no hydrogen 2.586 N/A ALA 96.A N VAL 92.A O no hydrogen 2.658 N/A GLY 97.A N ALA 93.A O no hydrogen 2.856 N/A PHE 98.A N HIS 94.A O no hydrogen 2.965 N/A LEU 99.A N VAL 95.A O no hydrogen 2.952 N/A LEU 99.A N ALA 96.A O no hydrogen 2.966 N/A LEU 100.A N GLY 97.A O no hydrogen 2.977 N/A GLU 101.A N GLY 97.A O no hydrogen 2.945 N/A ARG 103.A N LEU 100.A O no hydrogen 2.970 N/A ARG 103.A NE LEU 100.A O no hydrogen 3.222 N/A VAL 107.A N THR 117.A O no hydrogen 2.624 N/A ARG 109.A NH2 GLU 26.A OE2 no hydrogen 2.395 N/A SER 111.A OG ASP 113.A OD1 no hydrogen 2.477 N/A GLY 114.A N SER 111.A O no hydrogen 3.229 N/A TYR 115.A N GLN 4.A O no hydrogen 2.836 N/A ARG 116.A N GLU 26.A OE2 no hydrogen 3.339 N/A ARG 116.A NE CYS 25.A O no hydrogen 2.694 N/A ARG 116.A NH2 CYS 25.A O no hydrogen 3.198 N/A THR 117.A N VAL 107.A O no hydrogen 3.080 N/A VAL 118.A N ALA 23.A O no hydrogen 2.856 N/A ALA 119.A N VAL 105.A O no hydrogen 2.730 N/A GLN 120.A N TYR 13.A OH no hydrogen 3.487 N/A GLN 120.A NE2 ARG 14.A O no hydrogen 2.962 N/A GLN 120.A NE2 ASP 194.A OD2 no hydrogen 3.306 N/A GLY 121.A N VAL 193.A O no hydrogen 2.806 N/A LYS 123.A NZ LEU 11.A O no hydrogen 3.186 N/A LYS 124.A NZ ARG 103.A O no hydrogen 3.308 N/A CYS 127.A SG ASP 194.A O no hydrogen 3.816 N/A THR 128.A N LYS 124.A O no hydrogen 3.152 N/A THR 128.A OG1 THR 122.A O no hydrogen 3.053 N/A THR 128.A OG1 LYS 124.A O no hydrogen 2.472 N/A ILE 129.A N GLU 125.A O no hydrogen 2.924 N/A LEU 130.A N GLY 126.A O no hydrogen 2.920 N/A PHE 131.A N CYS 127.A O no hydrogen 2.926 N/A MET 132.A N THR 128.A O no hydrogen 2.876 N/A VAL 133.A N ILE 129.A O no hydrogen 2.959 N/A LEU 134.A N LEU 130.A O no hydrogen 2.954 N/A TYR 135.A N PHE 131.A O no hydrogen 2.888 N/A TYR 135.A OH PHE 215.A O no hydrogen 2.377 N/A PHE 136.A N MET 132.A O no hydrogen 2.919 N/A PHE 137.A N VAL 133.A O no hydrogen 2.960 N/A GLY 138.A N LEU 134.A O no hydrogen 2.925 N/A MET 139.A N TYR 135.A O no hydrogen 2.958 N/A ALA 140.A N PHE 136.A O no hydrogen 2.901 N/A SER 141.A N PHE 137.A O no hydrogen 2.850 N/A SER 141.A OG PHE 137.A O no hydrogen 2.404 N/A SER 142.A N GLY 138.A O no hydrogen 3.017 N/A SER 142.A OG GLY 138.A O no hydrogen 3.327 N/A ILE 143.A N MET 139.A O no hydrogen 2.944 N/A TRP 144.A N ALA 140.A O no hydrogen 2.831 N/A TRP 145.A N SER 141.A O no hydrogen 2.925 N/A VAL 146.A N SER 142.A O no hydrogen 2.996 N/A ILE 147.A N ILE 143.A O no hydrogen 2.842 N/A LEU 148.A N TRP 144.A O no hydrogen 2.847 N/A SER 149.A N TRP 145.A O no hydrogen 2.958 N/A SER 149.A OG TRP 145.A O no hydrogen 2.910 N/A SER 149.A OG GLY 227.A O no hydrogen 3.273 N/A LEU 150.A N VAL 146.A O no hydrogen 2.889 N/A THR 151.A N ILE 147.A O no hydrogen 2.851 N/A THR 151.A OG1 ILE 147.A O no hydrogen 2.930 N/A THR 151.A OG1 LEU 148.A O no hydrogen 2.782 N/A TRP 152.A N LEU 148.A O no hydrogen 2.945 N/A PHE 153.A N SER 149.A O no hydrogen 2.903 N/A LEU 154.A N LEU 150.A O no hydrogen 2.884 N/A ALA 155.A N THR 151.A O no hydrogen 2.904 N/A ALA 156.A N TRP 152.A O no hydrogen 2.919 N/A GLY 157.A N PHE 153.A O no hydrogen 2.846 N/A MET 158.A N PHE 153.A O no hydrogen 3.372 N/A TRP 160.A N LEU 154.A O no hydrogen 2.924 N/A ASN 168.A N ILE 165.A O no hydrogen 3.140 N/A SER 169.A N GLU 166.A O no hydrogen 2.909 N/A SER 169.A OG GLU 166.A O no hydrogen 2.337 N/A TYR 171.A N ASN 168.A O no hydrogen 2.943 N/A PHE 172.A N ASN 168.A O no hydrogen 3.073 N/A HIS 173.A N SER 169.A O no hydrogen 2.820 N/A ALA 175.A N TYR 171.A O no hydrogen 3.216 N/A ALA 176.A N PHE 172.A O no hydrogen 3.299 N/A TRP 177.A N HIS 173.A O no hydrogen 3.045 N/A TRP 177.A N LEU 174.A O no hydrogen 2.976 N/A ALA 178.A N LEU 174.A O no hydrogen 2.658 N/A VAL 182.A N ALA 178.A O no hydrogen 3.056 N/A LYS 183.A N VAL 179.A O no hydrogen 3.160 N/A THR 184.A N PRO 180.A O no hydrogen 2.523 N/A THR 184.A OG1 PRO 180.A O no hydrogen 2.658 N/A ILE 185.A N ALA 181.A O no hydrogen 2.785 N/A THR 186.A N VAL 182.A O no hydrogen 3.381 N/A THR 186.A OG1 VAL 182.A O no hydrogen 2.311 N/A ILE 187.A N LYS 183.A O no hydrogen 3.068 N/A LEU 188.A N THR 184.A O no hydrogen 2.951 N/A ALA 189.A N ILE 185.A O no hydrogen 2.672 N/A MET 190.A N THR 186.A O no hydrogen 2.799 N/A GLY 191.A N ILE 187.A O no hydrogen 2.479 N/A ASP 194.A N TYR 203.A O no hydrogen 3.022 N/A GLY 195.A N ASP 194.A OD1 no hydrogen 2.737 N/A SER 199.A OG ASP 196.A O no hydrogen 3.536 N/A SER 199.A OG ASP 196.A OD2 no hydrogen 2.373 N/A GLY 200.A N ASP 196.A O no hydrogen 2.813 N/A VAL 201.A N SER 199.A OG no hydrogen 3.408 N/A CYS 202.A SG ALA 104.A O no hydrogen 3.809 N/A CYS 202.A SG ASP 194.A O no hydrogen 3.315 N/A SER 207.A OG ASP 194.A OD2 no hydrogen 2.349 N/A ALA 211.A N SER 208.A OG no hydrogen 3.229 N/A LEU 212.A N SER 208.A O no hydrogen 3.083 N/A ARG 213.A N VAL 209.A O no hydrogen 2.906 N/A ARG 213.A NE GLN 284.A OE1 no hydrogen 2.446 N/A ARG 213.A NH2 GLN 284.A OE1 no hydrogen 2.957 N/A GLY 214.A N ASP 210.A O no hydrogen 2.894 N/A PHE 215.A N ALA 211.A O no hydrogen 2.911 N/A VAL 216.A N LEU 212.A O no hydrogen 3.155 N/A LEU 217.A N LEU 212.A O no hydrogen 2.911 N/A ALA 218.A N ARG 213.A O no hydrogen 3.158 N/A LEU 220.A N VAL 216.A O no hydrogen 3.207 N/A PHE 221.A N LEU 217.A O no hydrogen 2.936 N/A VAL 222.A N ALA 218.A O no hydrogen 2.923 N/A TYR 223.A N PRO 219.A O no hydrogen 2.926 N/A LEU 224.A N LEU 220.A O no hydrogen 2.929 N/A PHE 225.A N PHE 221.A O no hydrogen 2.909 N/A ILE 226.A N VAL 222.A O no hydrogen 2.945 N/A GLY 227.A N TYR 223.A O no hydrogen 2.938 N/A THR 228.A N LEU 224.A O no hydrogen 2.899 N/A THR 228.A OG1 LEU 224.A O no hydrogen 2.662 N/A SER 229.A N PHE 225.A O no hydrogen 2.918 N/A SER 229.A OG PHE 225.A O no hydrogen 2.771 N/A PHE 230.A N ILE 226.A O no hydrogen 2.958 N/A LEU 231.A N GLY 227.A O no hydrogen 2.922 N/A LEU 232.A N THR 228.A O no hydrogen 2.891 N/A ALA 233.A N SER 229.A O no hydrogen 2.959 N/A GLY 234.A N PHE 230.A O no hydrogen 2.947 N/A PHE 235.A N LEU 231.A O no hydrogen 2.884 N/A VAL 236.A N LEU 232.A O no hydrogen 2.915 N/A SER 237.A N ALA 233.A O no hydrogen 2.992 N/A SER 237.A OG ALA 156.A O no hydrogen 3.435 N/A LEU 238.A N GLY 234.A O no hydrogen 2.886 N/A PHE 239.A N PHE 235.A O no hydrogen 2.863 N/A ARG 240.A N VAL 236.A O no hydrogen 2.966 N/A ILE 241.A N SER 237.A O no hydrogen 2.942 N/A ARG 242.A N LEU 238.A O no hydrogen 2.879 N/A ARG 242.A NE GLU 256.A OE2 no hydrogen 2.914 N/A ARG 242.A NH2 GLU 256.A OE2 no hydrogen 2.702 N/A THR 243.A N PHE 239.A O no hydrogen 2.888 N/A THR 243.A OG1 PHE 239.A O no hydrogen 2.724 N/A ILE 244.A N ARG 240.A O no hydrogen 2.970 N/A MET 245.A N ILE 241.A O no hydrogen 2.899 N/A LYS 246.A N ARG 242.A O no hydrogen 2.890 N/A HIS 247.A N THR 243.A O no hydrogen 2.911 N/A ASP 248.A N ILE 244.A O no hydrogen 2.920 N/A GLY 249.A N LYS 246.A O no hydrogen 3.424 N/A THR 250.A N MET 245.A O no hydrogen 2.705 N/A LYS 251.A NZ GLU 253.A OE1 no hydrogen 2.786 N/A THR 252.A OG1 GLU 256.A OE2 no hydrogen 3.382 N/A GLU 256.A N THR 252.A O no hydrogen 2.871 N/A LYS 257.A N GLU 253.A O no hydrogen 2.930 N/A LEU 258.A N LYS 254.A O no hydrogen 2.946 N/A MET 259.A N LEU 255.A O no hydrogen 2.859 N/A VAL 260.A N GLU 256.A O no hydrogen 2.902 N/A ARG 261.A N LYS 257.A O no hydrogen 2.976 N/A ARG 261.A NH2 TRP 321.A O no hydrogen 3.098 N/A ILE 262.A N LEU 258.A O no hydrogen 2.934 N/A GLY 263.A N MET 259.A O no hydrogen 2.866 N/A VAL 264.A N VAL 260.A O no hydrogen 2.918 N/A PHE 265.A N ARG 261.A O no hydrogen 3.000 N/A SER 266.A N ILE 262.A O no hydrogen 2.846 N/A SER 266.A OG ILE 262.A O no hydrogen 2.600 N/A VAL 267.A N GLY 263.A O no hydrogen 2.928 N/A LEU 268.A N VAL 264.A O no hydrogen 2.917 N/A TYR 269.A N PHE 265.A O no hydrogen 2.930 N/A THR 270.A N SER 266.A O no hydrogen 2.866 N/A THR 270.A OG1 SER 266.A O no hydrogen 2.783 N/A VAL 271.A N VAL 267.A O no hydrogen 2.937 N/A ALA 273.A N TYR 269.A O no hydrogen 3.448 N/A THR 274.A N THR 270.A O no hydrogen 2.866 N/A THR 274.A OG1 THR 270.A O no hydrogen 3.452 N/A THR 274.A OG1 VAL 271.A O no hydrogen 2.341 N/A ILE 275.A N VAL 271.A O no hydrogen 2.952 N/A VAL 276.A N PRO 272.A O no hydrogen 2.887 N/A LEU 277.A N ALA 273.A O no hydrogen 2.917 N/A ALA 278.A N THR 274.A O no hydrogen 2.881 N/A CYS 279.A N ILE 275.A O no hydrogen 2.871 N/A CYS 279.A SG ILE 275.A O no hydrogen 3.249 N/A CYS 279.A SG VAL 303.A O no hydrogen 3.548 N/A TYR 280.A N VAL 276.A O no hydrogen 2.945 N/A PHE 281.A N LEU 277.A O no hydrogen 2.891 N/A TYR 282.A N ALA 278.A O no hydrogen 2.873 N/A GLU 283.A N CYS 279.A O no hydrogen 2.917 N/A GLN 284.A N TYR 280.A O no hydrogen 2.924 N/A GLN 284.A NE2 PHE 281.A O no hydrogen 3.150 N/A ALA 285.A N PHE 281.A O no hydrogen 2.897 N/A PHE 286.A N TYR 282.A O no hydrogen 2.967 N/A TRP 290.A N PHE 286.A O no hydrogen 2.940 N/A GLU 291.A N ARG 287.A O no hydrogen 2.897 N/A ARG 292.A N GLU 288.A O no hydrogen 2.929 N/A ARG 292.A NE GLU 288.A OE2 no hydrogen 3.428 N/A THR 293.A N HIS 289.A O no hydrogen 2.907 N/A THR 293.A OG1 HIS 289.A O no hydrogen 2.721 N/A TRP 294.A N TRP 290.A O no hydrogen 2.906 N/A TRP 294.A NE1 LEU 33.A O no hydrogen 3.085 N/A LEU 295.A N GLU 291.A O no hydrogen 2.907 N/A LEU 296.A N ARG 292.A O no hydrogen 2.920 N/A GLN 297.A N THR 293.A O no hydrogen 2.908 N/A THR 298.A N TRP 294.A O no hydrogen 2.886 N/A THR 298.A OG1 ASN 31.A OD1 no hydrogen 3.519 N/A THR 298.A OG1 TRP 294.A O no hydrogen 2.616 N/A CYS 299.A N LEU 295.A O no hydrogen 3.161 N/A CYS 299.A SG LEU 295.A O no hydrogen 3.647 N/A THR 302.A N ASP 300.A OD1 no hydrogen 3.084 N/A THR 302.A OG1 ASP 300.A OD1 no hydrogen 3.408 N/A MET 305.A N PHE 301.A O no hydrogen 2.988 N/A ILE 306.A N THR 302.A O no hydrogen 2.861 N/A LYS 307.A N VAL 303.A O no hydrogen 2.888 N/A LYS 307.A NZ GLU 283.A OE2 no hydrogen 2.454 N/A TYR 308.A N PHE 304.A O no hydrogen 2.990 N/A LEU 309.A N MET 305.A O no hydrogen 2.898 N/A MET 310.A N ILE 306.A O no hydrogen 2.819 N/A THR 311.A N LYS 307.A O no hydrogen 3.008 N/A THR 311.A OG1 LYS 307.A O no hydrogen 2.911 N/A MET 312.A N TYR 308.A O no hydrogen 2.970 N/A ILE 313.A N LEU 309.A O no hydrogen 2.876 N/A VAL 314.A N MET 310.A O no hydrogen 2.927 N/A GLY 315.A N THR 311.A O no hydrogen 2.976 N/A ILE 316.A N MET 312.A O no hydrogen 2.920 N/A THR 317.A N ILE 313.A O no hydrogen 2.906 N/A THR 317.A OG1 ILE 313.A O no hydrogen 2.306 N/A THR 318.A OG1 SER 84.A OG no hydrogen 2.906 N/A PHE 320.A N THR 317.A O no hydrogen 3.062 N/A TRP 321.A NE1 GLU 77.A OE1 no hydrogen 3.062 N/A SER 324.A OG ILE 322.A O no hydrogen 3.391 N/A THR 327.A OG1 ILE 322.A O no hydrogen 2.556 N/A LEU 328.A N SER 324.A O no hydrogen 3.331 N/A GLN 329.A N GLY 325.A O no hydrogen 3.309 N/A SER 330.A N LYS 326.A O no hydrogen 2.914 N/A SER 330.A OG ASP 69.A OD2 no hydrogen 3.326 N/A SER 330.A OG LYS 326.A O no hydrogen 2.994 N/A TRP 331.A N THR 327.A O no hydrogen 2.899 N/A TRP 331.A NE1 THR 65.A OG1 no hydrogen 2.737 N/A ARG 332.A N LEU 328.A O no hydrogen 2.896 N/A ARG 332.A NE HIS 336.A NE2 no hydrogen 3.356 N/A ARG 333.A N GLN 329.A O no hydrogen 2.911 N/A ARG 333.A NH1 ASP 69.A OD2 no hydrogen 3.277 N/A ARG 333.A NH2 ASP 69.A OD2 no hydrogen 2.527 N/A PHE 334.A N SER 330.A O no hydrogen 2.918 N/A TYR 335.A N TRP 331.A O no hydrogen 2.883 N/A HIS 336.A N ARG 332.A O no hydrogen 2.992 N/A