Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8val_E.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 3.A ND1 GLY 1.A O no hydrogen 3.047 N/A ARG 5.A N HIS 3.A O no hydrogen 2.531 N/A TRP 9.A NE1 MET 38.A O no hydrogen 3.234 N/A LEU 10.A N TYR 7.A O no hydrogen 3.177 N/A ARG 11.A N PRO 8.A O no hydrogen 2.916 N/A PHE 14.A N LEU 10.A O no hydrogen 2.807 N/A GLU 15.A N ARG 11.A O no hydrogen 3.331 N/A LEU 17.A N ASP 13.A O no hydrogen 2.748 N/A VAL 18.A N PHE 14.A O no hydrogen 2.917 N/A ALA 19.A N GLU 15.A O no hydrogen 3.441 N/A SER 20.A N LYS 16.A O no hydrogen 3.233 N/A TYR 21.A N LEU 17.A O no hydrogen 3.267 N/A TYR 21.A OH HIS 27.A O no hydrogen 3.399 N/A GLN 22.A N VAL 18.A O no hydrogen 2.560 N/A ALA 23.A N ALA 19.A O no hydrogen 3.136 N/A GLY 24.A N TYR 21.A O no hydrogen 3.151 N/A ALA 29.A N HIS 27.A ND1 no hydrogen 2.997 N/A LEU 30.A N PHE 144.A O no hydrogen 3.106 N/A LEU 31.A N ARG 163.A O no hydrogen 2.888 N/A ILE 32.A N LEU 146.A O no hydrogen 2.648 N/A GLN 33.A N HIS 165.A O no hydrogen 2.911 N/A MET 38.A N LEU 35.A O no hydrogen 3.006 N/A ASP 41.A N ASP 40.A OD1 no hydrogen 3.008 N/A ALA 42.A N ASP 41.A OD1 no hydrogen 2.446 N/A LEU 43.A N GLY 39.A O no hydrogen 3.108 N/A ILE 44.A N ASP 40.A O no hydrogen 2.910 N/A TYR 45.A N ASP 41.A O no hydrogen 2.877 N/A ALA 46.A N ALA 42.A O no hydrogen 2.912 N/A LEU 47.A N LEU 43.A O no hydrogen 2.916 N/A SER 48.A N ILE 44.A O no hydrogen 2.904 N/A ARG 49.A N TYR 45.A O no hydrogen 2.884 N/A TYR 50.A N ALA 46.A O no hydrogen 2.961 N/A LEU 51.A N LEU 47.A O no hydrogen 2.896 N/A LEU 52.A N SER 48.A O no hydrogen 2.915 N/A GLN 54.A NE2 LEU 109.A O no hydrogen 3.084 N/A LYS 60.A N GLN 57.A O no hydrogen 3.195 N/A GLN 69.A N CYS 65.A O no hydrogen 3.142 N/A GLN 69.A NE2 HIS 64.A O no hydrogen 2.658 N/A LEU 70.A N ARG 66.A O no hydrogen 2.908 N/A MET 71.A N GLY 67.A O no hydrogen 2.903 N/A GLN 72.A N CYS 68.A O no hydrogen 2.897 N/A ALA 73.A N GLN 69.A O no hydrogen 2.915 N/A GLY 74.A N MET 71.A O no hydrogen 3.157 N/A THR 75.A N LEU 70.A O no hydrogen 3.224 N/A ASP 78.A N HIS 76.A ND1 no hydrogen 2.934 N/A TYR 80.A N VAL 114.A O no hydrogen 2.911 N/A LEU 82.A N TRP 116.A O no hydrogen 2.871 N/A LYS 88.A N GLU 85.A O no hydrogen 2.960 N/A THR 90.A OG1 LEU 122.A O no hydrogen 3.514 N/A THR 90.A OG1 THR 124.A OG1 no hydrogen 3.067 N/A LEU 91.A N LEU 122.A O no hydrogen 3.322 N/A ARG 97.A N VAL 93.A O no hydrogen 2.867 N/A GLU 98.A N ASP 94.A O no hydrogen 2.900 N/A VAL 99.A N ALA 95.A O no hydrogen 2.937 N/A THR 100.A N VAL 96.A O no hydrogen 2.874 N/A THR 100.A OG1 VAL 96.A O no hydrogen 3.046 N/A THR 100.A OG1 THR 134.A OG1 no hydrogen 3.270 N/A GLU 101.A N ARG 97.A O no hydrogen 2.906 N/A LYS 102.A N GLU 98.A O no hydrogen 2.931 N/A LEU 103.A N VAL 99.A O no hydrogen 2.933 N/A ASN 104.A N GLU 101.A O no hydrogen 3.375 N/A ASN 104.A ND2 GLU 101.A O no hydrogen 3.282 N/A GLU 105.A N LYS 102.A O no hydrogen 3.275 N/A ARG 108.A N ASP 78.A OD1 no hydrogen 3.001 N/A LEU 109.A N ASP 78.A OD2 no hydrogen 3.123 N/A LYS 113.A N GLU 141.A O no hydrogen 3.093 N/A LYS 113.A NZ LEU 103.A O no hydrogen 3.264 N/A LYS 113.A NZ GLU 105.A O no hydrogen 3.282 N/A VAL 114.A N ASP 78.A O no hydrogen 3.217 N/A VAL 115.A N TRP 143.A O no hydrogen 2.876 N/A TRP 116.A N TYR 80.A O no hydrogen 2.915 N/A VAL 117.A N PHE 145.A O no hydrogen 2.977 N/A THR 118.A N LEU 82.A O no hydrogen 2.942 N/A ALA 120.A N ALA 147.A O no hydrogen 2.646 N/A ALA 121.A N ASP 119.A OD1 no hydrogen 3.025 N/A LEU 122.A N ASP 119.A O no hydrogen 3.265 N/A LEU 123.A N ALA 120.A O no hydrogen 3.193 N/A THR 124.A OG1 THR 90.A OG1 no hydrogen 3.067 N/A THR 124.A OG1 LEU 91.A O no hydrogen 3.249 N/A ALA 128.A N THR 124.A O no hydrogen 2.748 N/A ASN 129.A N ASP 125.A O no hydrogen 2.923 N/A ALA 130.A N ALA 126.A O no hydrogen 2.883 N/A LEU 131.A N ALA 127.A O no hydrogen 2.947 N/A LEU 131.A N ALA 128.A O no hydrogen 3.096 N/A LEU 132.A N ASN 129.A O no hydrogen 3.084 N/A THR 134.A OG1 THR 100.A OG1 no hydrogen 3.270 N/A THR 134.A OG1 ALA 130.A O no hydrogen 3.534 N/A LEU 135.A N LEU 131.A O no hydrogen 2.870 N/A GLU 136.A N LEU 132.A O no hydrogen 2.955 N/A GLU 137.A N LYS 133.A O no hydrogen 3.121 N/A THR 142.A OG1 PRO 139.A O no hydrogen 3.164 N/A TRP 143.A N LYS 113.A O no hydrogen 2.895 N/A PHE 144.A N HIS 28.A O no hydrogen 2.455 N/A PHE 145.A N VAL 115.A O no hydrogen 3.055 N/A LEU 146.A N LEU 30.A O no hydrogen 3.127 N/A THR 148.A N ILE 32.A O no hydrogen 3.058 N/A THR 148.A OG1 GLU 150.A O no hydrogen 2.814 N/A ARG 149.A NH1 ARG 149.A O no hydrogen 3.428 N/A ARG 153.A N GLU 150.A O no hydrogen 3.126 N/A LEU 154.A N PRO 151.A O no hydrogen 3.084 N/A ARG 159.A N LEU 155.A O no hydrogen 3.261 N/A ARG 161.A N LEU 158.A O no hydrogen 3.045 N/A ARG 161.A NE GLU 136.A OE1 no hydrogen 3.288 N/A ARG 161.A NH1 THR 157.A O no hydrogen 3.233 N/A ARG 161.A NH2 GLU 136.A OE1 no hydrogen 3.151 N/A CYS 162.A SG ARG 163.A O no hydrogen 3.600 N/A ARG 163.A N ALA 29.A O no hydrogen 2.930 N/A ARG 163.A NH1 SER 20.A OG no hydrogen 2.681 N/A HIS 165.A N LEU 31.A O no hydrogen 2.886 N/A LEU 167.A N GLN 33.A O no hydrogen 3.263 N/A ALA 175.A N PRO 171.A O no hydrogen 2.908 N/A VAL 176.A N GLU 172.A O no hydrogen 2.885 N/A THR 177.A N GLN 173.A O no hydrogen 2.941 N/A THR 177.A OG1 GLN 173.A O no hydrogen 2.942 N/A TRP 178.A N TYR 174.A O no hydrogen 2.918 N/A LEU 179.A N ALA 175.A O no hydrogen 2.915 N/A SER 180.A N VAL 176.A O no hydrogen 2.862 N/A SER 180.A OG VAL 176.A O no hydrogen 2.381 N/A ARG 181.A N THR 177.A O no hydrogen 2.944 N/A ARG 181.A NH1 ARG 181.A O no hydrogen 3.181 N/A GLU 182.A N TRP 178.A O no hydrogen 2.906 N/A VAL 183.A N LEU 179.A O no hydrogen 2.438 N/A GLN 187.A NE2 SER 180.A OG no hydrogen 2.910 N/A ASP 188.A N SER 186.A OG no hydrogen 3.270 N/A LEU 190.A N SER 186.A O no hydrogen 3.174 N/A LEU 191.A N GLN 187.A O no hydrogen 2.892 N/A ALA 192.A N ASP 188.A O no hydrogen 2.925 N/A ALA 193.A N ALA 189.A O no hydrogen 2.878 N/A LEU 194.A N LEU 190.A O no hydrogen 2.919 N/A ARG 195.A N LEU 191.A O no hydrogen 2.924 N/A ARG 195.A NH2 GLN 267.A OE1 no hydrogen 2.888 N/A LEU 196.A N ALA 192.A O no hydrogen 2.872 N/A SER 197.A N ALA 193.A O no hydrogen 2.879 N/A SER 197.A OG ALA 193.A O no hydrogen 3.345 N/A ALA 198.A N ARG 195.A O no hydrogen 3.152 N/A GLY 199.A N LEU 194.A O no hydrogen 2.672 N/A SER 200.A N SER 197.A O no hydrogen 2.982 N/A SER 200.A OG SER 197.A O no hydrogen 2.513 N/A ALA 204.A N SER 200.A O no hydrogen 3.348 N/A LEU 205.A N PRO 201.A O no hydrogen 2.923 N/A ALA 206.A N GLY 202.A O no hydrogen 2.902 N/A LEU 207.A N ALA 203.A O no hydrogen 2.862 N/A PHE 208.A N ALA 204.A O no hydrogen 2.956 N/A GLN 209.A N LEU 205.A O no hydrogen 2.885 N/A GLY 210.A N ALA 206.A O no hydrogen 3.037 N/A ALA 215.A N ASP 211.A O no hydrogen 3.118 N/A ARG 216.A N ASN 212.A O no hydrogen 2.866 N/A ARG 216.A NH2 ASN 270.A OD1 no hydrogen 2.361 N/A ARG 216.A NH2 ASP 272.A OD1 no hydrogen 3.321 N/A GLU 217.A N TRP 213.A O no hydrogen 2.928 N/A THR 218.A N GLN 214.A O no hydrogen 2.916 N/A THR 218.A OG1 GLN 214.A O no hydrogen 2.971 N/A LEU 219.A N ALA 215.A O no hydrogen 2.870 N/A CYS 220.A N ARG 216.A O no hydrogen 2.874 N/A CYS 220.A SG ARG 216.A O no hydrogen 3.382 N/A GLN 221.A N GLU 217.A O no hydrogen 2.947 N/A ALA 222.A N THR 218.A O no hydrogen 2.892 N/A LEU 223.A N LEU 219.A O no hydrogen 2.879 N/A ALA 224.A N CYS 220.A O no hydrogen 2.887 N/A TYR 225.A N GLN 221.A O no hydrogen 2.941 N/A SER 226.A N ALA 222.A O no hydrogen 2.901 N/A VAL 227.A N LEU 223.A O no hydrogen 2.891 N/A SER 229.A OG TYR 225.A O no hydrogen 3.365 N/A GLY 230.A N SER 226.A O no hydrogen 2.627 N/A ASP 231.A N SER 229.A OG no hydrogen 3.334 N/A SER 234.A N ASP 231.A O no hydrogen 3.402 N/A SER 234.A OG ASP 231.A O no hydrogen 3.123 N/A LEU 235.A N TRP 232.A O no hydrogen 2.914 N/A LEU 236.A N TYR 233.A O no hydrogen 2.918 N/A ALA 237.A N SER 234.A O no hydrogen 2.943 N/A ALA 238.A N LEU 235.A O no hydrogen 2.914 N/A LEU 239.A N LEU 236.A O no hydrogen 2.942 N/A ASN 240.A N LEU 236.A O no hydrogen 2.929 N/A GLN 243.A N HIS 241.A ND1 no hydrogen 3.448 N/A ALA 244.A N HIS 241.A O no hydrogen 3.189 N/A ARG 247.A NH1 ALA 238.A O no hydrogen 3.056 N/A LEU 248.A N ALA 244.A O no hydrogen 2.910 N/A HIS 249.A N PRO 245.A O no hydrogen 2.887 N/A TRP 250.A N ALA 246.A O no hydrogen 2.908 N/A LEU 251.A N ARG 247.A O no hydrogen 2.949 N/A ALA 252.A N LEU 248.A O no hydrogen 2.884 N/A THR 253.A N HIS 249.A O no hydrogen 2.873 N/A THR 253.A OG1 HIS 249.A O no hydrogen 3.167 N/A THR 253.A OG1 TRP 250.A O no hydrogen 2.437 N/A LEU 254.A N TRP 250.A O no hydrogen 2.950 N/A LEU 255.A N LEU 251.A O no hydrogen 2.951 N/A MET 256.A N ALA 252.A O no hydrogen 2.844 N/A ASP 257.A N THR 253.A O no hydrogen 2.915 N/A ALA 258.A N LEU 254.A O no hydrogen 2.912 N/A LEU 259.A N LEU 255.A O no hydrogen 2.945 N/A LYS 260.A N MET 256.A O no hydrogen 2.883 N/A ARG 261.A N ASP 257.A O no hydrogen 2.840 N/A HIS 262.A N ALA 258.A O no hydrogen 2.953 N/A HIS 263.A N LEU 259.A O no hydrogen 2.907 N/A GLY 264.A N ARG 261.A O no hydrogen 3.065 N/A ALA 265.A N LYS 260.A O no hydrogen 2.764 N/A THR 269.A N ASP 257.A OD1 no hydrogen 2.615 N/A THR 269.A OG1 THR 253.A O no hydrogen 3.428 N/A THR 269.A OG1 ASP 257.A OD1 no hydrogen 3.111 N/A THR 269.A OG1 ASP 257.A OD2 no hydrogen 2.321 N/A ASN 270.A N ASP 257.A OD2 no hydrogen 2.308 N/A ASN 270.A ND2 ASP 257.A OD2 no hydrogen 2.804 N/A ALA 278.A N PRO 274.A O no hydrogen 2.925 N/A GLU 279.A N GLY 275.A O no hydrogen 2.910 N/A LEU 280.A N LEU 276.A O no hydrogen 2.898 N/A ALA 281.A N VAL 277.A O no hydrogen 2.886 N/A ASN 282.A N ALA 278.A O no hydrogen 2.948 N/A ASN 282.A ND2 GLU 279.A OE2 no hydrogen 3.466 N/A HIS 283.A N GLU 279.A O no hydrogen 2.902 N/A HIS 283.A NE2 GLU 279.A OE1 no hydrogen 2.735 N/A LEU 284.A N LEU 280.A O no hydrogen 3.144 N/A LEU 289.A N SER 285.A O no hydrogen 2.871 N/A GLN 290.A N PRO 286.A O no hydrogen 2.901 N/A ILE 292.A N ARG 288.A O no hydrogen 2.925 N/A LEU 293.A N LEU 289.A O no hydrogen 2.895 N/A GLY 294.A N GLN 290.A O no hydrogen 2.893 N/A ASP 295.A N ALA 291.A O no hydrogen 2.924 N/A VAL 296.A N ILE 292.A O no hydrogen 2.895 N/A CYS 297.A N LEU 293.A O no hydrogen 2.965 N/A CYS 297.A SG LEU 293.A O no hydrogen 3.714 N/A HIS 298.A N GLY 294.A O no hydrogen 2.888 N/A ILE 299.A N ASP 295.A O no hydrogen 2.891 N/A ARG 300.A N VAL 296.A O no hydrogen 2.920 N/A GLU 301.A N CYS 297.A O no hydrogen 2.926 N/A GLN 302.A N HIS 298.A O no hydrogen 2.909 N/A LEU 303.A N ILE 299.A O no hydrogen 2.861 N/A MET 304.A N ARG 300.A O no hydrogen 2.943 N/A SER 305.A N GLU 301.A O no hydrogen 2.898 N/A SER 305.A OG GLU 301.A O no hydrogen 3.224 N/A SER 305.A OG GLU 301.A OE2 no hydrogen 3.248 N/A VAL 306.A N GLN 302.A O no hydrogen 3.395 N/A GLU 312.A N ASN 310.A OD1 no hydrogen 3.321 N/A LEU 314.A N ASN 310.A O no hydrogen 3.444 N/A ILE 315.A N ARG 311.A O no hydrogen 2.922 N/A THR 316.A N GLU 312.A O no hydrogen 2.924 N/A THR 316.A OG1 GLU 312.A O no hydrogen 3.185 N/A ASP 317.A N LEU 313.A O no hydrogen 2.886 N/A LEU 318.A N LEU 314.A O no hydrogen 2.895 N/A LEU 319.A N ILE 315.A O no hydrogen 2.943 N/A LEU 320.A N THR 316.A O no hydrogen 2.908 N/A ARG 321.A N ASP 317.A O no hydrogen 2.870 N/A ARG 321.A NE ASP 317.A OD1 no hydrogen 2.714 N/A ARG 321.A NH2 ASP 317.A OD1 no hydrogen 3.079 N/A ILE 322.A N LEU 318.A O no hydrogen 2.906 N/A GLU 323.A N LEU 319.A O no hydrogen 2.928 N/A HIS 324.A N LEU 320.A O no hydrogen 2.898 N/A TYR 325.A N ARG 321.A O no hydrogen 2.858 N/A TYR 325.A OH ASP 295.A OD2 no hydrogen 3.246 N/A LEU 326.A N ILE 322.A O no hydrogen 2.939 N/A GLN 327.A N HIS 324.A O no hydrogen 3.247 N/A GLN 327.A NE2 GLU 323.A O no hydrogen 3.298 N/A