Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8av1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A N VAL 11.A O no hydrogen 2.890 N/A ASP 5.A N SER 9.A O no hydrogen 3.373 N/A VAL 11.A N SER 3.A O no hydrogen 2.978 N/A THR 12.A N TYR 30.A O no hydrogen 2.855 N/A THR 13.A N LYS 1.A O no hydrogen 2.697 N/A THR 13.A OG1 SER 29.A OG no hydrogen 2.560 N/A VAL 14.A N VAL 28.A O no hydrogen 2.837 N/A ALA 16.A N GLN 26.A O no hydrogen 2.926 N/A THR 17.A N PHE 89.A O no hydrogen 2.876 N/A GLY 19.A N ARG 87.A O no hydrogen 2.694 N/A ARG 24.A N PRO 22.A O no hydrogen 2.791 N/A GLN 26.A N ALA 16.A O no hydrogen 2.914 N/A VAL 28.A N VAL 14.A O no hydrogen 2.783 N/A SER 29.A OG THR 13.A OG1 no hydrogen 2.560 N/A TYR 30.A N THR 12.A O no hydrogen 2.872 N/A THR 31.A N LYS 48.A O no hydrogen 2.870 N/A THR 31.A OG1 LYS 10.A O no hydrogen 2.602 N/A LYS 34.A N GLN 46.A O no hydrogen 2.947 N/A ILE 36.A N VAL 44.A O no hydrogen 2.852 N/A GLY 37.A N VAL 44.A O no hydrogen 3.210 N/A GLY 39.A N GLY 42.A O no hydrogen 2.897 N/A VAL 43.A N LYS 60.A O no hydrogen 3.220 N/A VAL 44.A N GLY 37.A O no hydrogen 2.849 N/A TYR 45.A N ILE 58.A O no hydrogen 2.798 N/A GLN 46.A N LYS 34.A O no hydrogen 2.690 N/A ALA 47.A N VAL 56.A O no hydrogen 3.011 N/A LYS 48.A N THR 31.A O no hydrogen 2.952 N/A LEU 49.A N GLU 54.A O no hydrogen 2.872 N/A CYS 50.A N SER 29.A O no hydrogen 3.050 N/A SER 52.A N ASP 51.A OD1 no hydrogen 2.651 N/A SER 52.A OG GLU 54.A OE1 no hydrogen 3.079 N/A GLY 53.A N LEU 49.A O no hydrogen 2.829 N/A GLU 54.A N SER 52.A OG no hydrogen 3.426 N/A VAL 56.A N ALA 47.A O no hydrogen 2.801 N/A ALA 57.A N LEU 102.A O no hydrogen 2.868 N/A ILE 58.A N TYR 45.A O no hydrogen 2.712 N/A LYS 59.A N LEU 100.A O no hydrogen 2.947 N/A LYS 59.A NZ GLU 71.A OE1 no hydrogen 3.071 N/A LYS 59.A NZ GLU 71.A OE2 no hydrogen 2.659 N/A LYS 59.A NZ ASP 170.A OD1 no hydrogen 3.502 N/A LYS 60.A N VAL 43.A O no hydrogen 2.823 N/A VAL 61.A N LEU 98.A O no hydrogen 2.875 N/A LEU 62.A N PHE 41.A O no hydrogen 3.476 N/A GLN 63.A N VAL 96.A O no hydrogen 2.784 N/A GLN 63.A NE2 ASP 64.A O no hydrogen 3.254 N/A ASN 69.A ND2 GLN 63.A OE1 no hydrogen 3.394 N/A LEU 72.A N ASN 69.A OD1 no hydrogen 2.755 N/A GLN 73.A N ASN 69.A O no hydrogen 3.329 N/A ILE 74.A N ARG 70.A O no hydrogen 3.040 N/A MET 75.A N GLU 71.A O no hydrogen 2.948 N/A ARG 76.A N LEU 72.A O no hydrogen 2.989 N/A ARG 76.A NH2 ASP 23.A OD1 no hydrogen 2.820 N/A LYS 77.A N ILE 74.A O no hydrogen 3.030 N/A ASP 79.A N TYR 141.A OH no hydrogen 2.836 N/A HIS 80.A NE2 GLU 335.A OE2 no hydrogen 2.704 N/A CYS 81.A SG ASN 82.A OD1 no hydrogen 3.601 N/A ASN 82.A N HIS 80.A ND1 no hydrogen 3.037 N/A ASN 82.A ND2 GLN 134.A OE1 no hydrogen 3.006 N/A ASN 82.A ND2 LEU 166.A O no hydrogen 2.968 N/A ILE 83.A N HIS 80.A O no hydrogen 3.211 N/A VAL 84.A N LEU 168.A O no hydrogen 3.122 N/A ARG 85.A NE ASP 103.A OD2 no hydrogen 3.234 N/A ARG 85.A NH2 ASP 103.A OD1 no hydrogen 3.106 N/A ARG 85.A NH2 ASP 103.A OD2 no hydrogen 3.452 N/A ARG 87.A N VAL 101.A O no hydrogen 2.701 N/A ARG 87.A NE ASP 103.A OD1 no hydrogen 2.428 N/A ARG 87.A NH1 GLU 54.A OE1 no hydrogen 2.698 N/A TYR 88.A N VAL 101.A O no hydrogen 3.273 N/A PHE 89.A N THR 17.A O no hydrogen 3.060 N/A PHE 90.A N ASN 99.A O no hydrogen 2.972 N/A SER 92.A N TYR 97.A O no hydrogen 2.957 N/A TYR 97.A N SER 92.A O no hydrogen 3.001 N/A LEU 98.A N VAL 61.A O no hydrogen 2.868 N/A ASN 99.A N PHE 90.A O no hydrogen 2.693 N/A ASN 99.A ND2 PHE 90.A O no hydrogen 3.379 N/A ASN 99.A ND2 SER 92.A OG no hydrogen 2.764 N/A LEU 100.A N LYS 59.A O no hydrogen 2.813 N/A VAL 101.A N TYR 88.A O no hydrogen 2.811 N/A LEU 102.A N ALA 57.A O no hydrogen 2.749 N/A ASP 103.A N ARG 85.A O no hydrogen 3.188 N/A TYR 104.A N LEU 55.A O no hydrogen 3.307 N/A GLU 107.A N LEU 159.A O no hydrogen 3.135 N/A VAL 109.A N LEU 157.A O no hydrogen 2.779 N/A ARG 111.A N THR 108.A OG1 no hydrogen 3.109 N/A VAL 112.A N THR 108.A O no hydrogen 3.241 N/A ALA 113.A N VAL 109.A O no hydrogen 2.955 N/A ARG 114.A N TYR 110.A O no hydrogen 2.972 N/A HIS 115.A N ARG 111.A O no hydrogen 3.055 N/A TYR 116.A N VAL 112.A O no hydrogen 3.452 N/A SER 117.A N ALA 113.A O no hydrogen 2.867 N/A SER 117.A OG ARG 114.A O no hydrogen 3.023 N/A ARG 118.A N ARG 114.A O no hydrogen 2.749 N/A ALA 119.A N TYR 116.A O no hydrogen 3.027 N/A LYS 120.A N SER 117.A O no hydrogen 2.731 N/A GLN 121.A N TYR 116.A O no hydrogen 2.928 N/A TYR 127.A N PRO 124.A O no hydrogen 3.108 N/A VAL 128.A N PRO 124.A O no hydrogen 3.455 N/A LYS 129.A N VAL 125.A O no hydrogen 2.755 N/A LYS 129.A NZ GLU 311.A OE1 no hydrogen 2.648 N/A LEU 130.A N ILE 126.A O no hydrogen 2.952 N/A TYR 131.A N TYR 127.A O no hydrogen 2.918 N/A MET 132.A N VAL 128.A O no hydrogen 2.874 N/A TYR 133.A N LYS 129.A O no hydrogen 2.899 N/A TYR 133.A OH LEU 328.A O no hydrogen 2.669 N/A GLN 134.A N LEU 130.A O no hydrogen 3.300 N/A GLN 134.A NE2 LEU 130.A O no hydrogen 3.044 N/A GLN 134.A NE2 ALA 164.A O no hydrogen 2.853 N/A LEU 135.A N TYR 131.A O no hydrogen 3.043 N/A PHE 136.A N MET 132.A O no hydrogen 3.073 N/A ARG 137.A N TYR 133.A O no hydrogen 3.059 N/A ARG 137.A NE GLU 335.A OE2 no hydrogen 3.007 N/A ARG 137.A NH1 ASN 330.A OD1 no hydrogen 2.988 N/A ARG 137.A NH2 ASN 330.A OD1 no hydrogen 2.773 N/A ARG 137.A NH2 GLU 335.A OE1 no hydrogen 3.020 N/A ARG 137.A NH2 GLU 335.A OE2 no hydrogen 3.287 N/A SER 138.A N GLN 134.A O no hydrogen 3.016 N/A SER 138.A OG GLN 134.A O no hydrogen 3.534 N/A SER 138.A OG LEU 135.A O no hydrogen 2.587 N/A LEU 139.A N LEU 135.A O no hydrogen 3.062 N/A ALA 140.A N PHE 136.A O no hydrogen 2.859 N/A TYR 141.A N ARG 137.A O no hydrogen 3.061 N/A ILE 142.A N SER 138.A O no hydrogen 3.075 N/A HIS 143.A N LEU 139.A O no hydrogen 2.887 N/A HIS 143.A NE2 ASP 208.A OD2 no hydrogen 2.829 N/A SER 144.A N ALA 140.A O no hydrogen 3.055 N/A SER 144.A OG TYR 141.A O no hydrogen 2.479 N/A PHE 145.A N ILE 142.A O no hydrogen 3.051 N/A GLY 146.A N HIS 143.A O no hydrogen 2.851 N/A ILE 147.A N ILE 142.A O no hydrogen 2.972 N/A CYS 148.A N LYS 175.A O no hydrogen 2.811 N/A CYS 148.A SG ASP 208.A OD2 no hydrogen 3.437 N/A HIS 149.A N ASP 208.A OD2 no hydrogen 2.948 N/A HIS 149.A NE2 CYS 169.A O no hydrogen 2.870 N/A ARG 150.A N ASP 208.A OD1 no hydrogen 3.042 N/A ARG 150.A NE SER 173.A O no hydrogen 2.697 N/A ARG 150.A NH1 SER 173.A O no hydrogen 3.058 N/A ASP 151.A N HIS 149.A ND1 no hydrogen 3.103 N/A LYS 153.A NZ SER 188.A OG.B no hydrogen 3.358 N/A GLN 155.A N GLN 155.A OE1 no hydrogen 2.784 N/A ASN 156.A N LYS 153.A O no hydrogen 2.978 N/A ASN 156.A ND2 ASP 151.A O no hydrogen 2.796 N/A ASN 156.A ND2 ASP 151.A OD2 no hydrogen 3.298 N/A LEU 157.A N PRO 154.A O no hydrogen 3.145 N/A LEU 158.A N LYS 167.A O no hydrogen 2.916 N/A LEU 159.A N GLU 107.A O no hydrogen 2.966 N/A ASP 160.A N VAL 165.A O no hydrogen 2.948 N/A THR 163.A OG1 ASP 160.A OD2 no hydrogen 2.900 N/A ALA 164.A N ASP 160.A O no hydrogen 2.784 N/A VAL 165.A N THR 163.A OG1 no hydrogen 3.283 N/A LEU 166.A N GLN 134.A OE1 no hydrogen 3.086 N/A LYS 167.A N LEU 158.A O no hydrogen 2.865 N/A LYS 167.A NZ CYS 81.A O no hydrogen 2.564 N/A LEU 168.A N ASN 82.A O no hydrogen 2.793 N/A CYS 169.A N ASN 156.A O no hydrogen 2.967 N/A GLY 172.A N ASP 170.A OD1 no hydrogen 3.031 N/A ALA 174.A N PHE 171.A O no hydrogen 3.271 N/A LYS 175.A N CYS 148.A O no hydrogen 2.839 N/A LYS 175.A NZ PRO 182.A O no hydrogen 3.506 N/A LYS 175.A NZ ASN 183.A OD1 no hydrogen 2.830 N/A LEU 177.A N GLY 146.A O no hydrogen 2.980 N/A GLU 181.A N VAL 178.A O no hydrogen 3.088 N/A ASN 183.A N THR 201.A O no hydrogen 2.736 N/A ASN 183.A ND2 THR 201.A O no hydrogen 3.586 N/A CYS 187.A SG.A ARG 150.A O no hydrogen 2.731 N/A CYS 187.A SG.B SER 188.A O no hydrogen 3.725 N/A CYS 187.A SG.B SER 211.A OG no hydrogen 3.461 N/A SER 188.A N ASP 151.A OD1 no hydrogen 3.145 N/A SER 188.A OG.B ASP 151.A OD1 no hydrogen 2.865 N/A ARG 189.A NH1 GLY 228.A O no hydrogen 2.867 N/A TYR 191.A N SER 188.A O no hydrogen 2.977 N/A TYR 191.A OH GLU 218.A OE1 no hydrogen 2.572 N/A TYR 191.A OH GLU 218.A OE2 no hydrogen 3.394 N/A ARG 192.A N ARG 189.A O no hydrogen 3.022 N/A ARG 192.A NE ILE 186.A O no hydrogen 3.012 N/A ARG 192.A NE CYS 187.A O no hydrogen 3.270 N/A ARG 192.A NH1 CYS 187.A O no hydrogen 2.883 N/A GLU 195.A N GLU 195.A OE1 no hydrogen 2.843 N/A LEU 196.A N ALA 193.A O no hydrogen 3.092 N/A PHE 198.A N PRO 194.A O no hydrogen 3.061 N/A GLY 199.A N LEU 196.A O no hydrogen 2.908 N/A ALA 200.A N GLU 195.A O no hydrogen 3.013 N/A TYR 203.A OH VAL 184.A O no hydrogen 2.488 N/A SER 206.A N THR 204.A OG1 no hydrogen 3.116 N/A SER 206.A OG THR 204.A OG1 no hydrogen 3.021 N/A ILE 207.A N THR 204.A O no hydrogen 3.199 N/A ASP 208.A N SER 205.A O no hydrogen 3.087 N/A TRP 210.A N SER 206.A O no hydrogen 3.278 N/A SER 211.A N ILE 207.A O no hydrogen 3.224 N/A SER 211.A OG TYR 191.A O no hydrogen 2.764 N/A SER 211.A OG ILE 207.A O no hydrogen 3.052 N/A ALA 212.A N ASP 208.A O no hydrogen 2.915 N/A GLY 213.A N VAL 209.A O no hydrogen 2.909 N/A CYS 214.A N TRP 210.A O no hydrogen 3.014 N/A CYS 214.A SG TYR 190.A O no hydrogen 3.592 N/A CYS 214.A SG TRP 210.A O no hydrogen 3.452 N/A VAL 215.A N SER 211.A O no hydrogen 2.939 N/A LEU 216.A N ALA 212.A O no hydrogen 2.844 N/A ALA 217.A N GLY 213.A O no hydrogen 2.947 N/A GLU 218.A N CYS 214.A O no hydrogen 3.127 N/A LEU 219.A N VAL 215.A O no hydrogen 3.010 N/A LEU 220.A N LEU 216.A O no hydrogen 3.094 N/A LEU 221.A N ALA 217.A O no hydrogen 2.894 N/A GLY 222.A N GLU 218.A O no hydrogen 2.767 N/A GLY 228.A N PHE 226.A O no hydrogen 3.127 N/A GLY 228.A N GLN 234.A OE1 no hydrogen 2.949 N/A ASP 229.A N ASP 233.A OD2 no hydrogen 2.729 N/A SER 230.A OG ASP 229.A OD1 no hydrogen 3.132 N/A ASP 233.A N SER 230.A OG no hydrogen 3.319 N/A GLN 234.A N SER 230.A O no hydrogen 2.936 N/A GLN 234.A NE2 PHE 226.A O no hydrogen 2.969 N/A LEU 235.A N VAL 232.A O no hydrogen 2.997 N/A VAL 236.A N VAL 232.A O no hydrogen 3.448 N/A GLU 237.A N ASP 233.A O no hydrogen 2.999 N/A ILE 238.A N GLN 234.A O no hydrogen 3.137 N/A ILE 239.A N LEU 235.A O no hydrogen 2.920 N/A LYS 240.A N VAL 236.A O no hydrogen 2.850 N/A LYS 240.A NZ GLU 237.A OE2 no hydrogen 3.426 N/A VAL 241.A N ILE 238.A O no hydrogen 2.979 N/A LEU 242.A N ILE 238.A O no hydrogen 2.871 N/A GLY 243.A N ILE 239.A O no hydrogen 2.635 N/A THR 244.A N ILE 265.A O no hydrogen 2.830 N/A THR 244.A OG1 PRO 263.A O no hydrogen 3.378 N/A THR 244.A OG1 ILE 265.A O no hydrogen 3.375 N/A THR 246.A N GLN 249.A OE1 no hydrogen 2.698 N/A GLN 249.A N THR 246.A OG1 no hydrogen 3.204 N/A ILE 250.A N THR 246.A O no hydrogen 2.968 N/A ARG 251.A N ARG 247.A O no hydrogen 2.928 N/A GLU 252.A N GLU 248.A O no hydrogen 2.954 N/A MET 253.A N ILE 250.A O no hydrogen 3.163 N/A ASN 254.A N ILE 250.A O no hydrogen 2.925 N/A ASN 254.A ND2 PHE 198.A O no hydrogen 2.914 N/A ASN 254.A ND2 ASN 256.A O no hydrogen 2.574 N/A ASN 256.A N ASN 254.A OD1 no hydrogen 3.297 N/A GLN 264.A NE2 ILE 265.A O no hydrogen 3.517 N/A ILE 265.A N THR 244.A OG1 no hydrogen 2.906 N/A HIS 268.A N VAL 241.A O no hydrogen 2.981 N/A LYS 272.A N PRO 269.A O no hydrogen 3.124 N/A VAL 273.A N TRP 270.A O no hydrogen 3.093 N/A THR 278.A N ARG 275.A O no hydrogen 3.133 N/A THR 278.A OG1 ARG 275.A O no hydrogen 2.562 N/A GLU 281.A N GLU 281.A OE1 no hydrogen 2.814 N/A ALA 282.A N PRO 279.A O no hydrogen 3.041 N/A ILE 283.A N PRO 279.A O no hydrogen 3.281 N/A ALA 284.A N PRO 280.A O no hydrogen 2.804 N/A LEU 285.A N GLU 281.A O no hydrogen 3.051 N/A CYS 286.A N ALA 282.A O no hydrogen 3.093 N/A CYS 286.A SG GLY 213.A O no hydrogen 3.948 N/A SER 287.A N ILE 283.A O no hydrogen 3.003 N/A SER 287.A OG ALA 284.A O no hydrogen 2.505 N/A ARG 288.A N ALA 284.A O no hydrogen 3.235 N/A ARG 288.A N LEU 285.A O no hydrogen 3.069 N/A ARG 288.A NH1 GLU 291.A OE2 no hydrogen 3.329 N/A ARG 288.A NH1 ALA 296.A O no hydrogen 3.002 N/A LEU 289.A N CYS 286.A O no hydrogen 3.104 N/A LEU 290.A N CYS 286.A O no hydrogen 2.944 N/A TYR 292.A OH GLY 243.A O no hydrogen 2.588 N/A ALA 296.A N THR 293.A O no hydrogen 2.860 N/A ARG 297.A N PRO 294.A O no hydrogen 3.360 N/A ARG 297.A NE GLU 291.A O no hydrogen 2.720 N/A ARG 297.A NH1 GLU 195.A OE1 no hydrogen 3.370 N/A ARG 297.A NH1 GLU 195.A OE2 no hydrogen 2.739 N/A ARG 297.A NH1 SER 206.A O no hydrogen 3.326 N/A ARG 297.A NH2 GLU 195.A OE1 no hydrogen 2.603 N/A ARG 297.A NH2 GLU 291.A O no hydrogen 3.230 N/A ARG 297.A NH2 TYR 292.A O no hydrogen 3.009 N/A LEU 298.A N ARG 288.A O no hydrogen 3.132 N/A THR 299.A N GLU 302.A OE1 no hydrogen 3.085 N/A GLU 302.A N THR 299.A OG1 no hydrogen 3.103 N/A ALA 303.A N THR 299.A O no hydrogen 2.865 N/A CYS 304.A N PRO 300.A O no hydrogen 3.005 N/A CYS 304.A SG TYR 133.A O no hydrogen 3.714 N/A CYS 304.A SG PRO 300.A O no hydrogen 3.656 N/A ALA 305.A N LEU 301.A O no hydrogen 3.267 N/A ALA 305.A N GLU 302.A O no hydrogen 2.972 N/A HIS 306.A N ALA 303.A O no hydrogen 3.152 N/A PHE 308.A N HIS 306.A ND1 no hydrogen 3.181 N/A PHE 309.A N HIS 306.A O no hydrogen 3.105 N/A ASP 310.A N SER 307.A O no hydrogen 2.907 N/A LEU 312.A N PHE 309.A O no hydrogen 2.939 N/A ARG 313.A N ASP 310.A O no hydrogen 2.931 N/A ARG 313.A NH1 HIS 306.A O no hydrogen 2.917 N/A ARG 313.A NH1 ASP 310.A OD1 no hydrogen 3.039 N/A ARG 313.A NH2 CYS 304.A O no hydrogen 2.872 N/A ASP 314.A N GLU 311.A O no hydrogen 3.255 N/A ASN 316.A N ASP 314.A OD1 no hydrogen 2.857 N/A VAL 317.A N ASP 314.A O no hydrogen 3.058 N/A LYS 318.A NZ ASP 324.A OD1 no hydrogen 2.840 N/A LEU 319.A N ARG 323.A O no hydrogen 2.955 N/A ASN 321.A ND2 ASP 162.A O no hydrogen 2.847 N/A GLY 322.A N LEU 319.A O no hydrogen 2.994 N/A ARG 323.A N ASN 321.A OD1 no hydrogen 2.871 N/A THR 332.A N GLU 335.A OE1 no hydrogen 2.977 N/A GLN 334.A NE2 SER 144.A OG no hydrogen 3.145 N/A GLU 335.A N THR 332.A OG1 no hydrogen 3.239 N/A LEU 336.A N THR 333.A O no hydrogen 2.951 N/A SER 337.A N GLN 334.A O no hydrogen 3.212 N/A SER 337.A OG GLN 334.A O no hydrogen 2.597 N/A ASN 339.A N LEU 336.A O no hydrogen 3.030 N/A LEU 342.A N ASN 339.A O no hydrogen 3.108 N/A ALA 343.A N PRO 340.A O no hydrogen 3.132 N/A THR 344.A N PRO 341.A O no hydrogen 3.247 N/A THR 344.A OG1 PRO 341.A O no hydrogen 3.396 N/A ILE 345.A N LEU 342.A O no hydrogen 3.009 N/A LEU 346.A N LEU 342.A O no hydrogen 2.944 N/A ILE 347.A N ALA 343.A O no hydrogen 2.798 N/A HIS 350.A NE2 ARG 313.A O no hydrogen 3.156 N/A