Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ib8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A N GLY 286.A O no hydrogen 2.797 N/A ALA 4.A N PHE 288.A O no hydrogen 2.952 N/A ARG 8.A N GLU 290.A O no hydrogen 2.803 N/A ASP 10.A N VAL 251.A O no hydrogen 2.689 N/A TYR 11.A N VAL 251.A O no hydrogen 3.165 N/A TYR 11.A OH ASP 159.A OD2 no hydrogen 2.638 N/A VAL 12.A N ASP 53.A OD2 no hydrogen 2.951 N/A LEU 13.A N VAL 249.A O no hydrogen 2.816 N/A LEU 14.A N ALA 54.A O no hydrogen 2.963 N/A HIS 15.A N ASN 247.A O no hydrogen 2.871 N/A HIS 15.A NE2 THR 58.A OG1 no hydrogen 3.007 N/A ILE 16.A N VAL 56.A O no hydrogen 2.843 N/A SER 17.A OG ASP 18.A OD2 no hydrogen 2.724 N/A SER 17.A OG THR 58.A O no hydrogen 3.259 N/A SER 17.A OG THR 58.A OG1 no hydrogen 2.749 N/A ASP 18.A N GLY 59.A O no hydrogen 2.968 N/A THR 19.A OG1 LEU 61.A O no hydrogen 2.771 N/A HIS 20.A N ASP 60.A O no hydrogen 2.964 N/A HIS 20.A ND1 ASP 63.A OD1 no hydrogen 2.800 N/A LEU 21.A N LEU 61.A O no hydrogen 3.082 N/A GLY 23.A N GLU 66.A OE1 no hydrogen 2.939 N/A ARG 27.A NH2 GLY 30.A O no hydrogen 3.185 N/A LEU 28.A N VAL 32.A O no hydrogen 2.750 N/A TYR 29.A OH ASP 63.A OD1 no hydrogen 2.600 N/A GLY 30.A N ARG 27.A O no hydrogen 2.867 N/A ALA 31.A N LEU 28.A O no hydrogen 2.919 N/A VAL 32.A N LEU 28.A O no hydrogen 3.274 N/A ASP 36.A N ASP 33.A OD1 no hydrogen 2.975 N/A ARG 37.A N ASP 33.A O no hydrogen 3.091 N/A ARG 37.A NE ASP 241.A OD1 no hydrogen 2.915 N/A ARG 37.A NH2 ASP 241.A OD1 no hydrogen 3.419 N/A ARG 37.A NH2 ASP 241.A OD2 no hydrogen 2.858 N/A LEU 38.A N ALA 34.A O no hydrogen 3.097 N/A GLY 39.A N ASP 35.A O no hydrogen 2.814 N/A GLU 40.A N ASP 36.A O no hydrogen 2.836 N/A LEU 41.A N ARG 37.A O no hydrogen 3.207 N/A LEU 42.A N LEU 38.A O no hydrogen 2.899 N/A GLU 43.A N GLY 39.A O no hydrogen 2.978 N/A GLN 44.A N GLU 40.A O no hydrogen 2.974 N/A GLN 44.A NE2 GLY 264.A O no hydrogen 3.351 N/A LEU 45.A N LEU 41.A O no hydrogen 2.894 N/A ASN 46.A N LEU 42.A O no hydrogen 2.822 N/A GLN 47.A N GLU 43.A O no hydrogen 2.929 N/A SER 48.A N GLN 44.A O no hydrogen 3.050 N/A SER 48.A OG LEU 45.A O no hydrogen 2.704 N/A GLY 49.A N ASN 46.A O no hydrogen 3.363 N/A LEU 50.A N SER 48.A OG no hydrogen 3.314 N/A ASP 53.A N VAL 12.A O no hydrogen 2.736 N/A ILE 55.A N GLU 87.A O no hydrogen 2.763 N/A VAL 56.A N LEU 14.A O no hydrogen 2.790 N/A PHE 57.A N VAL 89.A O no hydrogen 2.892 N/A THR 58.A N ILE 16.A O no hydrogen 2.891 N/A THR 58.A OG1 HIS 15.A NE2 no hydrogen 3.007 N/A THR 58.A OG1 SER 17.A OG no hydrogen 2.749 N/A LEU 61.A N ASP 96.A OD1 no hydrogen 3.178 N/A LEU 61.A N ASP 96.A OD2 no hydrogen 2.946 N/A ALA 62.A N ASP 96.A OD1 no hydrogen 2.985 N/A ASP 63.A N LEU 21.A O no hydrogen 2.861 N/A LYS 64.A NZ ASP 63.A O no hydrogen 3.191 N/A LYS 64.A NZ ASP 63.A OD2 no hydrogen 2.933 N/A GLY 65.A N ALA 62.A O no hydrogen 3.411 N/A TYR 70.A N GLU 66.A O no hydrogen 3.039 N/A TYR 70.A OH ASP 96.A OD1 no hydrogen 2.613 N/A ARG 71.A N PRO 67.A O no hydrogen 2.904 N/A LYS 72.A N ALA 68.A O no hydrogen 3.059 N/A LYS 72.A NZ ILE 22.A O no hydrogen 2.849 N/A LYS 72.A NZ GLY 24.A O no hydrogen 2.738 N/A LYS 72.A NZ ASP 35.A OD1 no hydrogen 3.336 N/A LYS 72.A NZ ASP 35.A OD2 no hydrogen 2.696 N/A LEU 73.A N ALA 69.A O no hydrogen 2.828 N/A ARG 74.A N TYR 70.A O no hydrogen 2.876 N/A ARG 74.A NE GLU 78.A OE2 no hydrogen 2.810 N/A ARG 74.A NH1 PHE 104.A O no hydrogen 3.509 N/A ARG 74.A NH1 ASP 107.A OD1 no hydrogen 3.251 N/A ARG 74.A NH1 ASP 107.A OD2 no hydrogen 2.637 N/A ARG 74.A NH2 ASP 107.A OD1 no hydrogen 2.735 N/A GLY 75.A N ARG 71.A O no hydrogen 3.014 N/A LEU 76.A N LYS 72.A O no hydrogen 2.939 N/A VAL 77.A N LEU 73.A O no hydrogen 2.910 N/A GLU 78.A N ARG 74.A O no hydrogen 2.916 N/A ALA 81.A N VAL 77.A O no hydrogen 2.811 N/A ALA 82.A N GLU 78.A O no hydrogen 2.856 N/A GLN 83.A N PRO 79.A O no hydrogen 2.920 N/A LEU 84.A N PHE 80.A O no hydrogen 3.088 N/A GLY 85.A N ALA 82.A O no hydrogen 3.156 N/A ALA 86.A N ALA 81.A O no hydrogen 2.980 N/A GLU 87.A N ASP 53.A O no hydrogen 3.023 N/A VAL 89.A N ILE 55.A O no hydrogen 2.879 N/A GLY 93.A N ASP 96.A OD2 no hydrogen 2.970 N/A ASN 94.A ND2 HIS 137.A ND1 no hydrogen 2.970 N/A HIS 95.A N ASP 60.A OD1 no hydrogen 2.894 N/A HIS 95.A ND1 ASP 63.A O no hydrogen 2.778 N/A ASP 96.A N GLY 93.A O no hydrogen 3.118 N/A ASP 97.A N TYR 70.A OH no hydrogen 3.090 N/A ARG 98.A NE ASP 130.A OD2 no hydrogen 2.850 N/A ARG 98.A NH1 MET 112.A O no hydrogen 2.811 N/A GLU 100.A N ASP 97.A OD2 no hydrogen 3.001 N/A LEU 101.A N ASP 97.A O no hydrogen 2.840 N/A ARG 102.A N ARG 98.A O no hydrogen 3.049 N/A ARG 102.A NH1 SER 111.A O no hydrogen 2.850 N/A ARG 102.A NH1 ALA 113.A O no hydrogen 2.780 N/A ARG 102.A NH2 ALA 113.A O no hydrogen 2.992 N/A ARG 102.A NH2 PRO 114.A O no hydrogen 3.190 N/A LYS 103.A N ALA 99.A O no hydrogen 3.044 N/A LYS 103.A NZ GLU 100.A OE1 no hydrogen 3.108 N/A PHE 104.A N GLU 100.A O no hydrogen 2.922 N/A LEU 105.A N LEU 101.A O no hydrogen 2.870 N/A LEU 106.A N LEU 101.A O no hydrogen 3.289 N/A LEU 106.A N ARG 102.A O no hydrogen 3.178 N/A GLU 108.A N ARG 102.A O no hydrogen 2.909 N/A ALA 113.A N SER 111.A OG no hydrogen 3.075 N/A LEU 115.A N ASP 130.A OD2 no hydrogen 2.824 N/A ASP 116.A N PRO 114.A O no hydrogen 3.012 N/A ARG 117.A N VAL 128.A O no hydrogen 2.973 N/A ARG 117.A NH1 GLU 108.A OE1 no hydrogen 2.946 N/A ARG 117.A NH2 GLU 108.A OE2 no hydrogen 2.614 N/A CYS 119.A N ILE 126.A O no hydrogen 2.922 N/A ILE 121.A N LEU 124.A O no hydrogen 2.781 N/A GLY 123.A N TYR 11.A OH no hydrogen 3.038 N/A LEU 124.A N ILE 121.A O no hydrogen 2.936 N/A ARG 125.A N GLY 160.A O no hydrogen 3.084 N/A ARG 125.A NE THR 161.A OG1 no hydrogen 2.814 N/A ARG 125.A NH1 GLU 152.A OE2 no hydrogen 2.783 N/A ARG 125.A NH1 THR 155.A O no hydrogen 3.239 N/A ARG 125.A NH2 THR 155.A O no hydrogen 2.822 N/A ARG 125.A NH2 THR 161.A OG1 no hydrogen 3.166 N/A ARG 125.A NH2 ASP 196.A OD1 no hydrogen 2.915 N/A ARG 125.A NH2 ASP 196.A OD2 no hydrogen 3.369 N/A ILE 126.A N CYS 119.A O no hydrogen 2.892 N/A ILE 127.A N ILE 162.A O no hydrogen 2.893 N/A VAL 128.A N ARG 117.A O no hydrogen 2.818 N/A LEU 129.A N ALA 164.A O no hydrogen 2.905 N/A ASP 130.A N ASP 116.A OD1 no hydrogen 2.784 N/A THR 131.A OG1 HIS 167.A ND1 no hydrogen 2.784 N/A SER 132.A N ASP 130.A OD1 no hydrogen 2.848 N/A SER 132.A OG ASP 130.A OD1 no hydrogen 2.574 N/A SER 132.A OG ASP 130.A OD2 no hydrogen 3.559 N/A HIS 136.A N VAL 133.A O no hydrogen 2.869 N/A HIS 136.A ND1 PRO 134.A O no hydrogen 3.248 N/A HIS 138.A NE2 GLU 140.A OE2 no hydrogen 2.625 N/A GLY 139.A N GLU 181.A O no hydrogen 3.069 N/A GLU 140.A N THR 131.A O no hydrogen 2.985 N/A ARG 142.A N GLN 145.A OE1 no hydrogen 2.832 N/A GLN 145.A NE2 ASP 116.A OD1 no hydrogen 3.131 N/A GLN 145.A NE2 ASP 116.A OD2 no hydrogen 2.892 N/A GLN 145.A NE2 ASP 130.A O no hydrogen 2.936 N/A LEU 146.A N ARG 142.A O no hydrogen 2.969 N/A GLY 147.A N ALA 143.A O no hydrogen 2.958 N/A TRP 148.A N SER 144.A O no hydrogen 3.020 N/A LEU 149.A N GLN 145.A O no hydrogen 2.892 N/A ALA 150.A N LEU 146.A O no hydrogen 2.907 N/A GLU 151.A N GLY 147.A O no hydrogen 3.018 N/A GLU 152.A N TRP 148.A O no hydrogen 2.976 N/A LEU 153.A N LEU 149.A O no hydrogen 2.921 N/A ALA 154.A N GLU 151.A O no hydrogen 3.294 N/A ALA 157.A N ASP 196.A OD2 no hydrogen 2.851 N/A ASP 159.A N GLY 123.A O no hydrogen 2.863 N/A GLY 160.A N ALA 157.A O no hydrogen 2.966 N/A THR 161.A N ASP 196.A O no hydrogen 2.998 N/A THR 161.A OG1 ASP 196.A OD1 no hydrogen 3.153 N/A THR 161.A OG1 ASP 196.A OD2 no hydrogen 2.742 N/A ILE 162.A N ARG 125.A O no hydrogen 2.815 N/A LEU 163.A N ALA 199.A O no hydrogen 2.932 N/A ALA 164.A N ILE 127.A O no hydrogen 2.780 N/A LEU 165.A N LEU 201.A O no hydrogen 2.956 N/A HIS 166.A ND1 THR 58.A O no hydrogen 2.793 N/A HIS 167.A N THR 131.A OG1 no hydrogen 3.086 N/A HIS 167.A ND1 THR 131.A OG1 no hydrogen 2.784 N/A HIS 167.A NE2 HIS 137.A O no hydrogen 2.880 N/A SER 172.A OG LEU 174.A O no hydrogen 3.501 N/A SER 172.A OG TYR 207.A OH no hydrogen 2.796 N/A VAL 173.A N TYR 207.A OH no hydrogen 2.999 N/A LEU 174.A N SER 172.A OG no hydrogen 3.061 N/A ALA 177.A N LEU 174.A O no hydrogen 3.105 N/A VAL 178.A N ASP 175.A O no hydrogen 3.143 N/A THR 179.A N MET 176.A O no hydrogen 3.151 N/A THR 179.A OG1 MET 176.A O no hydrogen 2.758 N/A VAL 180.A N ALA 177.A O no hydrogen 3.091 N/A ARG 183.A N GLY 139.A O no hydrogen 2.818 N/A GLN 185.A NE2 LEU 182.A O no hydrogen 2.885 N/A ALA 187.A N ASP 184.A O no hydrogen 3.284 N/A GLY 189.A N GLN 185.A O no hydrogen 2.851 N/A ARG 190.A N ALA 186.A O no hydrogen 3.005 N/A LEU 192.A N LEU 188.A O no hydrogen 2.957 N/A ARG 193.A N GLY 189.A O no hydrogen 2.955 N/A THR 195.A N LEU 192.A O no hydrogen 3.116 N/A THR 195.A OG1 LEU 192.A O no hydrogen 2.664 N/A ARG 198.A N THR 161.A O no hydrogen 2.780 N/A ARG 198.A NH1 ASP 159.A O no hydrogen 2.888 N/A ARG 198.A NH2 TYR 252.A O no hydrogen 2.730 N/A ILE 200.A N PRO 217.A O no hydrogen 2.891 N/A LEU 201.A N LEU 163.A O no hydrogen 2.749 N/A ALA 202.A N SER 219.A O no hydrogen 2.980 N/A GLY 203.A N HIS 166.A O no hydrogen 3.000 N/A HIS 204.A N ASP 18.A OD2 no hydrogen 2.934 N/A HIS 204.A ND1 HIS 166.A NE2 no hydrogen 3.155 N/A HIS 204.A NE2 VAL 180.A O no hydrogen 2.961 N/A HIS 206.A ND1 TYR 226.A O no hydrogen 3.123 N/A TYR 207.A OH SER 172.A OG no hydrogen 2.796 N/A THR 209.A N VAL 220.A O no hydrogen 3.288 N/A ALA 211.A N VAL 218.A O no hydrogen 3.087 N/A PHE 213.A N ILE 216.A O no hydrogen 2.783 N/A ILE 216.A N PHE 213.A O no hydrogen 2.847 N/A VAL 218.A N ALA 211.A O no hydrogen 2.753 N/A SER 219.A N ILE 200.A O no hydrogen 2.822 N/A VAL 220.A N THR 209.A O no hydrogen 2.810 N/A ALA 221.A N ALA 202.A O no hydrogen 3.040 N/A ALA 223.A N SER 222.A OG no hydrogen 2.820 N/A THR 224.A N SER 17.A O no hydrogen 3.323 N/A CYS 225.A SG ASP 18.A O no hydrogen 3.223 N/A THR 227.A N ARG 240.A O no hydrogen 3.030 N/A THR 227.A OG1 GLY 242.A O no hydrogen 2.648 N/A GLN 228.A N HIS 206.A O no hydrogen 2.744 N/A ASP 229.A N ARG 238.A O no hydrogen 2.869 N/A THR 231.A N ASP 229.A OD1 no hydrogen 2.985 N/A THR 231.A OG1 ASP 229.A OD1 no hydrogen 2.730 N/A THR 231.A OG1 ASP 229.A OD2 no hydrogen 3.530 N/A VAL 232.A N ASP 229.A O no hydrogen 3.364 N/A GLY 236.A N ALA 233.A O no hydrogen 2.921 N/A THR 237.A OG1 GLN 228.A OE1 no hydrogen 2.717 N/A ARG 238.A NH2 ASP 229.A OD2 no hydrogen 2.852 N/A ARG 240.A N THR 227.A O no hydrogen 2.816 N/A ARG 240.A NE THR 227.A OG1 no hydrogen 2.901 N/A GLY 242.A N ARG 240.A O no hydrogen 2.994 N/A GLN 244.A N GLN 244.A OE1 no hydrogen 2.861 N/A GLN 244.A NE2 CYS 225.A O no hydrogen 2.894 N/A GLN 244.A NE2 ASP 241.A OD1 no hydrogen 2.754 N/A GLY 245.A N ALA 223.A O no hydrogen 3.329 N/A CYS 246.A N ILE 261.A O no hydrogen 2.947 N/A CYS 246.A SG ASN 247.A O no hydrogen 3.906 N/A ASN 247.A N HIS 15.A O no hydrogen 2.783 N/A LEU 248.A N SER 259.A O no hydrogen 2.755 N/A VAL 249.A N LEU 13.A O no hydrogen 2.762 N/A HIS 250.A N VAL 257.A O no hydrogen 2.856 N/A VAL 251.A N TYR 11.A O no hydrogen 2.825 N/A TYR 252.A N THR 255.A O no hydrogen 2.845 N/A VAL 257.A N HIS 250.A O no hydrogen 2.853 N/A SER 259.A N LEU 248.A O no hydrogen 2.854 N/A ILE 261.A N CYS 246.A O no hydrogen 2.729 N/A LEU 263.A N GLN 244.A O no hydrogen 3.062 N/A GLY 264.A N GLN 44.A OE1 no hydrogen 2.666 N/A SER 274.A N GLN 277.A OE1 no hydrogen 2.818 N/A GLN 277.A N SER 274.A OG no hydrogen 3.077 N/A ALA 278.A N SER 274.A O no hydrogen 2.859 N/A ARG 279.A N PRO 275.A O no hydrogen 3.085 N/A ARG 280.A N GLY 276.A O no hydrogen 3.223 N/A LYS 281.A N GLN 277.A O no hydrogen 2.905 N/A ILE 282.A N ALA 278.A O no hydrogen 2.918 N/A ALA 283.A N ARG 279.A O no hydrogen 3.231 N/A GLU 284.A N ARG 280.A O no hydrogen 2.914 N/A SER 285.A N LYS 281.A O no hydrogen 2.905 N/A SER 285.A N ILE 282.A O no hydrogen 3.130 N/A SER 285.A OG LYS 281.A O no hydrogen 3.440 N/A GLY 286.A N ALA 283.A O no hydrogen 2.800 N/A ILE 287.A N ILE 282.A O no hydrogen 3.239 N/A PHE 288.A N ARG 2.A O no hydrogen 3.070 N/A SER 292.A OG PRO 9.A O no hydrogen 2.853 N/A ARG 293.A NE ASP 10.A OD1 no hydrogen 2.964 N/A ARG 293.A NE ASP 10.A OD2 no hydrogen 3.406 N/A ARG 293.A NH2 ASP 10.A OD2 no hydrogen 2.604 N/A ARG 294.A N SER 292.A OG no hydrogen 2.910 N/A ARG 294.A NE ASP 122.A OD2 no hydrogen 2.780 N/A ARG 294.A NH1 ASP 10.A O no hydrogen 2.795 N/A ARG 294.A NH1 ASP 53.A OD1 no hydrogen 3.045 N/A ARG 294.A NH1 ASP 53.A OD2 no hydrogen 3.198 N/A ARG 294.A NH2 ASP 53.A OD1 no hydrogen 2.943 N/A ARG 294.A NH2 ASP 122.A OD2 no hydrogen 2.980 N/A ASP 295.A N SER 292.A O no hydrogen 3.197 N/A