Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4bdi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 8.A N PRO 5.A O no hydrogen 3.246 N/A ARG 9.A N PRO 5.A O no hydrogen 3.210 N/A ASP 10.A N LYS 6.A O no hydrogen 2.919 N/A GLU 11.A N LEU 8.A O no hydrogen 2.958 N/A TYR 12.A N LEU 8.A O no hydrogen 2.896 N/A ILE 13.A N PHE 26.A O no hydrogen 2.871 N/A SER 15.A N LEU 24.A O no hydrogen 2.744 N/A LEU 18.A N VAL 22.A O no hydrogen 2.595 N/A VAL 22.A N GLY 19.A O no hydrogen 3.085 N/A LYS 23.A N ILE 36.A O no hydrogen 2.810 N/A LEU 24.A N LYS 16.A O no hydrogen 2.782 N/A ALA 25.A N VAL 34.A O no hydrogen 3.087 N/A PHE 26.A N ILE 13.A O no hydrogen 2.904 N/A GLU 27.A N LYS 32.A O no hydrogen 2.912 N/A ARG 28.A N GLU 11.A O no hydrogen 2.932 N/A ARG 28.A NE ARG 9.A O no hydrogen 2.855 N/A ARG 28.A NH2 ARG 9.A O no hydrogen 2.782 N/A CYS 31.A N GLU 27.A O no hydrogen 2.708 N/A CYS 31.A SG ARG 28.A O no hydrogen 3.995 N/A LYS 32.A N THR 30.A OG1 no hydrogen 3.346 N/A VAL 34.A N ALA 25.A O no hydrogen 2.811 N/A ALA 35.A N LEU 76.A O no hydrogen 2.906 N/A ILE 36.A N LYS 23.A O no hydrogen 2.665 N/A LYS 37.A N ILE 74.A O no hydrogen 2.848 N/A ILE 38.A N GLU 21.A O no hydrogen 2.714 N/A ILE 39.A N TYR 72.A O no hydrogen 2.822 N/A LYS 41.A NZ ASP 68.A OD1 no hydrogen 2.766 N/A LYS 41.A NZ ALA 69.A O no hydrogen 2.780 N/A GLU 46.A N ALA 42.A O no hydrogen 3.105 N/A THR 47.A N LEU 43.A O no hydrogen 3.412 N/A GLU 48.A N ASN 44.A O no hydrogen 2.752 N/A ILE 49.A N VAL 45.A O no hydrogen 3.059 N/A GLU 50.A N GLU 46.A O no hydrogen 3.244 N/A ILE 51.A N THR 47.A O no hydrogen 2.879 N/A LEU 52.A N GLU 48.A O no hydrogen 2.864 N/A LYS 53.A N ILE 49.A O no hydrogen 2.846 N/A LYS 54.A N GLU 50.A O no hydrogen 3.355 N/A LYS 54.A N ILE 51.A O no hydrogen 3.120 N/A LEU 55.A N ILE 51.A O no hydrogen 3.143 N/A ASN 56.A N TYR 112.A OH no hydrogen 2.759 N/A CYS 59.A N HIS 57.A ND1 no hydrogen 3.008 N/A CYS 59.A SG GLN 105.A O no hydrogen 3.943 N/A CYS 59.A SG GLN 105.A OE1 no hydrogen 3.852 N/A ILE 60.A N HIS 57.A O no hydrogen 3.239 N/A ILE 61.A N ILE 141.A O no hydrogen 2.974 N/A LYS 62.A N GLU 77.A OE2 no hydrogen 2.713 N/A LYS 62.A NZ HIS 57.A O no hydrogen 3.134 N/A LYS 64.A N VAL 75.A O no hydrogen 2.719 N/A LYS 64.A NZ GLU 27.A OE1 no hydrogen 3.472 N/A ASN 65.A N VAL 75.A O no hydrogen 3.416 N/A ASN 65.A ND2 GLU 11.A OE2 no hydrogen 3.526 N/A ASN 65.A ND2 TYR 12.A OH no hydrogen 3.191 N/A PHE 66.A N ASN 65.A OD1 no hydrogen 2.969 N/A PHE 67.A N TYR 73.A O no hydrogen 2.759 N/A ALA 69.A N ASP 71.A O no hydrogen 3.057 N/A TYR 72.A N ILE 39.A O no hydrogen 2.801 N/A TYR 73.A N PHE 67.A O no hydrogen 2.831 N/A ILE 74.A N LYS 37.A O no hydrogen 2.857 N/A VAL 75.A N ASN 65.A O no hydrogen 2.804 N/A LEU 76.A N ALA 35.A O no hydrogen 2.701 N/A GLU 77.A N LYS 62.A O no hydrogen 3.403 N/A GLY 81.A N LEU 130.A O no hydrogen 2.962 N/A LEU 84.A N VAL 128.A O no hydrogen 2.820 N/A PHE 85.A N PRO 125.A O no hydrogen 3.078 N/A ASP 86.A N GLU 83.A O no hydrogen 3.210 N/A LYS 87.A N LEU 84.A O no hydrogen 2.953 N/A VAL 88.A N PHE 85.A O no hydrogen 3.139 N/A VAL 89.A N PHE 85.A O no hydrogen 2.825 N/A ASN 91.A ND2 GLY 198.A O no hydrogen 3.380 N/A LYS 92.A NZ VAL 89.A O no hydrogen 3.143 N/A ARG 93.A NE LEU 196.A O no hydrogen 3.387 N/A ARG 93.A NH1 VAL 226.A O no hydrogen 3.272 N/A ARG 93.A NH2 LEU 196.A O no hydrogen 2.872 N/A ARG 93.A NH2 VAL 226.A O no hydrogen 2.982 N/A LYS 95.A NZ GLU 135.A OE2 no hydrogen 2.779 N/A THR 98.A OG1 GLU 135.A OE1 no hydrogen 3.265 N/A CYS 99.A N LYS 95.A O no hydrogen 2.997 N/A CYS 99.A SG LEU 94.A O no hydrogen 3.972 N/A CYS 99.A SG LYS 95.A O no hydrogen 3.542 N/A LYS 100.A N GLU 96.A O no hydrogen 2.976 N/A LYS 100.A NZ TRP 260.A O no hydrogen 2.731 N/A LYS 100.A NZ ASP 263.A OD2 no hydrogen 2.915 N/A LEU 101.A N ALA 97.A O no hydrogen 3.116 N/A TYR 102.A N THR 98.A O no hydrogen 3.004 N/A TYR 102.A OH GLU 135.A O no hydrogen 2.608 N/A PHE 103.A N CYS 99.A O no hydrogen 2.739 N/A TYR 104.A N LYS 100.A O no hydrogen 2.872 N/A GLN 105.A N LEU 101.A O no hydrogen 3.409 N/A GLN 105.A NE2 LEU 101.A O no hydrogen 3.171 N/A GLN 105.A NE2 CYS 137.A O no hydrogen 3.132 N/A MET 106.A N TYR 102.A O no hydrogen 3.054 N/A LEU 107.A N PHE 103.A O no hydrogen 2.876 N/A LEU 108.A N TYR 104.A O no hydrogen 3.055 N/A ALA 109.A N GLN 105.A O no hydrogen 2.939 N/A VAL 110.A N MET 106.A O no hydrogen 2.906 N/A GLN 111.A N LEU 107.A O no hydrogen 2.771 N/A TYR 112.A N LEU 108.A O no hydrogen 2.943 N/A LEU 113.A N ALA 109.A O no hydrogen 3.019 N/A HIS 114.A N VAL 110.A O no hydrogen 2.933 N/A HIS 114.A NE2 ASP 184.A OD2 no hydrogen 2.767 N/A GLU 115.A N GLN 111.A O no hydrogen 2.875 N/A ASN 116.A N TYR 112.A O no hydrogen 3.142 N/A ASN 116.A N LEU 113.A O no hydrogen 3.104 N/A ASN 116.A ND2 TYR 112.A O no hydrogen 2.769 N/A GLY 117.A N HIS 114.A O no hydrogen 3.191 N/A ILE 118.A N LEU 113.A O no hydrogen 2.809 N/A ILE 119.A N LYS 148.A O no hydrogen 2.901 N/A HIS 120.A N ASP 184.A OD2 no hydrogen 3.006 N/A HIS 120.A NE2 THR 142.A O no hydrogen 2.746 N/A ARG 121.A N ASP 184.A OD1 no hydrogen 2.914 N/A ASP 122.A N HIS 120.A ND1 no hydrogen 3.067 N/A GLU 126.A N GLU 126.A OE2 no hydrogen 2.915 N/A ASN 127.A N LYS 124.A O no hydrogen 2.839 N/A ASN 127.A ND2 ASP 122.A O no hydrogen 2.746 N/A ASN 127.A ND2 ASP 122.A OD2 no hydrogen 3.175 N/A VAL 128.A N PRO 125.A O no hydrogen 3.422 N/A LEU 129.A N LYS 140.A O no hydrogen 2.777 N/A LEU 130.A N GLY 82.A O no hydrogen 2.752 N/A SER 131.A N LEU 138.A O no hydrogen 2.860 N/A SER 131.A OG LEU 138.A O no hydrogen 3.106 N/A CYS 137.A SG TYR 102.A OH no hydrogen 3.889 N/A CYS 137.A SG SER 132.A O no hydrogen 3.812 N/A CYS 137.A SG GLU 134.A O no hydrogen 3.515 N/A CYS 137.A SG LEU 138.A O no hydrogen 3.744 N/A LEU 138.A N SER 131.A OG no hydrogen 3.035 N/A ILE 139.A N GLN 105.A OE1 no hydrogen 2.754 N/A LYS 140.A N LEU 129.A O no hydrogen 2.739 N/A LYS 140.A NZ PRO 58.A O no hydrogen 2.982 N/A ILE 141.A N CYS 59.A O no hydrogen 2.897 N/A THR 142.A N ASN 127.A O no hydrogen 2.928 N/A SER 147.A N PHE 144.A O no hydrogen 3.253 N/A SER 147.A OG PHE 144.A O no hydrogen 2.452 N/A LYS 148.A N ILE 119.A O no hydrogen 2.876 N/A LEU 150.A N GLY 117.A O no hydrogen 2.681 N/A ARG 157.A N THR 153.A O no hydrogen 3.378 N/A THR 158.A N SER 154.A O no hydrogen 2.874 N/A THR 158.A OG1 SER 154.A O no hydrogen 2.730 N/A LEU 159.A N LEU 155.A O no hydrogen 2.887 N/A CYS 160.A N ARG 157.A O no hydrogen 3.237 N/A CYS 160.A SG MET 156.A O no hydrogen 3.329 N/A GLY 161.A N THR 158.A O no hydrogen 3.337 N/A THR 162.A OG1 THR 164.A OG1 no hydrogen 3.223 N/A THR 164.A OG1 THR 162.A OG1 no hydrogen 3.223 N/A LEU 166.A N PRO 163.A O no hydrogen 2.993 N/A GLU 169.A N GLU 169.A OE1 no hydrogen 2.719 N/A VAL 170.A N ALA 167.A O no hydrogen 3.183 N/A VAL 172.A N PRO 168.A O no hydrogen 2.854 N/A SER 173.A N GLU 169.A O no hydrogen 3.127 N/A SER 173.A OG VAL 170.A O no hydrogen 2.585 N/A VAL 174.A N LEU 171.A O no hydrogen 3.285 N/A GLY 175.A N VAL 172.A O no hydrogen 3.348 N/A THR 176.A N SER 173.A O no hydrogen 3.319 N/A THR 176.A OG1 SER 173.A O no hydrogen 3.557 N/A ALA 177.A N SER 173.A O no hydrogen 3.087 N/A TYR 179.A N THR 176.A O no hydrogen 3.165 N/A ALA 182.A N TYR 179.A O no hydrogen 3.040 N/A VAL 183.A N ASN 180.A O no hydrogen 3.110 N/A ASP 184.A N ARG 181.A O no hydrogen 2.990 N/A TRP 186.A N ALA 182.A O no hydrogen 3.117 N/A SER 187.A N VAL 183.A O no hydrogen 3.126 N/A SER 187.A OG VAL 183.A O no hydrogen 3.147 N/A LEU 188.A N ASP 184.A O no hydrogen 2.936 N/A GLY 189.A N CYS 185.A O no hydrogen 3.068 N/A VAL 190.A N TRP 186.A O no hydrogen 3.070 N/A ILE 191.A N SER 187.A O no hydrogen 2.923 N/A LEU 192.A N LEU 188.A O no hydrogen 2.934 N/A PHE 193.A N GLY 189.A O no hydrogen 2.974 N/A ILE 194.A N VAL 190.A O no hydrogen 3.106 N/A CYS 195.A N ILE 191.A O no hydrogen 2.874 N/A CYS 195.A SG ILE 191.A O no hydrogen 3.387 N/A LEU 196.A N LEU 192.A O no hydrogen 2.962 N/A SER 197.A N PHE 193.A O no hydrogen 3.013 N/A SER 197.A OG PHE 193.A O no hydrogen 2.839 N/A GLY 198.A N ILE 194.A O no hydrogen 2.769 N/A TYR 199.A N SER 197.A OG no hydrogen 3.203 N/A TYR 199.A OH ASN 221.A O no hydrogen 2.613 N/A SER 203.A N GLN 214.A OE1 no hydrogen 3.098 N/A HIS 205.A N SER 203.A OG no hydrogen 3.278 N/A LEU 211.A N GLU 204.A OE2 no hydrogen 3.485 N/A ASP 213.A N SER 210.A OG no hydrogen 3.266 N/A GLN 214.A N SER 210.A O no hydrogen 2.898 N/A GLN 214.A NE2 SER 203.A O no hydrogen 2.818 N/A GLN 214.A NE2 VAL 209.A O no hydrogen 2.965 N/A ILE 215.A N LEU 211.A O no hydrogen 3.007 N/A THR 216.A N LYS 212.A O no hydrogen 2.918 N/A THR 216.A OG1 LYS 212.A O no hydrogen 3.523 N/A SER 217.A N ASP 213.A O no hydrogen 3.278 N/A SER 217.A OG ASP 213.A O no hydrogen 2.666 N/A SER 217.A OG GLN 214.A O no hydrogen 3.186 N/A GLY 218.A N ILE 215.A O no hydrogen 2.991 N/A LYS 219.A N GLN 214.A O no hydrogen 3.117 N/A ASN 221.A N PRO 201.A O no hydrogen 2.778 N/A ILE 223.A N TYR 199.A OH no hydrogen 2.800 N/A GLU 225.A N GLU 225.A OE1 no hydrogen 2.909 N/A VAL 226.A N ILE 223.A O no hydrogen 3.081 N/A TRP 227.A N ILE 223.A O no hydrogen 3.146 N/A TRP 227.A NE1 TYR 199.A OH no hydrogen 3.061 N/A ALA 228.A N PRO 224.A O no hydrogen 2.857 N/A VAL 230.A N TRP 227.A O no hydrogen 3.170 N/A SER 231.A N GLU 96.A OE1 no hydrogen 2.792 N/A SER 231.A OG GLU 96.A OE1 no hydrogen 3.471 N/A SER 231.A OG GLU 96.A OE2 no hydrogen 2.794 N/A ALA 234.A N SER 231.A OG no hydrogen 3.175 N/A LEU 235.A N SER 231.A O no hydrogen 3.340 N/A ASP 236.A N GLU 232.A O no hydrogen 2.829 N/A LEU 237.A N LYS 233.A O no hydrogen 3.114 N/A VAL 238.A N ALA 234.A O no hydrogen 3.226 N/A LYS 239.A N LEU 235.A O no hydrogen 2.877 N/A LYS 240.A N ASP 236.A O no hydrogen 3.121 N/A LYS 240.A NZ ASP 236.A OD2 no hydrogen 3.286 N/A LEU 241.A N LEU 237.A O no hydrogen 3.120 N/A LEU 241.A N VAL 238.A O no hydrogen 3.128 N/A LEU 242.A N VAL 238.A O no hydrogen 2.837 N/A LYS 247.A N ASP 245.A OD1 no hydrogen 3.173 N/A LYS 247.A NZ GLY 175.A O no hydrogen 2.913 N/A ALA 248.A N ASP 245.A O no hydrogen 3.138 N/A ARG 249.A N ASP 245.A O no hydrogen 3.013 N/A ARG 249.A NE ALA 182.A O no hydrogen 3.242 N/A ARG 249.A NH1 VAL 243.A O no hydrogen 2.856 N/A ARG 249.A NH2 ALA 182.A O no hydrogen 2.779 N/A PHE 250.A N LYS 240.A O no hydrogen 3.046 N/A THR 251.A N GLU 254.A OE1 no hydrogen 3.160 N/A THR 252.A OG1 GLU 253.A OE1 no hydrogen 3.302 N/A GLU 254.A N THR 251.A OG1 no hydrogen 3.316 N/A ALA 255.A N THR 251.A O no hydrogen 2.951 N/A LEU 256.A N THR 252.A O no hydrogen 2.851 N/A ARG 257.A N GLU 253.A O no hydrogen 3.092 N/A HIS 258.A N ALA 255.A O no hydrogen 3.029 N/A HIS 258.A NE2 ASP 236.A OD2 no hydrogen 2.744 N/A TRP 260.A N HIS 258.A ND1 no hydrogen 3.023 N/A TRP 260.A NE1 GLU 96.A OE2 no hydrogen 2.814 N/A LEU 261.A N HIS 258.A O no hydrogen 2.898 N/A GLN 262.A N PRO 259.A O no hydrogen 3.243 N/A GLN 262.A NE2 LEU 256.A O no hydrogen 2.870 N/A GLN 262.A NE2 HIS 258.A O no hydrogen 2.899 N/A MET 266.A N ASP 263.A OD1 no hydrogen 2.881 N/A LYS 267.A N ASP 263.A O no hydrogen 3.050 N/A LYS 267.A NZ LEU 261.A O no hydrogen 3.400 N/A ARG 268.A N GLU 264.A O no hydrogen 2.862 N/A ARG 268.A NH1 ASP 265.A OD1 no hydrogen 2.718 N/A ARG 268.A NH2 ASP 265.A OD1 no hydrogen 3.241 N/A LYS 269.A N ASP 265.A O no hydrogen 3.023 N/A PHE 270.A N MET 266.A O no hydrogen 3.043 N/A GLN 271.A N LYS 267.A O no hydrogen 2.906 N/A ASP 272.A N ARG 268.A O no hydrogen 2.761 N/A LEU 273.A N LYS 269.A O no hydrogen 2.988 N/A LEU 274.A N PHE 270.A O no hydrogen 2.957 N/A SER 275.A N GLN 271.A O no hydrogen 3.137 N/A SER 275.A OG GLN 271.A O no hydrogen 3.036 N/A SER 275.A OG ASP 272.A O no hydrogen 3.447 N/A GLU 276.A N ASP 272.A O no hydrogen 3.256 N/A GLU 277.A N LEU 273.A O no hydrogen 3.296 N/A ASN 278.A N LEU 274.A O no hydrogen 2.953 N/A ALA 282.A N ASN 278.A O no hydrogen 2.902 N/A GLN 285.A NE2 LEU 283.A O no hydrogen 3.393 N/A