Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4bfu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 4.A N SER 2.A OG no hydrogen 3.208 N/A VAL 5.A N LEU 303.A O no hydrogen 2.693 N/A PHE 7.A N LEU 301.A O no hydrogen 2.929 N/A ASP 8.A N GLN 11.A OE1 no hydrogen 3.044 N/A ARG 9.A N ASN 299.A O no hydrogen 3.238 N/A ARG 9.A NH1 GLU 42.A OE2 no hydrogen 2.679 N/A ARG 9.A NH1 ILE 298.A O no hydrogen 2.660 N/A GLN 11.A N ASP 8.A OD1 no hydrogen 3.112 N/A TRP 12.A N ASP 8.A O no hydrogen 2.947 N/A ARG 13.A N ARG 9.A O no hydrogen 2.967 N/A ARG 13.A NE GLU 45.A OE1 no hydrogen 2.785 N/A ARG 13.A NH2 GLU 45.A OE2 no hydrogen 3.125 N/A ALA 14.A N ARG 10.A O no hydrogen 2.842 N/A LEU 23.A N GLU 44.A OE2 no hydrogen 2.929 N/A THR 24.A N GLU 27.A OE1 no hydrogen 3.493 N/A GLU 27.A N THR 24.A OG1 no hydrogen 2.982 N/A LEU 28.A N THR 24.A O no hydrogen 3.034 N/A LEU 31.A N LEU 28.A O no hydrogen 3.322 N/A ARG 32.A N LEU 28.A O no hydrogen 3.235 N/A ARG 32.A N VAL 29.A O no hydrogen 2.861 N/A GLY 33.A N VAL 29.A O no hydrogen 2.819 N/A GLY 35.A N ARG 32.A O no hydrogen 2.454 N/A GLU 36.A N LEU 34.A O no hydrogen 3.121 N/A GLN 37.A N GLY 35.A O no hydrogen 2.564 N/A LEU 41.A N ASP 39.A OD1 no hydrogen 2.578 N/A GLU 42.A N ASP 39.A OD1 no hydrogen 3.003 N/A VAL 43.A N ASP 39.A O no hydrogen 2.978 N/A GLU 44.A N LEU 40.A O no hydrogen 2.980 N/A GLU 45.A N LEU 41.A O no hydrogen 3.009 N/A VAL 46.A N GLU 42.A O no hydrogen 2.935 N/A TYR 47.A N GLU 42.A O no hydrogen 3.272 N/A TYR 47.A OH THR 100.A OG1 no hydrogen 3.191 N/A LEU 48.A N VAL 43.A O no hydrogen 2.932 N/A LEU 50.A N VAL 46.A O no hydrogen 3.170 N/A ALA 51.A N TYR 47.A O no hydrogen 2.751 N/A ARG 52.A N LEU 48.A O no hydrogen 2.995 N/A ARG 52.A NH1 THR 19.A OG1 no hydrogen 2.743 N/A ARG 52.A NH2 THR 19.A OG1 no hydrogen 3.083 N/A LEU 53.A N PRO 49.A O no hydrogen 2.984 N/A ILE 54.A N LEU 50.A O no hydrogen 3.186 N/A HIS 55.A N ALA 51.A O no hydrogen 2.924 N/A HIS 55.A ND1 HIS 114.A NE2 no hydrogen 2.861 N/A LEU 56.A N ARG 52.A O no hydrogen 2.898 N/A GLN 57.A N LEU 53.A O no hydrogen 3.355 N/A VAL 58.A N ILE 54.A O no hydrogen 2.873 N/A ALA 59.A N HIS 55.A O no hydrogen 2.822 N/A ALA 60.A N LEU 56.A O no hydrogen 3.065 N/A ARG 61.A N GLN 57.A O no hydrogen 3.118 N/A ARG 61.A NH1 ASP 213.A OD1 no hydrogen 3.430 N/A GLN 62.A N VAL 58.A O no hydrogen 3.068 N/A GLN 62.A NE2 HIS 113.A O no hydrogen 3.100 N/A ARG 63.A N ALA 59.A O no hydrogen 2.971 N/A LEU 64.A N ALA 60.A O no hydrogen 2.861 N/A PHE 65.A N ARG 61.A O no hydrogen 2.893 N/A ALA 66.A N GLN 62.A O no hydrogen 3.284 N/A ALA 67.A N ARG 63.A O no hydrogen 2.852 N/A THR 68.A N LEU 64.A O no hydrogen 2.945 N/A THR 68.A OG1 LEU 64.A O no hydrogen 3.119 N/A ALA 69.A N PHE 65.A O no hydrogen 2.903 N/A GLU 70.A N ALA 66.A O no hydrogen 2.973 N/A PHE 71.A N ALA 67.A O no hydrogen 3.047 N/A LEU 72.A N THR 68.A O no hydrogen 3.074 N/A GLY 73.A N GLU 70.A O no hydrogen 2.717 N/A GLU 74.A N ALA 69.A O no hydrogen 2.796 N/A GLN 77.A N GLN 77.A OE1 no hydrogen 3.123 N/A ARG 81.A NH1 ASP 164.A OD1 no hydrogen 3.375 N/A ARG 81.A NH2 ASP 164.A OD2 no hydrogen 3.487 N/A PHE 85.A N ASP 190.A O no hydrogen 3.020 N/A ILE 86.A N ASP 213.A OD2 no hydrogen 2.831 N/A ILE 87.A N LEU 192.A O no hydrogen 2.724 N/A GLY 88.A N PHE 214.A O no hydrogen 3.036 N/A VAL 89.A N LEU 194.A O no hydrogen 2.811 N/A ALA 90.A N LEU 216.A O no hydrogen 2.876 N/A SER 92.A OG VAL 93.A O no hydrogen 2.857 N/A LYS 97.A NZ GLY 91.A O no hydrogen 3.467 N/A LYS 97.A NZ SER 92.A O no hydrogen 2.738 N/A THR 100.A N GLY 96.A O no hydrogen 2.954 N/A THR 100.A OG1 TYR 47.A OH no hydrogen 3.191 N/A THR 100.A OG1 GLY 96.A O no hydrogen 3.096 N/A ALA 101.A N LYS 97.A O no hydrogen 2.614 N/A ARG 102.A N SER 98.A O no hydrogen 2.850 N/A VAL 103.A N THR 99.A O no hydrogen 2.711 N/A LEU 104.A N THR 100.A O no hydrogen 2.982 N/A GLN 105.A N ALA 101.A O no hydrogen 2.872 N/A GLN 105.A NE2 VAL 117.A O no hydrogen 2.958 N/A ALA 106.A N ARG 102.A O no hydrogen 3.153 N/A LEU 107.A N VAL 103.A O no hydrogen 2.917 N/A LEU 108.A N LEU 104.A O no hydrogen 2.815 N/A ARG 110.A N LEU 107.A O no hydrogen 3.378 N/A ARG 110.A NH1 ALA 22.A O no hydrogen 3.532 N/A ARG 110.A NH1 GLU 27.A OE1 no hydrogen 2.591 N/A TRP 111.A N LEU 108.A O no hydrogen 3.491 N/A HIS 114.A N TRP 111.A O no hydrogen 3.277 N/A HIS 114.A NE2 HIS 55.A ND1 no hydrogen 2.861 N/A ARG 116.A N ASP 190.A OD2 no hydrogen 3.128 N/A ARG 116.A NH1 HIS 188.A O no hydrogen 2.888 N/A ARG 116.A NH2 ARG 187.A O no hydrogen 2.724 N/A ASP 118.A N ILE 191.A O no hydrogen 2.872 N/A VAL 120.A N ILE 193.A O no hydrogen 2.860 N/A THR 121.A OG1 GLU 195.A O no hydrogen 3.404 N/A THR 121.A OG1 GLU 195.A OE2 no hydrogen 3.364 N/A THR 122.A N GLU 195.A O no hydrogen 2.784 N/A THR 122.A OG1 ASN 198.A OD1 no hydrogen 2.782 N/A ASP 123.A N THR 121.A OG1 no hydrogen 3.018 N/A GLY 124.A N THR 121.A O no hydrogen 3.474 N/A PHE 125.A N THR 122.A O no hydrogen 2.688 N/A LEU 126.A N ASP 123.A O no hydrogen 3.271 N/A TYR 127.A N SER 146.A O no hydrogen 2.819 N/A ASN 129.A N ASP 177.A OD1 no hydrogen 2.622 N/A ASN 129.A ND2 TYR 176.A O no hydrogen 3.096 N/A LEU 132.A N PRO 128.A O no hydrogen 2.840 N/A GLN 133.A N ASN 129.A O no hydrogen 2.878 N/A ARG 134.A N ALA 130.A O no hydrogen 3.049 N/A ARG 135.A N LEU 132.A O no hydrogen 3.128 N/A ARG 135.A NE GLU 131.A OE2 no hydrogen 2.844 N/A ARG 135.A NH2 GLU 131.A OE2 no hydrogen 3.447 N/A ASN 136.A N GLN 133.A O no hydrogen 2.884 N/A ASN 136.A ND2 GLN 133.A O no hydrogen 3.339 N/A LEU 137.A N LEU 132.A O no hydrogen 3.035 N/A ARG 140.A N LEU 137.A O no hydrogen 2.387 N/A ARG 140.A NH1 GLU 145.A OE1 no hydrogen 3.286 N/A LYS 141.A N MET 138.A O no hydrogen 3.176 N/A LYS 141.A NZ ASN 129.A OD1 no hydrogen 2.747 N/A LYS 141.A NZ TYR 171.A OH no hydrogen 2.819 N/A GLY 142.A N SER 146.A OG no hydrogen 2.712 N/A PHE 143.A N ARG 140.A O no hydrogen 2.749 N/A SER 146.A N PHE 143.A O no hydrogen 2.893 N/A SER 146.A OG PHE 143.A O no hydrogen 2.494 N/A TYR 147.A N PRO 144.A O no hydrogen 3.250 N/A ASN 148.A N PHE 125.A O no hydrogen 2.782 N/A ALA 151.A N ASN 148.A OD1 no hydrogen 3.174 N/A LEU 152.A N ASN 148.A O no hydrogen 2.895 N/A MET 153.A N ARG 149.A O no hydrogen 2.848 N/A ARG 154.A N ARG 150.A O no hydrogen 2.907 N/A PHE 155.A N ALA 151.A O no hydrogen 2.979 N/A VAL 156.A N LEU 152.A O no hydrogen 3.154 N/A THR 157.A N MET 153.A O no hydrogen 2.986 N/A THR 157.A OG1 MET 153.A O no hydrogen 2.814 N/A SER 158.A N ARG 154.A O no hydrogen 2.920 N/A VAL 159.A N PHE 155.A O no hydrogen 2.986 N/A LYS 160.A N VAL 156.A O no hydrogen 2.754 N/A LYS 160.A NZ LEU 211.A O no hydrogen 2.787 N/A LYS 160.A NZ ASP 213.A OD1 no hydrogen 3.176 N/A LYS 160.A NZ ASP 213.A OD2 no hydrogen 3.243 N/A SER 161.A N THR 157.A O no hydrogen 2.863 N/A SER 161.A N SER 158.A O no hydrogen 3.247 N/A SER 161.A OG THR 157.A O no hydrogen 2.714 N/A GLY 162.A N VAL 159.A O no hydrogen 3.236 N/A SER 163.A N SER 158.A O no hydrogen 3.365 N/A SER 163.A OG SER 158.A OG no hydrogen 3.404 N/A SER 163.A OG TYR 165.A O no hydrogen 2.907 N/A ALA 166.A N VAL 186.A O no hydrogen 3.070 N/A CYS 167.A SG ALA 168.A O no hydrogen 3.974 N/A CYS 167.A SG GLU 183.A OE1 no hydrogen 3.705 N/A ALA 168.A N GLN 184.A O no hydrogen 2.853 N/A SER 172.A N ASP 177.A O no hydrogen 2.821 N/A HIS 173.A NE2 ASP 123.A OD2 no hydrogen 2.840 N/A LEU 174.A N SER 172.A OG no hydrogen 2.827 N/A HIS 175.A N SER 172.A OG no hydrogen 2.749 N/A ILE 179.A N VAL 170.A O no hydrogen 3.120 N/A ALA 182.A N ILE 179.A O no hydrogen 3.219 N/A GLN 184.A N ALA 168.A O no hydrogen 2.763 N/A GLN 184.A NE2 LEU 119.A O no hydrogen 3.277 N/A VAL 186.A N ALA 166.A O no hydrogen 2.731 N/A HIS 188.A NE2 PRO 82.A O no hydrogen 2.897 N/A ASP 190.A N ARG 116.A O no hydrogen 2.907 N/A ILE 191.A N ARG 116.A O no hydrogen 3.151 N/A LEU 192.A N PHE 85.A O no hydrogen 2.906 N/A ILE 193.A N ASP 118.A O no hydrogen 2.827 N/A LEU 194.A N ILE 87.A O no hydrogen 2.660 N/A GLU 195.A N VAL 120.A O no hydrogen 2.884 N/A GLY 196.A N VAL 89.A O no hydrogen 3.025 N/A GLN 201.A N ASN 198.A O no hydrogen 3.130 N/A GLN 201.A NE2 ASN 278.A O no hydrogen 2.702 N/A LEU 206.A N THR 205.A OG1 no hydrogen 2.576 N/A MET 207.A N ASP 210.A OD2 no hydrogen 2.915 N/A ASP 210.A N MET 207.A O no hydrogen 2.969 N/A LEU 211.A N VAL 208.A O no hydrogen 2.891 N/A PHE 212.A N SER 209.A O no hydrogen 3.216 N/A ASP 213.A N ILE 86.A O no hydrogen 2.901 N/A PHE 214.A N ILE 86.A O no hydrogen 3.381 N/A SER 215.A N THR 287.A OG1 no hydrogen 2.893 N/A SER 215.A OG THR 287.A OG1 no hydrogen 3.394 N/A LEU 216.A N GLY 88.A O no hydrogen 2.800 N/A TYR 217.A N LEU 288.A O no hydrogen 2.917 N/A VAL 218.A N ALA 90.A O no hydrogen 2.888 N/A ASP 219.A N LEU 290.A O no hydrogen 2.812 N/A ILE 225.A N ARG 221.A O no hydrogen 3.158 N/A GLU 226.A N ILE 222.A O no hydrogen 3.153 N/A GLN 227.A N GLU 223.A O no hydrogen 3.193 N/A GLN 227.A NE2 SER 231.A OG no hydrogen 3.304 N/A TRP 228.A N ASP 224.A O no hydrogen 3.033 N/A TRP 228.A NE1 ALA 294.A O no hydrogen 2.836 N/A TYR 229.A N ILE 225.A O no hydrogen 2.631 N/A VAL 230.A N GLU 226.A O no hydrogen 2.808 N/A SER 231.A N GLN 227.A O no hydrogen 2.946 N/A SER 231.A OG GLN 227.A O no hydrogen 3.059 N/A ARG 232.A N TRP 228.A O no hydrogen 3.027 N/A PHE 233.A N TYR 229.A O no hydrogen 3.049 N/A LEU 234.A N VAL 230.A O no hydrogen 2.871 N/A ALA 235.A N SER 231.A O no hydrogen 2.914 N/A MET 236.A N PHE 233.A O no hydrogen 2.924 N/A ARG 237.A N LEU 234.A O no hydrogen 2.794 N/A ARG 237.A NE LEU 234.A O no hydrogen 2.916 N/A ARG 237.A NH1 PHE 254.A O no hydrogen 3.091 N/A ARG 237.A NH1 ASP 256.A OD1 no hydrogen 2.555 N/A ARG 237.A NH2 ASP 256.A OD1 no hydrogen 2.773 N/A THR 239.A N MET 236.A O no hydrogen 3.040 N/A THR 239.A OG1 ALA 235.A O no hydrogen 3.462 N/A THR 239.A OG1 MET 236.A O no hydrogen 3.499 N/A PHE 241.A N MET 236.A O no hydrogen 2.890 N/A ALA 242.A N THR 239.A O no hydrogen 3.082 N/A GLU 245.A N ASP 243.A OD1 no hydrogen 3.446 N/A PHE 248.A N SER 246.A OG no hydrogen 2.680 N/A TYR 251.A N PHE 248.A O no hydrogen 2.795 N/A ALA 252.A N HIS 249.A O no hydrogen 2.703 N/A PHE 254.A N TYR 251.A O no hydrogen 3.091 N/A SER 257.A N SER 255.A OG no hydrogen 3.128 N/A GLN 258.A N SER 255.A O no hydrogen 2.871 N/A ALA 259.A N SER 255.A O no hydrogen 2.909 N/A VAL 261.A N SER 257.A O no hydrogen 3.423 N/A ALA 262.A N GLN 258.A O no hydrogen 3.155 N/A ALA 263.A N ALA 259.A O no hydrogen 2.962 N/A ARG 264.A N VAL 260.A O no hydrogen 2.728 N/A GLU 265.A N VAL 261.A O no hydrogen 3.244 N/A TRP 267.A N ALA 263.A O no hydrogen 2.979 N/A ARG 268.A N ARG 264.A O no hydrogen 3.123 N/A THR 269.A N GLU 265.A O no hydrogen 3.154 N/A THR 269.A OG1 GLU 265.A O no hydrogen 2.670 N/A ILE 270.A N ILE 266.A O no hydrogen 3.027 N/A ASN 271.A N ILE 266.A O no hydrogen 3.197 N/A ARG 272.A N TRP 267.A O no hydrogen 2.659 N/A ASN 274.A N ILE 270.A O no hydrogen 3.034 N/A ASN 274.A ND2 GLY 142.A O no hydrogen 2.621 N/A LEU 275.A N ASN 271.A O no hydrogen 3.143 N/A LEU 275.A N ARG 272.A O no hydrogen 2.971 N/A VAL 276.A N ARG 272.A O no hydrogen 3.013 N/A GLU 277.A N PRO 273.A O no hydrogen 2.894 N/A ASN 278.A N ASN 274.A O no hydrogen 2.991 N/A ASN 278.A ND2 ASN 274.A OD1 no hydrogen 2.915 N/A ILE 279.A N LEU 275.A O no hydrogen 3.255 N/A LEU 280.A N LEU 275.A O no hydrogen 2.778 N/A THR 282.A N ILE 279.A O no hydrogen 2.878 N/A THR 282.A OG1 ILE 279.A O no hydrogen 2.681 N/A ARG 283.A N LEU 280.A O no hydrogen 2.999 N/A ARG 285.A N THR 282.A O no hydrogen 3.027 N/A ARG 285.A NH1 LEU 200.A O no hydrogen 2.833 N/A ARG 285.A NH1 SER 209.A OG no hydrogen 2.953 N/A ALA 286.A N ARG 283.A O no hydrogen 3.157 N/A THR 287.A N SER 215.A OG no hydrogen 3.194 N/A THR 287.A OG1 SER 215.A O no hydrogen 3.477 N/A THR 287.A OG1 SER 215.A OG no hydrogen 3.394 N/A LEU 288.A N SER 215.A O no hydrogen 3.067 N/A VAL 289.A N ARG 302.A O no hydrogen 2.856 N/A LEU 290.A N TYR 217.A O no hydrogen 3.047 N/A ARG 291.A N ARG 300.A O no hydrogen 2.859 N/A LYS 292.A N ASP 219.A O no hydrogen 2.708 N/A LYS 292.A NZ HIS 296.A ND1 no hydrogen 3.485 N/A ASP 293.A N SER 297.A O no hydrogen 2.605 N/A HIS 296.A N ASP 293.A O no hydrogen 2.807 N/A ILE 298.A N GLU 42.A OE2 no hydrogen 2.725 N/A ASN 299.A N ARG 291.A O no hydrogen 2.846 N/A LEU 301.A N PHE 7.A O no hydrogen 2.895 N/A ARG 302.A N VAL 289.A O no hydrogen 2.883 N/A ARG 302.A NE GLU 6.A OE1 no hydrogen 2.693 N/A LEU 303.A N VAL 5.A O no hydrogen 2.972 N/A ARG 304.A N THR 287.A O no hydrogen 2.823 N/A ARG 304.A NH2 PRO 284.A O no hydrogen 2.499 N/A LYS 305.A N PRO 3.A O no hydrogen 2.857 N/A LYS 305.A NZ SER 2.A O no hydrogen 2.829 N/A