Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2zdu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 4.A N VAL 15.A O no hydrogen 2.810 N/A TYR 4.A OH TYR 19.A O no hydrogen 2.571 N/A SER 5.A OG THR 14.A OG1 no hydrogen 2.761 N/A VAL 6.A N PHE 13.A O no hydrogen 2.781 N/A VAL 8.A N SER 11.A O no hydrogen 2.625 N/A SER 11.A N VAL 8.A O no hydrogen 2.801 N/A PHE 13.A N VAL 6.A O no hydrogen 2.722 N/A THR 14.A N TYR 98.A OH no hydrogen 3.175 N/A THR 14.A OG1 SER 5.A OG no hydrogen 2.761 N/A VAL 15.A N TYR 4.A O no hydrogen 2.760 N/A LYS 17.A N GLN 2.A O no hydrogen 3.032 N/A LYS 17.A NZ ASN 1.A O no hydrogen 2.733 N/A ARG 18.A NE ASP 38.A OD1 no hydrogen 3.025 N/A ARG 18.A NH2 ASP 38.A OD1 no hydrogen 3.394 N/A ARG 18.A NH2 ASP 38.A OD2 no hydrogen 2.767 N/A TYR 19.A N LEU 16.A O no hydrogen 3.307 N/A GLN 20.A N TYR 37.A O no hydrogen 2.669 N/A LYS 23.A N ALA 35.A O no hydrogen 3.220 N/A ILE 25.A N VAL 33.A O no hydrogen 3.063 N/A SER 27.A OG GLY 31.A O no hydrogen 3.276 N/A VAL 33.A N GLY 26.A O no hydrogen 3.083 N/A CYS 34.A N ILE 47.A O no hydrogen 2.985 N/A ALA 35.A N LYS 23.A O no hydrogen 2.949 N/A ALA 36.A N VAL 45.A O no hydrogen 2.942 N/A TYR 37.A N GLN 20.A O no hydrogen 3.042 N/A TYR 37.A OH ASP 42.A OD1 no hydrogen 2.896 N/A ASP 38.A N ARG 43.A O no hydrogen 2.988 N/A ALA 39.A N ARG 18.A O no hydrogen 2.877 N/A VAL 40.A N ASP 38.A OD1 no hydrogen 3.280 N/A VAL 45.A N ALA 36.A O no hydrogen 2.692 N/A ALA 46.A N MET 101.A O no hydrogen 2.913 N/A ILE 47.A N CYS 34.A O no hydrogen 2.728 N/A LYS 48.A N LEU 99.A O no hydrogen 2.909 N/A LYS 48.A NZ GLN 30.A OE1 no hydrogen 2.563 N/A LYS 49.A N ILE 32.A O no hydrogen 3.424 N/A LYS 49.A NZ THR 12.A O no hydrogen 2.733 N/A LYS 49.A NZ TYR 98.A OH no hydrogen 3.118 N/A LEU 50.A N VAL 97.A O no hydrogen 2.703 N/A ARG 52.A N GLN 95.A O no hydrogen 2.762 N/A GLN 55.A N ARG 52.A O no hydrogen 3.047 N/A GLN 57.A NE2 HIS 315.A O no hydrogen 3.316 N/A ALA 60.A N ASN 56.A O no hydrogen 3.001 N/A LYS 61.A N GLN 57.A O no hydrogen 3.198 N/A LYS 61.A NZ GLU 314.A OE1 no hydrogen 3.230 N/A ARG 62.A N THR 58.A O no hydrogen 2.870 N/A ALA 63.A N HIS 59.A O no hydrogen 2.955 N/A TYR 64.A N ALA 60.A O no hydrogen 3.098 N/A ARG 65.A N LYS 61.A O no hydrogen 2.950 N/A ARG 65.A NH1 PHE 163.A O no hydrogen 3.069 N/A GLU 66.A N ARG 62.A O no hydrogen 3.273 N/A LEU 67.A N ALA 63.A O no hydrogen 3.062 N/A VAL 68.A N TYR 64.A O no hydrogen 3.095 N/A LEU 69.A N ARG 65.A O no hydrogen 2.647 N/A MET 70.A N GLU 66.A O no hydrogen 2.695 N/A LYS 71.A N LEU 67.A O no hydrogen 3.355 N/A LYS 71.A NZ GLU 327.A OE2 no hydrogen 3.188 N/A ASN 77.A ND2 GLN 127.A OE1 no hydrogen 3.611 N/A ASN 77.A ND2 LEU 158.A O no hydrogen 3.104 N/A ILE 78.A N HIS 75.A O no hydrogen 2.849 N/A ILE 79.A N ILE 160.A O no hydrogen 2.884 N/A SER 80.A N GLU 102.A OE2 no hydrogen 2.761 N/A SER 80.A OG GLU 102.A OE1 no hydrogen 2.814 N/A SER 80.A OG GLU 102.A OE2 no hydrogen 2.623 N/A LEU 82.A N VAL 100.A O no hydrogen 2.579 N/A ASN 83.A N VAL 100.A O no hydrogen 3.205 N/A ASN 83.A ND2 TYR 19.A OH no hydrogen 2.904 N/A PHE 85.A N TYR 98.A O no hydrogen 2.932 N/A THR 86.A OG1 ASP 96.A O no hydrogen 2.963 N/A GLN 88.A N THR 86.A OG1 no hydrogen 3.242 N/A GLN 88.A NE2 ASP 96.A OD1 no hydrogen 3.389 N/A THR 90.A OG1 GLU 93.A OE1 no hydrogen 2.538 N/A GLU 93.A N THR 90.A O no hydrogen 3.211 N/A GLU 93.A N THR 90.A OG1 no hydrogen 3.139 N/A PHE 94.A N THR 90.A O no hydrogen 2.841 N/A PHE 94.A N LEU 91.A O no hydrogen 2.816 N/A GLN 95.A N GLN 88.A OE1 no hydrogen 2.746 N/A ASP 96.A N GLN 88.A OE1 no hydrogen 2.953 N/A VAL 97.A N LEU 50.A O no hydrogen 2.832 N/A TYR 98.A N PHE 85.A O no hydrogen 2.952 N/A LEU 99.A N LYS 48.A O no hydrogen 2.907 N/A VAL 100.A N ASN 83.A O no hydrogen 2.549 N/A MET 101.A N ALA 46.A O no hydrogen 2.899 N/A GLU 102.A N SER 80.A O no hydrogen 3.078 N/A ASP 105.A N VAL 152.A O no hydrogen 2.859 N/A ALA 106.A N VAL 152.A O no hydrogen 3.052 N/A ASN 107.A ND2 SER 148.A O no hydrogen 2.881 N/A LEU 108.A N ILE 150.A O no hydrogen 2.796 N/A CYS 109.A N ASN 107.A OD1 no hydrogen 2.812 N/A GLN 110.A N ASN 107.A O no hydrogen 2.972 N/A VAL 111.A N ASN 107.A O no hydrogen 3.200 N/A ILE 112.A N LEU 108.A O no hydrogen 2.828 N/A GLN 113.A N GLN 110.A O no hydrogen 2.725 N/A GLN 113.A NE2 CYS 109.A O no hydrogen 2.865 N/A ASP 117.A N ASP 117.A OD1 no hydrogen 2.493 N/A HIS 118.A ND1 TYR 300.A OH no hydrogen 2.755 N/A MET 121.A N ASP 117.A O no hydrogen 3.165 N/A SER 122.A N HIS 118.A O no hydrogen 2.839 N/A SER 122.A OG HIS 118.A O no hydrogen 2.772 N/A SER 122.A OG GLU 119.A O no hydrogen 3.136 N/A TYR 123.A N GLU 119.A O no hydrogen 3.208 N/A LEU 124.A N ARG 120.A O no hydrogen 3.161 N/A LEU 124.A N MET 121.A O no hydrogen 3.250 N/A LEU 125.A N MET 121.A O no hydrogen 3.200 N/A TYR 126.A N SER 122.A O no hydrogen 2.814 N/A TYR 126.A OH GLU 309.A OE2 no hydrogen 2.674 N/A GLN 127.A N TYR 123.A O no hydrogen 3.379 N/A GLN 127.A NE2 TYR 123.A O no hydrogen 2.773 N/A GLN 127.A NE2 CYS 156.A O no hydrogen 2.971 N/A MET 128.A N LEU 124.A O no hydrogen 3.029 N/A LEU 129.A N LEU 125.A O no hydrogen 3.128 N/A CYS 130.A N TYR 126.A O no hydrogen 2.977 N/A CYS 130.A SG TYR 126.A O no hydrogen 3.461 N/A GLY 131.A N GLN 127.A O no hydrogen 2.846 N/A ILE 132.A N MET 128.A O no hydrogen 2.911 N/A LYS 133.A N LEU 129.A O no hydrogen 2.707 N/A LYS 133.A NZ ASP 293.A OD1 no hydrogen 3.495 N/A LYS 133.A NZ ASP 293.A OD2 no hydrogen 2.853 N/A HIS 134.A N CYS 130.A O no hydrogen 2.888 N/A LEU 135.A N GLY 131.A O no hydrogen 2.904 N/A HIS 136.A N ILE 132.A O no hydrogen 2.846 N/A HIS 136.A NE2 ASP 187.A OD2 no hydrogen 2.658 N/A SER 137.A N LYS 133.A O no hydrogen 2.820 N/A SER 137.A OG LYS 133.A O no hydrogen 3.181 N/A ALA 138.A N HIS 134.A O no hydrogen 3.237 N/A GLY 139.A N HIS 136.A O no hydrogen 2.613 N/A ILE 140.A N LEU 135.A O no hydrogen 2.747 N/A HIS 142.A N ASP 187.A OD2 no hydrogen 3.086 N/A HIS 142.A NE2 ASP 162.A OD1 no hydrogen 3.286 N/A ARG 143.A N ASP 187.A OD1 no hydrogen 2.787 N/A ASP 144.A N HIS 142.A ND1 no hydrogen 3.152 N/A LYS 146.A NZ ASP 144.A OD1 no hydrogen 3.276 N/A LYS 146.A NZ THR 168.A O no hydrogen 3.292 N/A LYS 146.A NZ THR 168.A OG1 no hydrogen 3.396 N/A ASN 149.A N LYS 146.A O no hydrogen 3.123 N/A ILE 150.A N PRO 147.A O no hydrogen 2.895 N/A VAL 151.A N LYS 159.A O no hydrogen 3.035 N/A VAL 152.A N ALA 106.A O no hydrogen 2.949 N/A LYS 153.A N THR 157.A O no hydrogen 3.069 N/A SER 154.A N ASP 105.A OD2 no hydrogen 2.912 N/A SER 154.A OG ASP 105.A OD2 no hydrogen 2.844 N/A CYS 156.A N LYS 153.A O no hydrogen 2.581 N/A THR 157.A N ASP 155.A OD1 no hydrogen 2.814 N/A THR 157.A OG1 ASP 155.A OD1 no hydrogen 2.915 N/A LYS 159.A N VAL 151.A O no hydrogen 2.978 N/A LYS 159.A NZ LYS 76.A O no hydrogen 3.038 N/A LYS 159.A NZ GLU 102.A OE2 no hydrogen 3.393 N/A ILE 160.A N ASN 77.A O no hydrogen 2.863 N/A LEU 161.A N ASN 149.A O no hydrogen 2.910 N/A PHE 163.A N GLU 66.A OE1 no hydrogen 3.208 N/A LEU 165.A N HIS 142.A O no hydrogen 3.140 N/A TYR 171.A OH GLU 197.A OE1 no hydrogen 2.622 N/A ARG 172.A N ARG 169.A O no hydrogen 3.214 N/A ARG 172.A NE ASP 144.A OD1 no hydrogen 3.115 N/A GLU 175.A N GLU 175.A OE1 no hydrogen 2.769 N/A VAL 176.A N ALA 173.A O no hydrogen 2.836 N/A ILE 177.A N ALA 173.A O no hydrogen 2.930 N/A LEU 178.A N PRO 174.A O no hydrogen 2.949 N/A GLY 179.A N VAL 176.A O no hydrogen 2.761 N/A MET 180.A N GLU 175.A O no hydrogen 2.945 N/A GLU 184.A N GLU 184.A OE1 no hydrogen 2.554 N/A ASN 185.A ND2 PRO 286.A O no hydrogen 3.251 N/A ASN 185.A ND2 ARG 289.A O no hydrogen 3.135 N/A ASN 185.A ND2 ILE 290.A O no hydrogen 3.468 N/A VAL 186.A N LYS 183.A O no hydrogen 3.273 N/A ASP 187.A N GLU 184.A O no hydrogen 3.213 N/A ILE 188.A N ASN 185.A O no hydrogen 2.987 N/A SER 190.A N ASP 187.A O no hydrogen 3.297 N/A SER 190.A OG TYR 171.A O no hydrogen 3.069 N/A VAL 191.A N ASP 187.A O no hydrogen 3.441 N/A GLY 192.A N ILE 188.A O no hydrogen 3.017 N/A CYS 193.A N TRP 189.A O no hydrogen 3.270 N/A CYS 193.A SG TYR 170.A O no hydrogen 4.049 N/A CYS 193.A SG TRP 189.A O no hydrogen 3.327 N/A ILE 194.A N SER 190.A O no hydrogen 2.971 N/A MET 195.A N VAL 191.A O no hydrogen 2.890 N/A GLY 196.A N GLY 192.A O no hydrogen 2.754 N/A GLU 197.A N CYS 193.A O no hydrogen 2.751 N/A MET 198.A N ILE 194.A O no hydrogen 2.859 N/A VAL 199.A N GLY 196.A O no hydrogen 2.679 N/A ARG 200.A N GLY 196.A O no hydrogen 2.656 N/A ARG 200.A NH1 GLN 220.A OE1 no hydrogen 2.975 N/A ARG 200.A NH2 GLN 220.A OE1 no hydrogen 2.662 N/A ARG 200.A NH2 LEU 254.A O no hydrogen 3.480 N/A HIS 201.A N GLU 197.A O no hydrogen 2.591 N/A ARG 208.A N ASP 212.A OD2 no hydrogen 2.863 N/A ILE 211.A N ASP 209.A OD1 no hydrogen 3.280 N/A ASP 212.A N ASP 209.A OD2 no hydrogen 3.020 N/A GLN 213.A N ASP 209.A O no hydrogen 2.946 N/A GLN 213.A N TYR 210.A O no hydrogen 3.092 N/A GLN 213.A NE2 PHE 205.A O no hydrogen 2.693 N/A TRP 214.A N TYR 210.A O no hydrogen 3.468 N/A LYS 216.A N GLN 213.A O no hydrogen 3.008 N/A LYS 216.A NZ GLU 219.A OE1 no hydrogen 3.079 N/A VAL 217.A N GLN 213.A O no hydrogen 3.397 N/A VAL 217.A N TRP 214.A O no hydrogen 2.875 N/A ILE 218.A N TRP 214.A O no hydrogen 3.152 N/A GLU 219.A N ASN 215.A O no hydrogen 3.128 N/A GLN 220.A N VAL 217.A O no hydrogen 3.062 N/A GLN 220.A NE2 LEU 204.A O no hydrogen 3.207 N/A GLN 220.A NE2 LYS 216.A O no hydrogen 3.415 N/A LEU 221.A N VAL 217.A O no hydrogen 2.739 N/A GLY 222.A N ILE 218.A O no hydrogen 2.667 N/A THR 223.A N TYR 246.A O no hydrogen 2.986 N/A GLU 227.A N GLU 227.A OE1 no hydrogen 3.069 N/A PHE 228.A N CYS 225.A O no hydrogen 3.145 N/A MET 229.A N CYS 225.A O no hydrogen 3.286 N/A LYS 230.A N PRO 226.A O no hydrogen 2.801 N/A LYS 231.A N PHE 228.A O no hydrogen 2.720 N/A LEU 232.A N MET 229.A O no hydrogen 3.061 N/A ARG 237.A N GLN 233.A O no hydrogen 2.662 N/A ARG 237.A NH1 GLU 241.A OE1 no hydrogen 2.805 N/A TYR 239.A N THR 235.A O no hydrogen 3.358 N/A VAL 240.A N ARG 237.A O no hydrogen 3.221 N/A GLU 241.A N ARG 237.A O no hydrogen 3.204 N/A TYR 246.A N THR 223.A OG1 no hydrogen 3.163 N/A LEU 249.A N GLN 220.A O no hydrogen 2.780 N/A LYS 253.A N THR 250.A OG1 no hydrogen 3.226 N/A LEU 254.A N THR 250.A O no hydrogen 2.947 N/A PHE 255.A N PHE 251.A O no hydrogen 3.022 N/A LEU 259.A N PRO 256.A O no hydrogen 3.165 N/A PHE 260.A N ASP 257.A O no hydrogen 3.062 N/A ASP 263.A N ASP 263.A OD2 no hydrogen 2.438 N/A ASN 267.A N SER 264.A OG no hydrogen 2.750 N/A ASN 267.A ND2 ASP 263.A OD2 no hydrogen 2.663 N/A LYS 268.A N SER 264.A O no hydrogen 2.819 N/A LEU 269.A N GLU 265.A O no hydrogen 2.904 N/A LYS 270.A N HIS 266.A O no hydrogen 2.898 N/A LYS 270.A NZ GLN 273.A OE1 no hydrogen 2.989 N/A ALA 271.A N ASN 267.A O no hydrogen 3.084 N/A SER 272.A N LYS 268.A O no hydrogen 3.079 N/A GLN 273.A N LEU 269.A O no hydrogen 2.881 N/A ALA 274.A N LYS 270.A O no hydrogen 2.838 N/A ARG 275.A N ALA 271.A O no hydrogen 2.934 N/A ARG 275.A NE PHE 255.A O no hydrogen 3.460 N/A ASP 276.A N SER 272.A O no hydrogen 2.978 N/A LEU 277.A N GLN 273.A O no hydrogen 2.902 N/A LEU 278.A N ALA 274.A O no hydrogen 2.874 N/A SER 279.A N ARG 275.A O no hydrogen 2.758 N/A SER 279.A OG ASP 276.A O no hydrogen 2.621 N/A LYS 280.A N LEU 277.A O no hydrogen 2.822 N/A LYS 280.A NZ ASP 276.A OD1 no hydrogen 3.380 N/A LYS 280.A NZ ASP 276.A OD2 no hydrogen 2.549 N/A MET 281.A N LEU 277.A O no hydrogen 2.945 N/A MET 281.A N LEU 278.A O no hydrogen 3.160 N/A LEU 282.A N LEU 278.A O no hydrogen 2.908 N/A VAL 283.A N MET 281.A O no hydrogen 2.769 N/A ALA 287.A N ASP 285.A OD1 no hydrogen 3.281 N/A LYS 288.A N ASP 285.A O no hydrogen 2.864 N/A LYS 288.A NZ ASP 285.A OD2 no hydrogen 3.151 N/A ARG 289.A N PRO 286.A O no hydrogen 2.750 N/A ARG 289.A NE VAL 283.A O no hydrogen 2.977 N/A ARG 289.A NH1 GLU 175.A OE2 no hydrogen 2.812 N/A ARG 289.A NH1 ASN 185.A O no hydrogen 2.792 N/A ARG 289.A NH2 GLU 175.A OE1 no hydrogen 2.639 N/A ARG 289.A NH2 GLU 175.A OE2 no hydrogen 3.021 N/A ARG 289.A NH2 VAL 283.A O no hydrogen 3.310 N/A ARG 289.A NH2 ILE 284.A O no hydrogen 3.256 N/A ILE 290.A N LYS 280.A O no hydrogen 2.949 N/A ALA 295.A N SER 291.A O no hydrogen 3.152 N/A ALA 295.A N VAL 292.A O no hydrogen 3.125 N/A LEU 296.A N VAL 292.A O no hydrogen 3.247 N/A GLN 297.A N ASP 293.A O no hydrogen 3.255 N/A HIS 298.A NE2 ASP 276.A OD2 no hydrogen 2.734 N/A TYR 300.A N HIS 298.A ND1 no hydrogen 2.908 N/A TYR 300.A OH HIS 118.A ND1 no hydrogen 2.755 N/A ILE 301.A N HIS 298.A O no hydrogen 2.843 N/A ASN 302.A N HIS 298.A O no hydrogen 3.072 N/A ASN 302.A ND2 GLN 297.A O no hydrogen 2.809 N/A TRP 304.A N ILE 301.A O no hydrogen 3.113 N/A TRP 304.A NE1 SER 122.A OG no hydrogen 2.759 N/A TYR 305.A N ASN 302.A O no hydrogen 2.917 N/A ASP 306.A N TYR 126.A OH no hydrogen 2.951 N/A ALA 308.A N ASP 306.A OD1 no hydrogen 2.901 N/A GLU 309.A N ASP 306.A O no hydrogen 2.806 N/A VAL 310.A N ASP 306.A O no hydrogen 2.902 N/A GLU 311.A N PRO 307.A O no hydrogen 3.187 N/A ARG 313.A NH1 ARG 313.A O no hydrogen 3.524 N/A THR 316.A N GLU 319.A OE1 no hydrogen 2.821 N/A GLU 319.A N THR 316.A OG1 no hydrogen 3.075 N/A TRP 320.A N THR 316.A O no hydrogen 2.938 N/A TRP 320.A NE1 GLN 57.A OE1 no hydrogen 3.143 N/A LYS 321.A N ILE 317.A O no hydrogen 2.792 N/A LYS 321.A NZ LEU 91.A O no hydrogen 2.884 N/A LYS 321.A NZ GLU 92.A O no hydrogen 2.952 N/A GLU 322.A N GLU 318.A O no hydrogen 3.095 N/A LEU 323.A N GLU 319.A O no hydrogen 2.931 N/A ILE 324.A N TRP 320.A O no hydrogen 2.748 N/A TYR 325.A N LYS 321.A O no hydrogen 2.978 N/A LYS 326.A N GLU 322.A O no hydrogen 2.619 N/A GLU 327.A N LEU 323.A O no hydrogen 3.121 N/A VAL 328.A N ILE 324.A O no hydrogen 3.078 N/A VAL 328.A N TYR 325.A O no hydrogen 2.762 N/A MET 329.A N TYR 325.A O no hydrogen 3.171 N/A ASN 330.A N GLU 327.A O no hydrogen 2.956 N/A