Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1xku_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N ASP 28.A O no hydrogen 2.820 N/A CYS 4.A SG CYS 8.A O no hydrogen 3.559 N/A ARG 7.A NE PHE 6.A O no hydrogen 3.279 N/A ARG 7.A NH1 LEU 20.A O no hydrogen 3.277 N/A ARG 7.A NH2 LEU 20.A O no hydrogen 3.269 N/A CYS 8.A N PRO 5.A O no hydrogen 2.886 N/A GLN 9.A N GLN 16.A O no hydrogen 2.960 N/A GLN 9.A NE2 ARG 7.A O no hydrogen 2.920 N/A HIS 11.A N VAL 14.A O no hydrogen 3.038 N/A ARG 13.A NE ASP 32.A O no hydrogen 2.873 N/A ARG 13.A NH2 ASP 32.A O no hydrogen 2.819 N/A VAL 14.A N HIS 11.A O no hydrogen 3.121 N/A VAL 15.A N LEU 35.A O no hydrogen 2.915 N/A GLN 16.A N GLN 9.A O no hydrogen 2.767 N/A GLN 16.A NE2 ASP 37.A OD2 no hydrogen 3.041 N/A CYS 17.A N ASP 37.A O no hydrogen 2.827 N/A SER 18.A N GLN 16.A OE1 no hydrogen 2.866 N/A SER 18.A OG GLN 16.A OE1 no hydrogen 2.722 N/A SER 18.A OG ASP 37.A OD1 no hydrogen 3.201 N/A SER 18.A OG ASP 37.A OD2 no hydrogen 3.476 N/A ASP 19.A N GLN 39.A O no hydrogen 3.174 N/A ASP 19.A N ASN 40.A O no hydrogen 3.224 N/A LEU 20.A N ASN 41.A OD1 no hydrogen 2.994 N/A LEU 22.A N ASN 41.A OD1 no hydrogen 2.964 N/A THR 33.A N PRO 30.A O no hydrogen 3.142 N/A THR 33.A OG1 PRO 30.A O no hydrogen 2.688 N/A ALA 34.A N ARG 13.A O no hydrogen 2.791 N/A LEU 35.A N ARG 13.A O no hydrogen 3.245 N/A LEU 36.A N THR 59.A O no hydrogen 3.015 N/A ASP 37.A N VAL 15.A O no hydrogen 2.861 N/A LEU 38.A N ILE 61.A O no hydrogen 2.791 N/A GLN 39.A N ASP 37.A OD1 no hydrogen 3.114 N/A ASN 40.A N ILE 63.A O no hydrogen 2.987 N/A ASN 40.A ND2 ASP 19.A OD2 no hydrogen 2.886 N/A ASN 41.A ND2 CYS 17.A O no hydrogen 3.016 N/A ASN 41.A ND2 LEU 38.A O no hydrogen 2.833 N/A LYS 42.A N LEU 22.A O no hydrogen 2.667 N/A ILE 43.A N ASN 65.A OD1 no hydrogen 3.070 N/A ILE 46.A N LYS 69.A O no hydrogen 2.984 N/A LYS 47.A N ASP 50.A OD1 no hydrogen 2.956 N/A ASP 50.A N LYS 47.A O no hydrogen 3.094 N/A LYS 52.A NZ GLY 49.A O no hydrogen 3.056 N/A ASN 56.A ND2 PRO 31.A O no hydrogen 3.607 N/A LEU 57.A N LEU 54.A O no hydrogen 3.347 N/A HIS 58.A N ALA 34.A O no hydrogen 2.893 N/A HIS 58.A ND1 THR 59.A OG1 no hydrogen 2.692 N/A THR 59.A N ALA 34.A O no hydrogen 3.160 N/A THR 59.A OG1 HIS 58.A ND1 no hydrogen 2.692 N/A LEU 60.A N ARG 83.A O no hydrogen 2.994 N/A ILE 61.A N LEU 36.A O no hydrogen 2.907 N/A LEU 62.A N TYR 85.A O no hydrogen 2.862 N/A ASN 64.A N SER 87.A O no hydrogen 2.885 N/A ASN 65.A ND2 LEU 38.A O no hydrogen 3.018 N/A ASN 65.A ND2 LEU 62.A O no hydrogen 2.845 N/A LYS 66.A N ILE 43.A O no hydrogen 2.826 N/A ILE 67.A N ASN 89.A OD1 no hydrogen 2.913 N/A SER 68.A N THR 44.A O no hydrogen 3.080 N/A SER 71.A N ILE 46.A O no hydrogen 3.158 N/A SER 71.A OG ILE 46.A O no hydrogen 3.175 N/A GLY 73.A N GLU 96.A O no hydrogen 3.003 N/A ALA 74.A N SER 71.A O no hydrogen 3.079 N/A ALA 76.A N GLY 73.A O no hydrogen 3.016 N/A LEU 78.A N PHE 75.A O no hydrogen 2.885 N/A LEU 81.A N LEU 78.A O no hydrogen 3.062 N/A GLU 82.A N HIS 58.A O no hydrogen 2.828 N/A ARG 83.A N HIS 58.A O no hydrogen 3.022 N/A ARG 83.A NE THR 59.A OG1 no hydrogen 2.969 N/A ARG 83.A NH1 GLU 82.A OE1 no hydrogen 3.382 N/A ARG 83.A NH2 HIS 58.A ND1 no hydrogen 3.095 N/A ARG 83.A NH2 GLU 82.A OE1 no hydrogen 3.144 N/A LEU 84.A N GLU 104.A O no hydrogen 3.002 N/A TYR 85.A N LEU 60.A O no hydrogen 3.023 N/A TYR 85.A OH GLU 104.A OE1 no hydrogen 2.961 N/A LEU 86.A N ARG 106.A O no hydrogen 2.700 N/A LYS 88.A N HIS 108.A O no hydrogen 2.881 N/A LYS 88.A NZ GLU 109.A OE1 no hydrogen 3.544 N/A LYS 88.A NZ GLU 109.A OE2 no hydrogen 2.901 N/A ASN 89.A N GLU 109.A O no hydrogen 3.268 N/A ASN 89.A ND2 LEU 62.A O no hydrogen 3.012 N/A ASN 89.A ND2 LEU 86.A O no hydrogen 2.884 N/A GLN 90.A N ILE 67.A O no hydrogen 2.765 N/A LEU 91.A N ASN 110.A OD1 no hydrogen 3.003 N/A LYS 92.A NZ GLU 111.A OE1 no hydrogen 2.599 N/A THR 101.A OG1 VAL 79.A O no hydrogen 3.292 N/A THR 101.A OG1 LEU 81.A O no hydrogen 2.734 N/A LEU 102.A N PRO 99.A O no hydrogen 3.112 N/A GLN 103.A N GLU 82.A O no hydrogen 2.718 N/A GLU 104.A N GLU 82.A O no hydrogen 2.949 N/A LEU 105.A N VAL 128.A O no hydrogen 3.044 N/A ARG 106.A N LEU 84.A O no hydrogen 3.038 N/A ARG 106.A NH1 GLU 104.A OE2 no hydrogen 2.723 N/A VAL 107.A N GLU 130.A O no hydrogen 2.891 N/A HIS 108.A N SER 87.A OG no hydrogen 2.968 N/A HIS 108.A ND1 GLU 130.A OE1 no hydrogen 2.567 N/A GLU 109.A N GLY 132.A O no hydrogen 2.899 N/A ASN 110.A N ASN 134.A OD1 no hydrogen 3.110 N/A ASN 110.A ND2 LEU 86.A O no hydrogen 3.029 N/A ASN 110.A ND2 HIS 108.A O no hydrogen 3.280 N/A GLU 111.A N LEU 91.A O no hydrogen 2.824 N/A ILE 112.A N ASN 134.A OD1 no hydrogen 2.953 N/A THR 113.A N LYS 92.A O no hydrogen 3.055 N/A LYS 114.A NZ LYS 92.A O no hydrogen 3.127 N/A LYS 114.A NZ GLU 93.A OE2 no hydrogen 3.456 N/A VAL 115.A N GLY 140.A O no hydrogen 2.778 N/A ARG 116.A NE GLU 93.A OE2 no hydrogen 3.525 N/A LYS 117.A N GLU 142.A OE2 no hydrogen 2.831 N/A SER 118.A OG GLU 96.A OE1 no hydrogen 3.148 N/A SER 118.A OG GLU 96.A OE2 no hydrogen 3.000 N/A PHE 120.A N LYS 117.A O no hydrogen 2.978 N/A ASN 121.A N LYS 117.A O no hydrogen 3.249 N/A LEU 123.A N PHE 120.A O no hydrogen 3.115 N/A ASN 124.A N GLY 122.A O no hydrogen 2.898 N/A ILE 127.A N GLN 103.A O no hydrogen 2.736 N/A VAL 128.A N GLN 103.A O no hydrogen 3.097 N/A VAL 129.A N TYR 154.A O no hydrogen 3.112 N/A GLU 130.A N LEU 105.A O no hydrogen 2.949 N/A LEU 131.A N ARG 156.A O no hydrogen 2.747 N/A GLY 132.A N GLU 130.A OE1 no hydrogen 2.754 N/A THR 133.A N ALA 158.A O no hydrogen 2.698 N/A THR 133.A OG1 HIS 108.A NE2 no hydrogen 2.890 N/A ASN 134.A ND2 VAL 107.A O no hydrogen 3.091 N/A ASN 134.A ND2 LEU 131.A O no hydrogen 2.857 N/A SER 138.A OG THR 164.A O no hydrogen 3.555 N/A SER 138.A OG THR 164.A OG1 no hydrogen 3.364 N/A GLY 140.A N LYS 137.A O no hydrogen 2.966 N/A ILE 141.A N SER 138.A O no hydrogen 3.130 N/A GLU 142.A N VAL 115.A O no hydrogen 3.110 N/A GLY 144.A N GLN 167.A O no hydrogen 3.137 N/A ALA 145.A N GLU 142.A O no hydrogen 3.075 N/A GLN 147.A N GLY 144.A O no hydrogen 2.944 N/A MET 149.A N PHE 146.A O no hydrogen 3.275 N/A LYS 150.A N ASN 124.A OD1 no hydrogen 3.398 N/A LYS 151.A NZ GLN 125.A OE1 no hydrogen 2.956 N/A LEU 152.A N MET 149.A O no hydrogen 3.231 N/A SER 153.A N ILE 127.A O no hydrogen 2.976 N/A SER 153.A OG THR 174.A OG1 no hydrogen 2.858 N/A TYR 154.A N ILE 127.A O no hydrogen 2.886 N/A ILE 155.A N GLU 175.A O no hydrogen 3.212 N/A ARG 156.A N VAL 129.A O no hydrogen 2.941 N/A ARG 156.A NE ASP 179.A OD1 no hydrogen 2.965 N/A ARG 156.A NH1 GLU 130.A OE2 no hydrogen 3.166 N/A ARG 156.A NH2 ASP 179.A OD2 no hydrogen 2.798 N/A ILE 157.A N HIS 177.A O no hydrogen 2.828 N/A ASP 159.A N ASP 179.A O no hydrogen 3.119 N/A THR 160.A N ASN 181.A OD1 no hydrogen 2.829 N/A THR 160.A OG1 ASN 181.A OD1 no hydrogen 2.720 N/A ASN 161.A N LEU 136.A O no hydrogen 2.871 N/A ASN 161.A ND2 PRO 135.A O no hydrogen 2.962 N/A ILE 162.A N THR 160.A OG1 no hydrogen 3.189 N/A THR 163.A N SER 138.A OG no hydrogen 2.951 N/A THR 164.A N SER 138.A OG no hydrogen 3.197 N/A THR 164.A OG1 SER 138.A OG no hydrogen 3.364 N/A SER 172.A OG LYS 150.A O no hydrogen 3.376 N/A SER 172.A OG LEU 152.A O no hydrogen 2.632 N/A LEU 173.A N PRO 170.A O no hydrogen 3.053 N/A THR 174.A N SER 153.A O no hydrogen 2.885 N/A THR 174.A OG1 SER 153.A O no hydrogen 3.253 N/A THR 174.A OG1 SER 153.A OG no hydrogen 2.858 N/A GLU 175.A N SER 153.A O no hydrogen 2.984 N/A LEU 176.A N LYS 199.A O no hydrogen 3.051 N/A HIS 177.A N ILE 155.A O no hydrogen 2.929 N/A HIS 177.A NE2 GLU 175.A OE2 no hydrogen 2.805 N/A LEU 178.A N GLY 201.A O no hydrogen 2.767 N/A GLY 180.A N SER 203.A O no hydrogen 2.826 N/A ASN 181.A ND2 ILE 157.A O no hydrogen 2.731 N/A ASN 181.A ND2 LEU 178.A O no hydrogen 2.951 N/A LYS 182.A N ILE 162.A O no hydrogen 2.854 N/A LYS 182.A NZ ASN 161.A OD1 no hydrogen 2.850 N/A ILE 183.A N ASN 205.A OD1 no hydrogen 3.207 N/A THR 184.A N THR 163.A O no hydrogen 3.416 N/A VAL 186.A N ALA 209.A O no hydrogen 3.001 N/A SER 190.A OG ASP 187.A O no hydrogen 2.813 N/A SER 190.A OG ASP 187.A OD1 no hydrogen 2.844 N/A LEU 191.A N ALA 188.A O no hydrogen 3.133 N/A LYS 192.A N ALA 189.A O no hydrogen 3.176 N/A LEU 194.A N LEU 191.A O no hydrogen 3.194 N/A ASN 195.A N GLY 193.A O no hydrogen 2.923 N/A ASN 196.A ND2 PRO 171.A O no hydrogen 2.870 N/A LEU 197.A N LEU 194.A O no hydrogen 3.314 N/A ALA 198.A N THR 174.A O no hydrogen 2.725 N/A LYS 199.A N THR 174.A O no hydrogen 2.947 N/A LYS 199.A NZ GLU 223.A OE1 no hydrogen 2.851 N/A LEU 200.A N GLU 223.A O no hydrogen 3.007 N/A GLY 201.A N LEU 176.A O no hydrogen 2.852 N/A LEU 202.A N HIS 225.A O no hydrogen 2.880 N/A PHE 204.A N ASN 227.A O no hydrogen 3.106 N/A ASN 205.A ND2 LEU 178.A O no hydrogen 2.976 N/A ASN 205.A ND2 LEU 202.A O no hydrogen 2.952 N/A SER 206.A N ILE 183.A O no hydrogen 2.770 N/A ILE 207.A N ASN 229.A OD1 no hydrogen 3.013 N/A SER 208.A N THR 184.A O no hydrogen 2.934 N/A SER 208.A OG THR 184.A O no hydrogen 3.343 N/A ASP 211.A N VAL 186.A O no hydrogen 2.676 N/A SER 214.A N ASP 211.A O no hydrogen 3.182 N/A SER 214.A OG VAL 186.A O no hydrogen 3.292 N/A SER 214.A OG ASP 211.A O no hydrogen 2.841 N/A ASN 217.A N SER 214.A O no hydrogen 3.267 N/A ASN 217.A ND2 ALA 188.A O no hydrogen 2.673 N/A THR 218.A N LEU 215.A O no hydrogen 3.022 N/A THR 218.A OG1 LEU 215.A O no hydrogen 3.016 N/A HIS 220.A ND1 ASN 195.A O no hydrogen 2.617 N/A LEU 221.A N THR 218.A O no hydrogen 3.090 N/A ARG 222.A N ALA 198.A O no hydrogen 2.850 N/A GLU 223.A N ALA 198.A O no hydrogen 3.008 N/A LEU 224.A N VAL 246.A O no hydrogen 2.742 N/A HIS 225.A N LEU 200.A O no hydrogen 3.083 N/A LEU 226.A N TYR 248.A O no hydrogen 2.804 N/A ASN 227.A ND2 ASN 228.A OD1 no hydrogen 2.863 N/A ASN 228.A N HIS 250.A O no hydrogen 3.016 N/A ASN 229.A N ASN 251.A O no hydrogen 3.179 N/A ASN 229.A ND2 LEU 202.A O no hydrogen 2.862 N/A ASN 229.A ND2 LEU 226.A O no hydrogen 2.953 N/A LYS 230.A N ILE 207.A O no hydrogen 2.821 N/A LEU 231.A N ASN 252.A OD1 no hydrogen 3.029 N/A HIS 241.A N GLY 237.A O no hydrogen 3.034 N/A HIS 241.A N LEU 238.A O no hydrogen 3.199 N/A HIS 241.A NE2 THR 218.A O no hydrogen 2.799 N/A TYR 243.A N HIS 241.A ND1 no hydrogen 3.299 N/A ILE 244.A N HIS 241.A ND1 no hydrogen 3.016 N/A GLN 245.A N ARG 222.A O no hydrogen 2.824 N/A GLN 245.A NE2 SER 273.A O no hydrogen 3.109 N/A VAL 246.A N ARG 222.A O no hydrogen 2.886 N/A VAL 247.A N GLY 276.A O no hydrogen 2.852 N/A TYR 248.A N LEU 224.A O no hydrogen 2.867 N/A LEU 249.A N SER 278.A O no hydrogen 2.983 N/A LEU 249.A N SER 278.A OG no hydrogen 2.939 N/A HIS 250.A N SER 278.A OG no hydrogen 3.256 N/A ASN 251.A N PHE 280.A O no hydrogen 3.223 N/A ASN 252.A ND2 LEU 226.A O no hydrogen 2.970 N/A ASN 252.A ND2 LEU 249.A O no hydrogen 3.061 N/A ASN 253.A N LEU 231.A O no hydrogen 2.636 N/A ILE 254.A N ASN 282.A OD1 no hydrogen 3.104 N/A GLY 258.A N ASP 261.A OD2 no hydrogen 2.948 N/A ASP 261.A N GLY 258.A O no hydrogen 3.335 N/A CYS 263.A SG THR 293.A O no hydrogen 3.444 N/A LYS 270.A N ASN 268.A OD1 no hydrogen 2.964 N/A LYS 271.A N ASN 268.A O no hydrogen 3.063 N/A LYS 271.A NZ LEU 238.A O no hydrogen 2.946 N/A LYS 271.A NZ HIS 241.A O no hydrogen 2.886 N/A LYS 271.A NZ TYR 274.A OH no hydrogen 3.208 N/A ALA 272.A N LYS 242.A O no hydrogen 2.763 N/A TYR 274.A OH PHE 262.A O no hydrogen 2.733 N/A SER 275.A N GLN 245.A O no hydrogen 2.715 N/A SER 275.A OG GLN 245.A O no hydrogen 3.445 N/A GLY 276.A N GLN 245.A O no hydrogen 3.212 N/A VAL 277.A N ALA 302.A O no hydrogen 2.929 N/A SER 278.A N VAL 247.A O no hydrogen 3.138 N/A LEU 279.A N GLN 304.A O no hydrogen 2.802 N/A ASN 282.A ND2 LEU 249.A O no hydrogen 3.055 N/A ASN 282.A ND2 LEU 279.A O no hydrogen 2.710 N/A ASN 282.A ND2 PHE 280.A O no hydrogen 3.188 N/A VAL 284.A N ILE 254.A O no hydrogen 2.899 N/A GLN 285.A N GLU 288.A OE2 no hydrogen 2.856 N/A GLN 285.A NE2 ASN 282.A O no hydrogen 3.683 N/A GLN 285.A NE2 PRO 283.A O no hydrogen 2.882 N/A GLN 285.A NE2 VAL 284.A O no hydrogen 3.475 N/A GLU 288.A N GLN 285.A O no hydrogen 2.757 N/A ILE 289.A N TYR 286.A O no hydrogen 3.403 N/A GLN 290.A NE2 ILE 257.A O no hydrogen 3.242 N/A THR 293.A N GLN 290.A O no hydrogen 3.054 N/A THR 293.A OG1 GLN 290.A O no hydrogen 2.890 N/A PHE 294.A N PRO 291.A O no hydrogen 3.443 N/A ARG 295.A N SER 292.A O no hydrogen 2.884 N/A ARG 295.A NE PRO 264.A O no hydrogen 3.402 N/A ARG 295.A NH1 SER 259.A O no hydrogen 2.925 N/A ARG 295.A NH1 SER 292.A O no hydrogen 2.745 N/A ARG 295.A NH2 SER 259.A O no hydrogen 3.456 N/A ARG 295.A NH2 ASN 260.A OD1 no hydrogen 2.552 N/A ARG 295.A NH2 PRO 264.A O no hydrogen 2.901 N/A VAL 297.A N PHE 294.A O no hydrogen 3.067 N/A ALA 302.A N VAL 299.A O no hydrogen 3.192 N/A GLN 304.A N VAL 277.A O no hydrogen 2.694 N/A GLN 304.A NE2 ALA 302.A O no hydrogen 3.621 N/A