Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2xuu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 1.A N GLU 61.A OE2 no hydrogen 3.497 N/A THR 1.A OG1 GLU 61.A OE1 no hydrogen 2.860 N/A ARG 4.A N VAL 81.A O no hydrogen 2.939 N/A ARG 4.A NE GLU 6.A OE1 no hydrogen 3.464 N/A GLU 6.A N GLU 6.A OE1 no hydrogen 3.074 N/A ASP 9.A N ASN 7.A OD1 no hydrogen 2.848 N/A ASP 10.A N ASN 7.A O no hydrogen 3.087 N/A TYR 11.A N VAL 8.A O no hydrogen 2.885 N/A TYR 11.A OH GLU 6.A OE2 no hydrogen 3.275 N/A TYR 12.A N VAL 8.A O no hydrogen 2.934 N/A TYR 12.A OH HIS 79.A ND1 no hydrogen 3.143 N/A TYR 12.A OH GLU 80.A OE2 no hydrogen 2.716 N/A ASP 13.A N ARG 30.A O no hydrogen 2.963 N/A GLY 15.A N LYS 28.A O no hydrogen 2.812 N/A LEU 18.A N VAL 26.A O no hydrogen 2.675 N/A GLY 19.A N VAL 26.A O no hydrogen 3.267 N/A GLY 21.A N ALA 24.A O no hydrogen 2.804 N/A VAL 25.A N PHE 42.A O no hydrogen 3.174 N/A VAL 26.A N GLY 19.A O no hydrogen 2.828 N/A LYS 27.A N ALA 40.A O no hydrogen 2.896 N/A LYS 28.A N GLU 16.A O no hydrogen 2.822 N/A CYS 29.A N TYR 38.A O no hydrogen 2.935 N/A ARG 30.A N ASP 13.A O no hydrogen 2.959 N/A GLU 31.A N LEU 36.A O no hydrogen 2.815 N/A LYS 32.A N TYR 11.A O no hydrogen 2.954 N/A LYS 32.A NZ ASP 9.A O no hydrogen 2.831 N/A LYS 32.A NZ ASP 10.A O no hydrogen 3.463 N/A THR 34.A OG1 GLU 31.A OE1 no hydrogen 2.726 N/A GLY 35.A N GLU 31.A O no hydrogen 2.819 N/A LEU 36.A N THR 34.A OG1 no hydrogen 3.182 N/A TYR 38.A N CYS 29.A O no hydrogen 2.930 N/A ALA 39.A N LEU 92.A O no hydrogen 2.977 N/A ALA 40.A N LYS 27.A O no hydrogen 2.750 N/A LYS 41.A N LEU 90.A O no hydrogen 2.861 N/A LYS 41.A NZ GLU 63.A OE1 no hydrogen 3.523 N/A LYS 41.A NZ GLU 63.A OE2 no hydrogen 2.623 N/A PHE 42.A N VAL 25.A O no hydrogen 3.010 N/A ILE 43.A N VAL 88.A O no hydrogen 2.786 N/A LYS 44.A N PHE 23.A O no hydrogen 2.850 N/A LYS 45.A N THR 86.A O no hydrogen 2.841 N/A LYS 45.A NZ GLU 83.A OE1 no hydrogen 3.028 N/A LYS 45.A NZ ASN 84.A O no hydrogen 2.584 N/A LYS 45.A NZ LYS 85.A O no hydrogen 3.402 N/A ARG 46.A N VAL 55.A O no hydrogen 3.334 N/A THR 48.A OG1 SER 50.A OG no hydrogen 2.773 N/A SER 50.A OG THR 48.A OG1 no hydrogen 2.773 N/A SER 51.A N THR 48.A O no hydrogen 2.604 N/A SER 51.A OG ARG 46.A O no hydrogen 3.400 N/A SER 51.A OG ARG 53.A O no hydrogen 3.381 N/A ARG 53.A N SER 51.A OG no hydrogen 3.103 N/A VAL 55.A N LYS 44.A O no hydrogen 2.895 N/A ARG 57.A NE GLU 61.A OE2 no hydrogen 2.696 N/A ARG 57.A NH1 GLU 83.A OE1 no hydrogen 2.567 N/A ASP 59.A N SER 56.A OG no hydrogen 3.060 N/A ILE 60.A N SER 56.A O no hydrogen 3.020 N/A GLU 61.A N ARG 57.A O no hydrogen 2.871 N/A ARG 62.A N GLU 58.A O no hydrogen 2.993 N/A ARG 62.A NH1 ASP 59.A OD1 no hydrogen 2.798 N/A ARG 62.A NH2 GLU 58.A OE1 no hydrogen 3.157 N/A GLU 63.A N ASP 59.A O no hydrogen 3.278 N/A VAL 64.A N ILE 60.A O no hydrogen 2.985 N/A SER 65.A N GLU 61.A O no hydrogen 2.837 N/A ILE 66.A N ARG 62.A O no hydrogen 2.980 N/A LEU 67.A N GLU 63.A O no hydrogen 3.095 N/A LYS 68.A N VAL 64.A O no hydrogen 2.930 N/A GLU 69.A N ILE 66.A O no hydrogen 3.052 N/A ILE 70.A N LEU 67.A O no hydrogen 3.239 N/A GLN 71.A N TYR 128.A OH no hydrogen 2.935 N/A ASN 74.A N HIS 72.A ND1 no hydrogen 3.018 N/A ASN 74.A ND2 GLN 121.A OE1 no hydrogen 3.312 N/A ASN 74.A ND2 ILE 156.A O no hydrogen 2.855 N/A VAL 75.A N HIS 72.A O no hydrogen 3.161 N/A ILE 76.A N ILE 158.A O no hydrogen 3.198 N/A THR 77.A N GLU 93.A OE1 no hydrogen 3.168 N/A THR 77.A OG1 GLU 93.A OE1 no hydrogen 3.514 N/A HIS 79.A N ILE 91.A O no hydrogen 2.661 N/A GLU 80.A N ILE 91.A O no hydrogen 3.385 N/A TYR 82.A N ILE 89.A O no hydrogen 2.979 N/A TYR 82.A OH GLU 80.A OE2 no hydrogen 2.612 N/A GLU 83.A N ARG 4.A O no hydrogen 2.954 N/A ASN 84.A N ASP 87.A O no hydrogen 3.081 N/A THR 86.A N ASN 84.A OD1 no hydrogen 3.027 N/A THR 86.A OG1 ASN 84.A OD1 no hydrogen 3.076 N/A THR 86.A OG1 ASP 87.A OD1 no hydrogen 3.381 N/A ASP 87.A N ASN 84.A OD1 no hydrogen 2.778 N/A VAL 88.A N ILE 43.A O no hydrogen 2.991 N/A ILE 89.A N TYR 82.A O no hydrogen 2.789 N/A LEU 90.A N LYS 41.A O no hydrogen 2.763 N/A ILE 91.A N GLU 80.A O no hydrogen 2.814 N/A LEU 92.A N ALA 39.A O no hydrogen 2.748 N/A GLU 93.A N THR 77.A O no hydrogen 2.948 N/A ALA 96.A N LEU 147.A O no hydrogen 3.146 N/A GLY 97.A N LEU 146.A O no hydrogen 2.742 N/A LEU 100.A N ILE 144.A O no hydrogen 2.982 N/A PHE 103.A N GLU 99.A O no hydrogen 3.304 N/A LEU 104.A N LEU 100.A O no hydrogen 2.924 N/A ALA 105.A N PHE 101.A O no hydrogen 2.909 N/A GLU 106.A N PHE 103.A O no hydrogen 3.032 N/A LYS 107.A N LEU 104.A O no hydrogen 3.003 N/A GLU 108.A N GLU 108.A OE1 no hydrogen 2.247 N/A SER 109.A N GLU 108.A OE1 no hydrogen 3.352 N/A THR 111.A N GLU 114.A OE1 no hydrogen 2.969 N/A GLU 112.A N SER 288.A O no hydrogen 2.914 N/A GLU 113.A N ARG 285.A O no hydrogen 3.137 N/A GLU 114.A N THR 111.A OG1 no hydrogen 2.931 N/A ALA 115.A N THR 111.A O no hydrogen 2.885 N/A THR 116.A N GLU 112.A O no hydrogen 2.877 N/A THR 116.A OG1 GLU 112.A O no hydrogen 3.336 N/A THR 116.A OG1 GLU 113.A O no hydrogen 2.907 N/A GLU 117.A N GLU 113.A O no hydrogen 3.293 N/A GLU 117.A N GLU 114.A O no hydrogen 3.267 N/A LEU 119.A N ALA 115.A O no hydrogen 2.880 N/A LYS 120.A N THR 116.A O no hydrogen 2.662 N/A GLN 121.A N PHE 118.A O no hydrogen 3.018 N/A GLN 121.A NE2 GLU 117.A O no hydrogen 3.579 N/A GLN 121.A NE2 PRO 154.A O no hydrogen 3.253 N/A ILE 122.A N PHE 118.A O no hydrogen 3.380 N/A LEU 123.A N LEU 119.A O no hydrogen 3.027 N/A ASN 124.A N LYS 120.A O no hydrogen 2.881 N/A GLY 125.A N GLN 121.A O no hydrogen 3.039 N/A VAL 126.A N ILE 122.A O no hydrogen 2.976 N/A TYR 127.A N LEU 123.A O no hydrogen 2.788 N/A TYR 128.A N ASN 124.A O no hydrogen 3.099 N/A LEU 129.A N GLY 125.A O no hydrogen 2.986 N/A HIS 130.A N VAL 126.A O no hydrogen 2.839 N/A HIS 130.A NE2 ASP 198.A OD2 no hydrogen 2.710 N/A SER 131.A N TYR 127.A O no hydrogen 2.956 N/A SER 131.A OG TYR 127.A O no hydrogen 2.843 N/A LEU 132.A N TYR 128.A O no hydrogen 3.227 N/A LEU 132.A N LEU 129.A O no hydrogen 3.068 N/A GLN 133.A N HIS 130.A O no hydrogen 2.923 N/A ILE 134.A N LEU 129.A O no hydrogen 2.970 N/A ALA 135.A N HIS 165.A O no hydrogen 2.874 N/A HIS 136.A N ASP 198.A OD2 no hydrogen 2.840 N/A HIS 136.A NE2 ILE 159.A O no hydrogen 2.902 N/A PHE 137.A N ASP 198.A OD1 no hydrogen 2.845 N/A ASP 138.A N HIS 136.A ND1 no hydrogen 2.945 N/A LYS 140.A NZ GLU 142.A OE2 no hydrogen 3.474 N/A LYS 140.A NZ THR 179.A OG1 no hydrogen 3.115 N/A ASN 143.A N LYS 140.A O no hydrogen 2.883 N/A ASN 143.A ND2 ASP 138.A O no hydrogen 2.852 N/A ASN 143.A ND2 ASP 138.A OD2 no hydrogen 3.427 N/A ASN 143.A ND2 ASP 160.A OD2 no hydrogen 3.157 N/A ILE 144.A N PRO 141.A O no hydrogen 2.943 N/A MET 145.A N LYS 157.A O no hydrogen 3.017 N/A LEU 146.A N GLY 98.A O no hydrogen 2.875 N/A LEU 147.A N ARG 155.A O no hydrogen 2.902 N/A ASN 150.A N ASP 148.A OD1 no hydrogen 2.735 N/A ILE 156.A N GLN 121.A OE1 no hydrogen 2.891 N/A LYS 157.A N MET 145.A O no hydrogen 2.816 N/A LYS 157.A NZ PRO 73.A O no hydrogen 2.799 N/A LYS 157.A NZ GLU 93.A OE1 no hydrogen 3.527 N/A LYS 157.A NZ GLU 93.A OE2 no hydrogen 2.846 N/A ILE 158.A N ASN 74.A O no hydrogen 2.807 N/A ILE 159.A N ASN 143.A O no hydrogen 3.075 N/A GLY 162.A N ASP 160.A OD1 no hydrogen 3.099 N/A HIS 165.A N ALA 135.A O no hydrogen 3.039 N/A LYS 166.A NZ GLU 69.A OE1 no hydrogen 3.147 N/A LYS 166.A NZ GLU 69.A OE2 no hydrogen 3.485 N/A ILE 167.A N GLN 133.A O no hydrogen 2.864 N/A ASN 171.A N ASP 168.A O no hydrogen 3.370 N/A PHE 182.A N THR 179.A O no hydrogen 2.842 N/A VAL 183.A N PRO 180.A O no hydrogen 3.445 N/A GLU 186.A N GLU 186.A OE1 no hydrogen 2.818 N/A VAL 188.A N ALA 184.A O no hydrogen 3.123 N/A ASN 189.A N PRO 185.A O no hydrogen 2.851 N/A TYR 190.A N ILE 187.A O no hydrogen 3.278 N/A GLU 191.A N GLU 186.A O no hydrogen 2.925 N/A LEU 193.A N PHE 173.A O no hydrogen 2.976 N/A GLU 196.A N GLU 196.A OE1 no hydrogen 2.821 N/A TRP 200.A N GLU 196.A O no hydrogen 3.187 N/A SER 201.A N ALA 197.A O no hydrogen 3.166 N/A SER 201.A OG PHE 182.A O no hydrogen 2.666 N/A SER 201.A OG ALA 197.A O no hydrogen 3.334 N/A ILE 202.A N ASP 198.A O no hydrogen 2.964 N/A GLY 203.A N MET 199.A O no hydrogen 3.100 N/A VAL 204.A N TRP 200.A O no hydrogen 3.028 N/A ILE 205.A N SER 201.A O no hydrogen 2.951 N/A THR 206.A N ILE 202.A O no hydrogen 2.919 N/A THR 206.A OG1 ILE 202.A O no hydrogen 2.834 N/A TYR 207.A N GLY 203.A O no hydrogen 2.960 N/A TYR 207.A OH GLU 234.A O no hydrogen 2.603 N/A ILE 208.A N VAL 204.A O no hydrogen 2.988 N/A LEU 209.A N ILE 205.A O no hydrogen 2.878 N/A LEU 210.A N THR 206.A O no hydrogen 2.983 N/A SER 211.A N ILE 208.A O no hydrogen 3.119 N/A SER 211.A OG TYR 207.A O no hydrogen 2.734 N/A GLY 212.A N ILE 208.A O no hydrogen 2.836 N/A ALA 213.A N SER 211.A OG no hydrogen 2.980 N/A GLY 218.A N THR 224.A OG1 no hydrogen 2.751 N/A GLU 223.A N THR 220.A OG1 no hydrogen 3.217 N/A THR 224.A N THR 220.A O no hydrogen 3.034 N/A THR 224.A OG1 THR 220.A O no hydrogen 3.242 N/A LEU 225.A N LYS 221.A O no hydrogen 2.777 N/A ALA 226.A N GLN 222.A O no hydrogen 2.871 N/A ASN 227.A N GLU 223.A O no hydrogen 2.838 N/A VAL 228.A N THR 224.A O no hydrogen 2.932 N/A SER 229.A N LEU 225.A O no hydrogen 3.021 N/A SER 229.A OG ASN 189.A OD1 no hydrogen 2.880 N/A ALA 230.A N ALA 226.A O no hydrogen 3.067 N/A VAL 231.A N VAL 228.A O no hydrogen 2.999 N/A ASN 232.A N ASN 227.A O no hydrogen 2.911 N/A TYR 233.A N VAL 231.A O no hydrogen 3.186 N/A TYR 239.A N GLU 236.A O no hydrogen 2.846 N/A PHE 240.A N GLU 236.A O no hydrogen 2.995 N/A THR 243.A N PHE 240.A O no hydrogen 3.223 N/A SER 244.A N GLU 112.A OE2 no hydrogen 2.829 N/A SER 244.A OG GLU 112.A OE1 no hydrogen 2.679 N/A ALA 247.A N SER 244.A OG no hydrogen 3.036 N/A LYS 248.A N SER 244.A O no hydrogen 3.297 N/A ASP 249.A N ALA 245.A O no hydrogen 2.947 N/A PHE 250.A N LEU 246.A O no hydrogen 2.941 N/A ILE 251.A N ALA 247.A O no hydrogen 3.121 N/A ARG 252.A N LYS 248.A O no hydrogen 2.856 N/A ARG 253.A N ASP 249.A O no hydrogen 3.021 N/A ARG 253.A N PHE 250.A O no hydrogen 3.259 N/A ARG 253.A NE ASP 249.A OD1 no hydrogen 2.885 N/A LEU 254.A N ILE 251.A O no hydrogen 2.999 N/A LEU 255.A N ILE 251.A O no hydrogen 2.887 N/A LYS 257.A NZ SER 229.A O no hydrogen 3.311 N/A LYS 260.A N ASP 258.A OD1 no hydrogen 3.067 N/A LYS 261.A N ASP 258.A O no hydrogen 2.775 N/A ARG 262.A N PRO 259.A O no hydrogen 3.277 N/A ARG 262.A NE VAL 256.A O no hydrogen 2.988 N/A ARG 262.A NH1 GLU 186.A OE1 no hydrogen 3.501 N/A ARG 262.A NH1 GLU 186.A OE2 no hydrogen 2.795 N/A ARG 262.A NH1 GLU 196.A O no hydrogen 2.916 N/A ARG 262.A NH2 GLU 186.A OE1 no hydrogen 2.863 N/A ARG 262.A NH2 VAL 256.A O no hydrogen 3.001 N/A ARG 262.A NH2 LYS 257.A O no hydrogen 3.110 N/A MET 263.A N ARG 253.A O no hydrogen 2.915 N/A ASP 267.A N THR 264.A OG1 no hydrogen 3.334 N/A SER 268.A N THR 264.A O no hydrogen 2.982 N/A SER 268.A OG ILE 265.A O no hydrogen 2.795 N/A LEU 269.A N ILE 265.A O no hydrogen 3.319 N/A GLN 270.A N ASP 267.A O no hydrogen 3.067 N/A HIS 271.A N SER 268.A O no hydrogen 3.322 N/A HIS 271.A NE2 ASP 249.A OD1 no hydrogen 2.847 N/A TRP 273.A N HIS 271.A ND1 no hydrogen 3.001 N/A TRP 273.A NE1 GLU 112.A OE1 no hydrogen 2.912 N/A ILE 274.A N HIS 271.A O no hydrogen 2.855 N/A LYS 275.A N HIS 271.A O no hydrogen 2.918 N/A LYS 277.A N GLN 281.A OE1 no hydrogen 2.761 N/A GLN 281.A N ASP 278.A OD1 no hydrogen 2.900 N/A ALA 282.A N ASP 278.A O no hydrogen 3.132 N/A LEU 283.A N THR 279.A O no hydrogen 2.977 N/A SER 284.A N GLN 280.A O no hydrogen 2.993 N/A SER 284.A OG GLN 281.A O no hydrogen 2.915 N/A ARG 285.A N GLN 281.A O no hydrogen 3.296 N/A ARG 285.A NH1 TRP 273.A O no hydrogen 2.905 N/A ARG 285.A NH1 ILE 274.A O no hydrogen 3.088 N/A LYS 286.A N ALA 282.A O no hydrogen 3.121 N/A ALA 287.A N LEU 283.A O no hydrogen 2.993 N/A SER 288.A N SER 284.A O no hydrogen 3.141 N/A SER 288.A OG SER 284.A O no hydrogen 2.641 N/A ALA 289.A N ASN 242.A O no hydrogen 3.254 N/A VAL 290.A N LEU 110.A O no hydrogen 2.926 N/A ASN 291.A N LEU 210.A O no hydrogen 3.035 N/A ASN 291.A ND2 TYR 239.A O no hydrogen 3.385 N/A LYS 294.A NZ GLU 238.A OE1 no hydrogen 3.397 N/A PHE 295.A N ASN 291.A O no hydrogen 2.908 N/A LYS 296.A N MET 292.A O no hydrogen 2.905 N/A LYS 296.A NZ ALA 105.A O no hydrogen 2.889 N/A LYS 296.A NZ LYS 107.A O no hydrogen 2.721 N/A LYS 297.A NZ GLU 293.A O no hydrogen 3.530 N/A PHE 298.A N LYS 294.A O no hydrogen 3.008 N/A ALA 299.A N PHE 295.A O no hydrogen 3.020 N/A ALA 300.A N LYS 296.A O no hydrogen 3.139 N/A ALA 300.A N LYS 297.A O no hydrogen 3.310 N/A