Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ums_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A N SER 1.A O no hydrogen 2.860 N/A ALA 7.A N GLU 3.A O no hydrogen 3.020 N/A VAL 8.A N ASP 4.A O no hydrogen 2.771 N/A GLU 9.A N LYS 5.A O no hydrogen 2.927 N/A ARG 10.A N ALA 6.A O no hydrogen 2.912 N/A ARG 10.A NH1 LYS 187.A O no hydrogen 2.823 N/A ARG 10.A NH2 LYS 187.A O no hydrogen 3.035 N/A SER 11.A N ALA 7.A O no hydrogen 3.103 N/A SER 11.A OG ALA 7.A O no hydrogen 2.794 N/A LYS 12.A N GLU 9.A O no hydrogen 3.154 N/A LYS 12.A NZ GLU 9.A OE2 no hydrogen 2.978 N/A MET 13.A N ARG 10.A O no hydrogen 3.077 N/A ARG 16.A NH1 GLY 22.A O no hydrogen 2.909 N/A ARG 16.A NH1 ALA 25.A O no hydrogen 2.801 N/A ASN 17.A N ILE 14.A O no hydrogen 3.073 N/A ASN 17.A ND2 ILE 14.A O no hydrogen 3.120 N/A LEU 18.A N ASP 15.A O no hydrogen 3.044 N/A ARG 19.A N ARG 16.A O no hydrogen 2.955 N/A GLY 22.A N ARG 19.A O no hydrogen 2.992 N/A LYS 24.A N ASP 21.A O no hydrogen 2.958 N/A ALA 25.A N GLY 22.A O no hydrogen 3.013 N/A ALA 26.A N PHE 337.A O no hydrogen 2.920 N/A ARG 27.A NH1 ASP 15.A OD1 no hydrogen 2.908 N/A ARG 27.A NH2 ASP 15.A OD2 no hydrogen 2.807 N/A ARG 27.A NH2 CYS 334.A O no hydrogen 2.949 N/A GLU 28.A N GLY 335.A O no hydrogen 2.933 N/A VAL 29.A N HIS 190.A O no hydrogen 2.879 N/A LYS 30.A N THR 202.A OG1 no hydrogen 2.978 N/A LYS 30.A NZ GLU 199.A O no hydrogen 3.233 N/A LEU 31.A N LYS 192.A O no hydrogen 2.874 N/A LEU 32.A N ALA 203.A O no hydrogen 2.969 N/A LEU 33.A N PHE 194.A O no hydrogen 2.633 N/A LEU 34.A N ILE 205.A O no hydrogen 2.947 N/A SER 39.A N ALA 36.A O no hydrogen 3.107 N/A SER 39.A OG ALA 36.A O no hydrogen 2.716 N/A LYS 41.A NZ GLY 35.A O no hydrogen 3.260 N/A LYS 41.A NZ ALA 36.A O no hydrogen 3.118 N/A SER 42.A OG.A THR 176.A OG1 no hydrogen 3.047 N/A ILE 44.A N GLY 40.A O no hydrogen 2.997 N/A VAL 45.A N LYS 41.A O no hydrogen 3.037 N/A LYS 46.A N SER 42.A O.A no hydrogen 3.022 N/A LYS 46.A N SER 42.A O.B no hydrogen 3.045 N/A GLN 47.A N THR 43.A O no hydrogen 2.921 N/A GLN 47.A NE2 ALA 309.A O no hydrogen 2.648 N/A MET 48.A N ILE 44.A O no hydrogen 2.949 N/A LYS 49.A N VAL 45.A O no hydrogen 3.399 N/A LYS 49.A N LYS 46.A O no hydrogen 3.013 N/A ILE 50.A N LYS 46.A O no hydrogen 2.874 N/A ILE 51.A N GLN 47.A O no hydrogen 2.753 N/A HIS 52.A N MET 48.A O no hydrogen 2.878 N/A GLU 53.A N LYS 49.A O no hydrogen 3.157 N/A SER 57.A N GLU 60.A OE1 no hydrogen 2.638 N/A CYS 61.A N SER 57.A O no hydrogen 2.890 N/A CYS 61.A SG TYR 56.A O no hydrogen 3.258 N/A CYS 61.A SG SER 57.A O no hydrogen 3.205 N/A LYS 62.A N GLU 58.A O no hydrogen 2.902 N/A LYS 62.A NZ GLU 59.A OE2 no hydrogen 3.409 N/A GLN 63.A N GLU 60.A O no hydrogen 3.155 N/A GLN 63.A NE2 GLU 59.A O no hydrogen 3.281 N/A TYR 64.A N CYS 61.A O no hydrogen 3.067 N/A LYS 65.A N LYS 62.A O no hydrogen 3.288 N/A VAL 68.A N TYR 64.A O no hydrogen 2.937 N/A TYR 69.A N LYS 65.A O no hydrogen 2.919 N/A SER 70.A N ALA 66.A O no hydrogen 2.719 N/A ASN 71.A N VAL 67.A O no hydrogen 2.783 N/A ASN 71.A ND2 ARG 173.A O no hydrogen 3.540 N/A THR 72.A N VAL 68.A O no hydrogen 2.975 N/A THR 72.A OG1 VAL 68.A O no hydrogen 2.889 N/A ILE 73.A N TYR 69.A O no hydrogen 2.875 N/A GLN 74.A N SER 70.A O no hydrogen 2.847 N/A SER 75.A N ASN 71.A O no hydrogen 2.909 N/A SER 75.A OG ASN 71.A O no hydrogen 2.864 N/A ILE 76.A N THR 72.A O no hydrogen 3.079 N/A ILE 77.A N ILE 73.A O no hydrogen 3.016 N/A ALA 78.A N GLN 74.A O no hydrogen 3.005 N/A ILE 79.A N SER 75.A O no hydrogen 3.278 N/A ILE 80.A N ILE 76.A O no hydrogen 2.992 N/A ARG 81.A N ILE 77.A O no hydrogen 2.853 N/A ALA 82.A N ALA 78.A O no hydrogen 3.027 N/A MET 83.A N ILE 79.A O no hydrogen 3.008 N/A GLY 84.A N ARG 81.A O no hydrogen 3.162 N/A ARG 85.A N ARG 81.A O no hydrogen 3.257 N/A LEU 86.A N ALA 82.A O no hydrogen 2.664 N/A LYS 87.A N GLY 84.A O no hydrogen 3.314 N/A ILE 88.A N MET 83.A O no hydrogen 2.800 N/A GLY 91.A N ASP 128.A OD2 no hydrogen 2.937 N/A ASP 92.A N ASP 128.A OD1 no hydrogen 2.916 N/A ALA 94.A N ASP 92.A OD1 no hydrogen 3.270 N/A ARG 95.A N ASP 92.A O no hydrogen 3.089 N/A ARG 95.A NE ASP 98.A OD2 no hydrogen 2.806 N/A ARG 95.A NH2 ASP 98.A OD2 no hydrogen 2.776 N/A ALA 96.A N SER 93.A O no hydrogen 3.109 N/A ASP 97.A N ALA 94.A O no hydrogen 3.430 N/A ALA 99.A N ARG 95.A O no hydrogen 2.912 N/A ARG 100.A N ALA 96.A O no hydrogen 3.176 N/A GLN 101.A N ASP 97.A O no hydrogen 2.968 N/A LEU 102.A N ASP 98.A O no hydrogen 2.779 N/A PHE 103.A N ALA 99.A O no hydrogen 3.368 N/A VAL 104.A N ARG 100.A O no hydrogen 2.925 N/A LEU 105.A N GLN 101.A O no hydrogen 2.995 N/A ALA 106.A N LEU 102.A O no hydrogen 2.912 N/A GLY 107.A N PHE 103.A O no hydrogen 2.838 N/A ALA 108.A N LEU 105.A O no hydrogen 3.375 N/A ALA 109.A N LEU 105.A O no hydrogen 3.308 N/A LEU 118.A N THR 115.A OG1 no hydrogen 3.041 N/A ALA 119.A N THR 115.A O no hydrogen 2.856 N/A GLY 120.A N ALA 116.A O no hydrogen 2.899 N/A VAL 121.A N GLU 117.A O no hydrogen 2.979 N/A ILE 122.A N LEU 118.A O no hydrogen 2.959 N/A LYS 123.A N ALA 119.A O no hydrogen 2.891 N/A ARG 124.A N GLY 120.A O no hydrogen 3.144 N/A ARG 124.A NE ASP 98.A OD1 no hydrogen 3.442 N/A ARG 124.A NE ASP 98.A OD2 no hydrogen 3.028 N/A ARG 124.A NH2 ASP 98.A OD1 no hydrogen 2.957 N/A LEU 125.A N VAL 121.A O no hydrogen 3.135 N/A TRP 126.A N ILE 122.A O no hydrogen 2.873 N/A TRP 126.A NE1 ASN 152.A OD1 no hydrogen 2.751 N/A LYS 127.A N LYS 123.A O no hydrogen 3.161 N/A ASP 128.A N LEU 125.A O no hydrogen 3.053 N/A GLY 130.A N ASP 128.A OD2 no hydrogen 3.006 N/A VAL 131.A N ASP 128.A OD2 no hydrogen 3.232 N/A GLN 132.A N ASP 128.A O no hydrogen 2.923 N/A GLN 132.A NE2 TRP 126.A O no hydrogen 3.091 N/A ALA 133.A N SER 129.A O no hydrogen 2.915 N/A CYS 134.A N GLY 130.A O no hydrogen 2.942 N/A CYS 134.A SG ILE 79.A O no hydrogen 3.459 N/A CYS 134.A SG TYR 141.A OH no hydrogen 3.620 N/A PHE 135.A N VAL 131.A O no hydrogen 2.806 N/A ASN 136.A N GLN 132.A O no hydrogen 2.977 N/A ARG 137.A N CYS 134.A O no hydrogen 2.881 N/A ARG 137.A NE GLU 140.A OE2 no hydrogen 2.876 N/A ARG 137.A NH2 GLU 140.A OE1 no hydrogen 2.975 N/A SER 138.A N PHE 135.A O no hydrogen 2.948 N/A SER 138.A OG PHE 135.A O no hydrogen 3.254 N/A ARG 139.A NE ASP 214.A O no hydrogen 3.459 N/A GLU 140.A N ARG 137.A O no hydrogen 2.913 N/A TYR 141.A N SER 138.A O no hydrogen 3.040 N/A TYR 141.A OH CYS 134.A O no hydrogen 2.731 N/A GLN 142.A NE2 VAL 216.A O no hydrogen 3.127 N/A ASN 144.A ND2 GLN 74.A OE1 no hydrogen 3.234 N/A SER 146.A OG ARG 171.A O no hydrogen 2.740 N/A ALA 147.A N ASN 144.A O no hydrogen 3.117 N/A TYR 149.A OH ASP 168.A OD1 no hydrogen 2.808 N/A TYR 150.A N SER 146.A O no hydrogen 3.080 N/A TYR 150.A OH ASP 168.A O no hydrogen 2.711 N/A LEU 151.A N ALA 147.A O no hydrogen 2.930 N/A ASN 152.A N ALA 148.A O no hydrogen 2.864 N/A ASP 153.A N TYR 150.A O no hydrogen 2.968 N/A LEU 154.A N LEU 151.A O no hydrogen 3.263 N/A ARG 156.A NH1 ASP 168.A OD1 no hydrogen 3.461 N/A ARG 156.A NH1 ASP 168.A OD2 no hydrogen 2.767 N/A ARG 156.A NH2 ASP 153.A OD2 no hydrogen 2.838 N/A ARG 156.A NH2 ASP 168.A OD1 no hydrogen 2.954 N/A ILE 157.A N ASP 153.A O no hydrogen 3.141 N/A ALA 158.A N LEU 154.A O no hydrogen 2.819 N/A GLN 159.A N ARG 156.A O no hydrogen 3.321 N/A GLN 159.A NE2 ASP 155.A O no hydrogen 3.420 N/A TYR 162.A N GLN 159.A O no hydrogen 2.923 N/A TYR 162.A OH ASP 168.A OD2 no hydrogen 2.627 N/A THR 165.A N ASP 168.A OD2 no hydrogen 3.127 N/A GLN 166.A NE2 TYR 56.A O no hydrogen 3.694 N/A GLN 167.A NE2 THR 310.A O no hydrogen 2.902 N/A ASP 168.A N THR 165.A OG1 no hydrogen 3.100 N/A VAL 169.A N THR 165.A O no hydrogen 2.965 N/A LEU 170.A N GLN 166.A O no hydrogen 2.789 N/A ARG 171.A N GLN 167.A O no hydrogen 2.914 N/A ARG 171.A NE GLN 167.A OE1 no hydrogen 2.823 N/A ARG 171.A NH2 GLN 167.A OE1 no hydrogen 3.501 N/A THR 172.A N VAL 169.A O no hydrogen 2.936 N/A THR 172.A OG1 VAL 169.A O no hydrogen 2.766 N/A ARG 173.A N ASN 71.A OD1 no hydrogen 2.810 N/A THR 176.A OG1 SER 42.A OG.A no hydrogen 3.047 N/A THR 176.A OG1 VAL 174.A O no hydrogen 3.505 N/A VAL 180.A N ASP 195.A O no hydrogen 2.954 N/A THR 182.A N MET 193.A O no hydrogen 2.852 N/A HIS 183.A NE2 GLU 181.A OE2 no hydrogen 2.858 N/A PHE 184.A N PHE 191.A O no hydrogen 3.165 N/A THR 185.A N GLU 53.A OE2 no hydrogen 3.131 N/A PHE 186.A N LEU 189.A O no hydrogen 2.979 N/A LYS 187.A NZ ASP 320.A OD1 no hydrogen 2.642 N/A LYS 187.A NZ ASP 324.A OD1 no hydrogen 2.826 N/A LEU 189.A N PHE 186.A O no hydrogen 2.771 N/A HIS 190.A N ARG 27.A O no hydrogen 2.848 N/A PHE 191.A N PHE 184.A O no hydrogen 2.757 N/A LYS 192.A N VAL 29.A O no hydrogen 2.697 N/A MET 193.A N THR 182.A O no hydrogen 2.788 N/A PHE 194.A N LEU 31.A O no hydrogen 2.814 N/A ASP 195.A N VAL 180.A O no hydrogen 2.856 N/A VAL 196.A N LEU 33.A O no hydrogen 3.346 N/A THR 202.A N LYS 30.A O no hydrogen 2.773 N/A THR 202.A OG1 LYS 30.A O no hydrogen 3.271 N/A ALA 203.A N LYS 30.A O no hydrogen 3.235 N/A ILE 204.A N SER 246.A O no hydrogen 2.838 N/A ILE 205.A N LEU 32.A O no hydrogen 2.830 N/A PHE 206.A N ILE 248.A O no hydrogen 2.695 N/A CYS 207.A N LEU 34.A O no hydrogen 2.831 N/A VAL 208.A N PHE 250.A O no hydrogen 2.901 N/A LEU 210.A N ASN 252.A O no hydrogen 3.003 N/A ASP 212.A N ALA 209.A O no hydrogen 2.930 N/A TYR 213.A N LEU 210.A O no hydrogen 3.374 N/A TYR 213.A OH SER 264.A O no hydrogen 2.638 N/A LEU 215.A N ASP 212.A O no hydrogen 2.838 N/A LEU 217.A N MET 223.A O no hydrogen 3.074 N/A GLU 221.A N GLU 221.A OE1 no hydrogen 2.865 N/A ARG 225.A N LEU 215.A O no hydrogen 3.538 N/A ARG 225.A NH1 GLU 38.A OE1 no hydrogen 3.223 N/A ARG 225.A NH1 ASP 212.A OD2 no hydrogen 3.535 N/A ARG 225.A NH2 GLU 38.A OE1 no hydrogen 3.295 N/A MET 226.A N ASN 224.A OD1 no hydrogen 2.700 N/A HIS 227.A N ASN 224.A OD1 no hydrogen 3.408 N/A GLU 228.A N ASN 224.A O no hydrogen 3.266 N/A SER 229.A N ARG 225.A O no hydrogen 3.250 N/A SER 229.A OG ARG 225.A O no hydrogen 3.506 N/A SER 229.A OG MET 226.A O no hydrogen 3.127 N/A MET 230.A N MET 226.A O no hydrogen 2.993 N/A LYS 231.A N HIS 227.A O no hydrogen 2.862 N/A LEU 232.A N GLU 228.A O no hydrogen 2.974 N/A PHE 233.A N SER 229.A O no hydrogen 2.712 N/A ASP 234.A N MET 230.A O no hydrogen 2.845 N/A SER 235.A N LYS 231.A O no hydrogen 3.415 N/A ILE 236.A N LEU 232.A O no hydrogen 2.870 N/A CYS 237.A N PHE 233.A O no hydrogen 2.676 N/A CYS 237.A SG ASN 294.A OD1 no hydrogen 3.921 N/A ASN 238.A N ASP 234.A O no hydrogen 3.169 N/A ASN 238.A ND2 ASP 234.A O no hydrogen 3.081 N/A ASN 238.A ND2 ASP 234.A OD1 no hydrogen 3.036 N/A ASN 238.A ND2 LEU 293.A O no hydrogen 2.780 N/A ASN 239.A N ILE 236.A O no hydrogen 3.002 N/A TRP 241.A N ASN 239.A OD1 no hydrogen 2.835 N/A PHE 242.A N ASN 239.A O no hydrogen 3.062 N/A THR 245.A N PHE 242.A O no hydrogen 2.917 N/A THR 245.A OG1 VAL 201.A O no hydrogen 2.951 N/A SER 246.A N THR 202.A O no hydrogen 3.252 N/A SER 246.A OG ASN 330.A OD1 no hydrogen 2.369 N/A ILE 248.A N ILE 204.A O no hydrogen 2.775 N/A LEU 249.A N TYR 303.A O no hydrogen 2.799 N/A PHE 250.A N PHE 206.A O no hydrogen 2.753 N/A LEU 251.A N HIS 305.A O no hydrogen 2.772 N/A ASN 252.A N VAL 208.A O no hydrogen 2.689 N/A ASN 252.A ND2 SER 39.A O no hydrogen 3.010 N/A LYS 253.A NZ GLU 38.A O no hydrogen 2.921 N/A LYS 253.A NZ ASP 145.A OD2 no hydrogen 2.454 N/A LYS 254.A N THR 307.A O no hydrogen 3.279 N/A LYS 254.A NZ PHE 306.A O no hydrogen 3.153 N/A PHE 257.A N LYS 253.A O no hydrogen 3.013 N/A GLU 258.A N LYS 254.A O no hydrogen 2.914 N/A GLU 259.A N ASP 255.A O no hydrogen 3.317 N/A GLU 259.A N LEU 256.A O no hydrogen 3.146 N/A LYS 260.A N LEU 256.A O no hydrogen 2.848 N/A LYS 260.A NZ SER 211.A O no hydrogen 2.561 N/A LYS 260.A NZ ASP 214.A OD1 no hydrogen 2.677 N/A ILE 261.A N PHE 257.A O no hydrogen 2.855 N/A LYS 262.A NZ GLU 259.A OE2 no hydrogen 2.844 N/A LYS 263.A N LYS 260.A O no hydrogen 2.962 N/A SER 264.A N LYS 260.A O no hydrogen 3.019 N/A SER 264.A OG ASP 214.A OD2 no hydrogen 2.870 N/A LEU 266.A N ASN 277.A OD1 no hydrogen 2.905 N/A ILE 268.A N PRO 265.A O no hydrogen 2.996 N/A CYS 269.A N LEU 266.A O no hydrogen 2.543 N/A CYS 269.A SG ASN 224.A OD1 no hydrogen 3.892 N/A TYR 270.A N LEU 266.A O no hydrogen 2.971 N/A GLU 272.A N GLU 272.A OE1 no hydrogen 2.702 N/A TYR 273.A N TYR 270.A O no hydrogen 2.811 N/A TYR 273.A OH SER 276.A O no hydrogen 2.572 N/A SER 276.A N GLU 281.A OE2 no hydrogen 2.849 N/A SER 276.A OG GLU 281.A OE1 no hydrogen 3.362 N/A ALA 282.A N THR 278.A O no hydrogen 3.009 N/A ALA 283.A N TYR 279.A O no hydrogen 2.839 N/A ALA 284.A N GLU 280.A O no hydrogen 3.237 N/A TYR 285.A N GLU 281.A O no hydrogen 2.955 N/A TYR 285.A OH GLU 272.A OE2 no hydrogen 2.779 N/A ILE 286.A N ALA 282.A O no hydrogen 3.042 N/A GLN 287.A N ALA 283.A O no hydrogen 2.989 N/A GLN 287.A NE2 GLU 291.A OE2 no hydrogen 2.925 N/A CYS 288.A N ALA 284.A O no hydrogen 2.886 N/A CYS 288.A SG ALA 284.A O no hydrogen 3.583 N/A GLN 289.A N TYR 285.A O no hydrogen 2.859 N/A PHE 290.A N ILE 286.A O no hydrogen 3.043 N/A GLU 291.A N GLN 287.A O no hydrogen 2.912 N/A ASP 292.A N CYS 288.A O no hydrogen 2.954 N/A LEU 293.A N PHE 290.A O no hydrogen 2.913 N/A ASN 294.A N GLU 291.A O no hydrogen 3.071 N/A ASN 294.A ND2 LYS 300.A O no hydrogen 2.628 N/A LYS 295.A N ASN 238.A OD1 no hydrogen 2.583 N/A ARG 296.A N ASN 294.A OD1 no hydrogen 3.315 N/A LYS 297.A NZ ASP 292.A O no hydrogen 3.178 N/A LYS 297.A NZ ASP 292.A OD1 no hydrogen 3.315 N/A LYS 297.A NZ ASN 294.A O no hydrogen 3.088 N/A THR 299.A N ARG 296.A O no hydrogen 3.367 N/A LYS 300.A N LYS 297.A O no hydrogen 3.094 N/A LYS 300.A NZ PHE 242.A O no hydrogen 2.748 N/A LYS 300.A NZ THR 243.A O no hydrogen 2.963 N/A LYS 300.A NZ THR 245.A O no hydrogen 2.637 N/A TYR 303.A N ILE 247.A O no hydrogen 2.985 N/A THR 304.A OG1 GLU 291.A OE2 no hydrogen 2.620 N/A HIS 305.A N LEU 249.A O no hydrogen 2.784 N/A THR 307.A N LEU 251.A O no hydrogen 3.087 N/A THR 307.A OG1 ASN 252.A OD1 no hydrogen 2.781 N/A CYS 308.A N ASN 314.A OD1 no hydrogen 2.766 N/A CYS 308.A SG THR 310.A OG1 no hydrogen 3.537 N/A ASP 311.A N CYS 308.A O no hydrogen 2.869 N/A THR 312.A OG1 GLN 47.A OE1 no hydrogen 2.905 N/A ASN 314.A N ASP 311.A OD1 no hydrogen 3.049 N/A VAL 315.A N ASP 311.A O no hydrogen 3.039 N/A GLN 316.A N THR 312.A O no hydrogen 2.985 N/A PHE 317.A N LYS 313.A O no hydrogen 3.012 N/A VAL 318.A N ASN 314.A O no hydrogen 2.851 N/A PHE 319.A N VAL 315.A O no hydrogen 2.663 N/A ASP 320.A N GLN 316.A O no hydrogen 2.955 N/A ALA 321.A N PHE 317.A O no hydrogen 3.181 N/A VAL 322.A N VAL 318.A O no hydrogen 2.806 N/A THR 323.A N PHE 319.A O no hydrogen 2.891 N/A THR 323.A OG1 PHE 319.A O no hydrogen 3.007 N/A ASP 324.A N ASP 320.A O no hydrogen 3.199 N/A VAL 325.A N ALA 321.A O no hydrogen 3.298 N/A ILE 326.A N VAL 322.A O no hydrogen 3.198 N/A ILE 327.A N THR 323.A O no hydrogen 2.921 N/A LYS 328.A N ASP 324.A O no hydrogen 2.866 N/A LYS 328.A NZ ALA 2.A O no hydrogen 2.629 N/A ASN 329.A N VAL 325.A O no hydrogen 2.909 N/A ASN 329.A N ILE 326.A O no hydrogen 3.276 N/A ASN 330.A N ILE 326.A O no hydrogen 2.815 N/A ASP 333.A N ASN 330.A O no hydrogen 2.953 N/A CYS 334.A N LEU 331.A O no hydrogen 3.082 N/A CYS 334.A SG ASN 330.A O no hydrogen 3.422 N/A PHE 337.A N ALA 26.A O no hydrogen 2.834 N/A