Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5duj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A N ALA 28.A O no hydrogen 2.849 N/A THR 7.A N THR 26.A O no hydrogen 2.922 N/A SER 9.A N SER 24.A O no hydrogen 2.928 N/A SER 9.A OG SER 24.A O no hydrogen 3.427 N/A SER 9.A OG SER 24.A OG no hydrogen 3.406 N/A GLY 13.A N THR 86.A O no hydrogen 2.831 N/A ALA 14.A N THR 11.A O no hydrogen 3.006 N/A VAL 17.A N GLN 88.A O no hydrogen 3.131 N/A THR 18.A OG1 ASP 20.A OD1 no hydrogen 2.660 N/A VAL 23.A N THR 58.A OG1 no hydrogen 2.916 N/A SER 24.A N SER 9.A OG no hydrogen 2.818 N/A SER 24.A OG SER 9.A OG no hydrogen 3.406 N/A VAL 25.A N TRP 56.A O no hydrogen 3.039 N/A THR 26.A N THR 7.A O no hydrogen 2.857 N/A ALA 27.A N LEU 54.A O no hydrogen 2.891 N/A ALA 28.A N LYS 5.A O no hydrogen 2.941 N/A VAL 31.A N LEU 75.A O no hydrogen 2.858 N/A LEU 32.A N GLY 53.A O no hydrogen 2.792 N/A ALA 33.A N THR 73.A O no hydrogen 2.835 N/A ALA 34.A N THR 73.A O no hydrogen 3.430 N/A THR 36.A N ASN 71.A O no hydrogen 2.931 N/A VAL 38.A N THR 69.A O no hydrogen 3.043 N/A ASN 39.A N ARG 43.A O no hydrogen 3.099 N/A ASN 41.A N ASN 39.A OD1 no hydrogen 3.512 N/A GLY 42.A N ASN 39.A O no hydrogen 2.924 N/A ARG 43.A N ASN 39.A OD1 no hydrogen 3.145 N/A VAL 45.A N MET 37.A O no hydrogen 2.700 N/A ARG 48.A N.A SER 57.A O no hydrogen 2.935 N/A ARG 48.A N.B SER 57.A O no hydrogen 2.886 N/A SER 50.A N ARG 55.A O no hydrogen 2.736 N/A SER 50.A OG ASP 52.A OD1 no hydrogen 2.588 N/A SER 50.A OG ARG 55.A O no hydrogen 3.237 N/A GLY 53.A N SER 50.A O no hydrogen 2.980 N/A LEU 54.A N ASP 52.A OD1 no hydrogen 3.001 N/A ARG 55.A N SER 50.A OG no hydrogen 2.959 N/A ARG 55.A NH1 ASP 52.A OD2 no hydrogen 2.825 N/A ARG 55.A NH2 ASP 52.A OD2 no hydrogen 3.277 N/A TRP 56.A N VAL 25.A O no hydrogen 2.958 N/A SER 57.A N ARG 48.A O.A no hydrogen 3.056 N/A SER 57.A N ARG 48.A O.B no hydrogen 2.979 N/A SER 57.A OG THR 58.A O no hydrogen 3.347 N/A THR 58.A N VAL 23.A O no hydrogen 3.003 N/A THR 58.A OG1 VAL 23.A O no hydrogen 3.533 N/A THR 59.A N ALA 46.A O no hydrogen 3.167 N/A GLY 63.A N TYR 68.A OH no hydrogen 2.670 N/A TYR 64.A OH GLY 183.A O no hydrogen 2.589 N/A ASN 65.A N SER 90.A O no hydrogen 2.962 N/A ARG 66.A N THR 89.A OG1 no hydrogen 2.985 N/A ARG 66.A NH1 ASP 40.A OD1 no hydrogen 3.364 N/A ARG 67.A N ASP 40.A OD1 no hydrogen 3.258 N/A TYR 68.A N PHE 87.A O no hydrogen 3.014 N/A THR 69.A N VAL 38.A O no hydrogen 2.749 N/A LEU 70.A N LEU 85.A O no hydrogen 2.825 N/A ASN 71.A N THR 36.A O no hydrogen 2.914 N/A ALA 72.A N ARG 83.A O no hydrogen 3.037 N/A THR 73.A N ALA 34.A O no hydrogen 2.773 N/A ALA 74.A N ALA 81.A O no hydrogen 2.859 N/A LEU 75.A N VAL 31.A O no hydrogen 2.823 N/A GLY 76.A N GLY 79.A O no hydrogen 2.865 N/A GLY 79.A N GLY 76.A O no hydrogen 3.203 N/A ALA 81.A N ALA 74.A O no hydrogen 2.945 N/A ARG 83.A N ALA 72.A O no hydrogen 2.990 N/A ARG 83.A NH1 THR 82.A O no hydrogen 2.765 N/A LEU 85.A N LEU 70.A O no hydrogen 2.860 N/A THR 86.A N ASP 12.A OD1 no hydrogen 2.708 N/A PHE 87.A N TYR 68.A O no hydrogen 3.141 N/A GLN 88.A N ALA 14.A O no hydrogen 2.891 N/A THR 89.A N ARG 66.A O no hydrogen 3.021 N/A THR 89.A OG1 GLY 63.A O no hydrogen 2.741 N/A THR 89.A OG1 ARG 66.A O no hydrogen 3.366 N/A SER 90.A N VAL 17.A O no hydrogen 2.943 N/A SER 90.A OG VAL 17.A O no hydrogen 3.321 N/A HIS 94.A N GLY 180.A O no hydrogen 3.225 N/A THR 96.A N PHE 182.A O no hydrogen 2.996 N/A THR 96.A OG1 ASP 119.A OD1 no hydrogen 2.852 N/A MET 97.A N ASP 119.A OD1 no hydrogen 3.018 N/A TYR 99.A N ARG 117.A O no hydrogen 2.736 N/A MET 101.A N ALA 115.A O no hydrogen 3.031 N/A GLY 105.A N HIS 190.A O no hydrogen 2.812 N/A GLU 106.A N GLY 103.A O no hydrogen 3.134 N/A VAL 108.A N THR 192.A O no hydrogen 2.873 N/A GLY 109.A N ARG 315.A O no hydrogen 2.845 N/A GLY 111.A N GLY 316.A O no hydrogen 2.773 N/A GLU 112.A N GLY 109.A O no hydrogen 3.217 N/A VAL 114.A N TRP 154.A O no hydrogen 2.899 N/A ALA 115.A N MET 101.A O no hydrogen 3.017 N/A ILE 116.A N VAL 152.A O no hydrogen 2.897 N/A ARG 117.A N TYR 99.A O no hydrogen 2.776 N/A PHE 118.A N ARG 150.A O no hydrogen 2.876 N/A ASP 119.A N MET 97.A O no hydrogen 3.158 N/A ILE 122.A N ASN 149.A O no hydrogen 3.089 N/A ASP 124.A N LEU 177.A O no hydrogen 3.016 N/A ARG 125.A NH1 ASN 349.A O no hydrogen 2.865 N/A ARG 125.A NH2 ASN 149.A OD1 no hydrogen 2.765 N/A ALA 127.A N ASP 124.A OD1 no hydrogen 3.127 N/A ALA 128.A N ASP 124.A O no hydrogen 3.214 N/A GLU 129.A N ARG 125.A O no hydrogen 2.963 N/A LYS 130.A N GLY 126.A O no hydrogen 2.962 N/A ALA 131.A N ALA 127.A O no hydrogen 3.115 N/A ALA 131.A N ALA 128.A O no hydrogen 3.102 N/A ILE 132.A N GLU 129.A O no hydrogen 3.127 N/A LYS 133.A N ALA 169.A O no hydrogen 2.844 N/A THR 135.A N ASP 167.A O no hydrogen 2.941 N/A THR 136.A OG1 VAL 140.A O no hydrogen 3.549 N/A ASN 137.A N ALA 165.A O no hydrogen 3.028 N/A VAL 140.A N THR 136.A OG1 no hydrogen 2.941 N/A ALA 143.A N ARG 155.A O no hydrogen 3.175 N/A TYR 145.A N ARG 153.A O no hydrogen 2.766 N/A TRP 146.A N ASN 349.A OD1 no hydrogen 2.925 N/A TRP 146.A NE1 GLU 129.A OE2 no hydrogen 2.757 N/A LEU 147.A N GLU 151.A O no hydrogen 2.984 N/A ARG 150.A N ASN 148.A OD1 no hydrogen 2.842 N/A ARG 150.A NE ASN 121.A OD1 no hydrogen 2.631 N/A ARG 150.A NH2 ASN 121.A OD1 no hydrogen 3.357 N/A GLU 151.A N ASN 148.A OD1 no hydrogen 2.838 N/A VAL 152.A N ILE 116.A O no hydrogen 2.946 N/A ARG 153.A N TYR 145.A O no hydrogen 2.865 N/A ARG 153.A NH1 GLU 151.A OE2 no hydrogen 2.905 N/A ARG 153.A NH1 GLY 334.A O no hydrogen 2.984 N/A ARG 153.A NH2 GLY 334.A O no hydrogen 2.591 N/A ARG 153.A NH2 ASP 337.A OD2 no hydrogen 3.001 N/A TRP 154.A N VAL 114.A O no hydrogen 2.827 N/A ARG 155.A N ALA 143.A O no hydrogen 3.250 N/A ARG 155.A NH1 PRO 156.A O no hydrogen 2.852 N/A ARG 155.A NH2 ASP 337.A O no hydrogen 2.953 N/A ARG 155.A NH2 ILE 340.A O no hydrogen 3.095 N/A TRP 160.A N VAL 110.A O no hydrogen 2.896 N/A TRP 160.A NE1 GLU 112.A O no hydrogen 2.723 N/A GLY 163.A N ILE 193.A O no hydrogen 2.958 N/A THR 164.A N LYS 161.A O no hydrogen 3.226 N/A THR 164.A OG1 LYS 161.A O no hydrogen 2.599 N/A ALA 165.A N ASN 137.A O no hydrogen 2.807 N/A VAL 166.A N PHE 191.A O no hydrogen 2.919 N/A ASP 167.A N THR 135.A O no hydrogen 2.858 N/A VAL 168.A N THR 189.A O no hydrogen 2.900 N/A ALA 169.A N LYS 133.A O no hydrogen 2.884 N/A VAL 170.A N VAL 187.A O no hydrogen 2.765 N/A ASN 171.A N ALA 131.A O no hydrogen 2.861 N/A THR 172.A OG1 ASP 185.A O no hydrogen 2.852 N/A TYR 173.A N ASN 186.A OD1 no hydrogen 2.797 N/A TYR 173.A OH LEU 62.A O no hydrogen 2.650 N/A GLY 174.A N TYR 64.A OH no hydrogen 2.865 N/A VAL 175.A N THR 172.A O no hydrogen 3.100 N/A LEU 177.A N MET 181.A O no hydrogen 2.670 N/A GLY 178.A N ASP 176.A OD1 no hydrogen 2.975 N/A MET 181.A N GLY 178.A O no hydrogen 2.971 N/A PHE 182.A N HIS 94.A O no hydrogen 3.059 N/A GLY 183.A N VAL 175.A O no hydrogen 3.228 N/A GLU 184.A N THR 96.A O no hydrogen 2.846 N/A ASN 186.A N ASP 185.A OD1 no hydrogen 2.881 N/A VAL 187.A N VAL 170.A O no hydrogen 3.029 N/A THR 189.A N VAL 168.A O no hydrogen 3.023 N/A THR 189.A OG1 PRO 102.A O no hydrogen 3.146 N/A HIS 190.A N ASP 104.A OD1 no hydrogen 2.874 N/A HIS 190.A ND1 ASP 167.A OD1 no hydrogen 2.699 N/A PHE 191.A N VAL 166.A O no hydrogen 2.782 N/A THR 192.A N GLU 106.A O no hydrogen 3.046 N/A ILE 193.A N THR 164.A O no hydrogen 3.019 N/A GLY 194.A N VAL 108.A O no hydrogen 2.862 N/A GLU 196.A N ASN 213.A OD1 no hydrogen 3.093 N/A ILE 198.A N ARG 211.A O no hydrogen 3.001 N/A ALA 199.A N ILE 318.A O no hydrogen 2.827 N/A THR 200.A N THR 209.A O no hydrogen 2.764 N/A ALA 201.A N GLU 320.A O no hydrogen 2.793 N/A ASP 202.A N ILE 207.A O no hydrogen 3.153 N/A ASP 203.A N VAL 322.A O no hydrogen 2.976 N/A ASN 204.A N ASP 202.A OD1 no hydrogen 2.912 N/A THR 205.A N ASP 202.A O no hydrogen 3.147 N/A THR 205.A OG1 ASP 202.A O no hydrogen 3.340 N/A LYS 206.A NZ ASP 203.A O no hydrogen 2.949 N/A LYS 206.A NZ ASP 203.A OD1 no hydrogen 3.306 N/A LEU 208.A N MET 220.A O no hydrogen 2.799 N/A THR 209.A N THR 200.A O no hydrogen 2.976 N/A VAL 210.A N LYS 218.A O no hydrogen 2.794 N/A ARG 211.A N ILE 198.A O no hydrogen 2.919 N/A VAL 212.A N GLU 215.A O no hydrogen 2.855 N/A ASN 213.A N GLU 196.A O no hydrogen 2.804 N/A ASN 213.A ND2 ASP 195.A OD1 no hydrogen 3.189 N/A GLU 215.A N VAL 212.A O no hydrogen 3.068 N/A VAL 217.A N VAL 210.A O no hydrogen 2.871 N/A LYS 218.A NZ ASN 305.A OD1 no hydrogen 2.896 N/A MET 220.A N LEU 208.A O no hydrogen 2.888 N/A THR 222.A N LYS 206.A O no hydrogen 2.734 N/A THR 222.A OG1 ASN 300.A O no hydrogen 2.603 N/A SER 223.A N ASN 300.A O no hydrogen 2.865 N/A SER 223.A OG THR 292.A O no hydrogen 2.818 N/A SER 223.A OG THR 294.A OG1 no hydrogen 2.718 N/A MET 224.A N ASN 293.A OD1 no hydrogen 2.942 N/A GLY 225.A N THR 231.A OG1 no hydrogen 3.050 N/A LYS 226.A N SER 295.A O no hydrogen 3.016 N/A LYS 226.A NZ THR 229.A OG1 no hydrogen 3.156 N/A THR 229.A N LYS 226.A O no hydrogen 2.760 N/A THR 229.A OG1 THR 229.A O no hydrogen 2.636 N/A THR 229.A OG1 SER 295.A O no hydrogen 2.964 N/A THR 231.A OG1 GLY 297.A O no hydrogen 2.493 N/A ASN 233.A N GLY 327.A O no hydrogen 2.895 N/A ASN 233.A ND2 THR 324.A O no hydrogen 3.350 N/A ASN 233.A ND2 GLY 326.A O no hydrogen 3.209 N/A ASN 233.A ND2 GLY 327.A O no hydrogen 3.283 N/A GLY 234.A N VAL 321.A O no hydrogen 2.831 N/A ILE 235.A N ASN 339.A OD1 no hydrogen 2.961 N/A TYR 236.A N VAL 319.A O no hydrogen 2.714 N/A TYR 236.A OH ALA 232.A O no hydrogen 2.580 N/A ILE 237.A N LEU 335.A O no hydrogen 2.890 N/A VAL 238.A N ASP 317.A O no hydrogen 2.858 N/A GLY 239.A N GLN 271.A O no hydrogen 2.850 N/A ARG 241.A NE VAL 313.A O no hydrogen 3.366 N/A ARG 241.A NH1 GLY 239.A O no hydrogen 2.962 N/A ARG 241.A NH2 GLY 239.A O no hydrogen 3.435 N/A ARG 241.A NH2 VAL 313.A O no hydrogen 3.265 N/A TYR 242.A N ALA 269.A O no hydrogen 2.714 N/A ILE 245.A N VAL 266.A O no hydrogen 2.984 N/A MET 247.A N THR 264.A O no hydrogen 2.782 N/A SER 249.A N TYR 262.A O no hydrogen 2.865 N/A SER 249.A OG VAL 254.A O no hydrogen 2.515 N/A SER 249.A OG TYR 262.A O no hydrogen 3.258 N/A SER 250.A N ASP 248.A OD1 no hydrogen 3.062 N/A SER 250.A OG ASP 248.A OD1 no hydrogen 2.642 N/A THR 251.A N ASP 248.A O no hydrogen 2.960 N/A THR 251.A OG1 ASP 248.A O no hydrogen 3.147 N/A TYR 252.A N SER 249.A O no hydrogen 2.777 N/A VAL 254.A N SER 249.A O no hydrogen 3.148 N/A SER 258.A N PRO 255.A O no hydrogen 2.992 N/A SER 258.A OG PRO 255.A O no hydrogen 2.797 N/A GLY 261.A N SER 258.A O no hydrogen 3.317 N/A TYR 262.A N SER 249.A OG no hydrogen 3.109 N/A THR 264.A N MET 247.A O no hydrogen 3.046 N/A VAL 266.A N ILE 245.A O no hydrogen 3.109 N/A TRP 268.A N LYS 243.A O no hydrogen 2.963 N/A ALA 269.A N TYR 242.A O no hydrogen 2.772 N/A THR 270.A N VAL 279.A O no hydrogen 2.820 N/A GLN 271.A N SER 240.A O no hydrogen 2.788 N/A GLN 271.A NE2 SER 273.A O no hydrogen 2.877 N/A ILE 272.A N VAL 277.A O no hydrogen 2.866 N/A SER 273.A N VAL 277.A O no hydrogen 3.212 N/A SER 273.A OG SER 275.A OG no hydrogen 2.571 N/A TYR 274.A N ASP 333.A OD2 no hydrogen 2.925 N/A SER 275.A N ASP 333.A OD1 no hydrogen 2.873 N/A SER 275.A OG SER 273.A OG no hydrogen 2.571 N/A GLY 276.A N SER 273.A O no hydrogen 3.190 N/A VAL 277.A N SER 273.A OG no hydrogen 2.920 N/A VAL 279.A N THR 270.A O no hydrogen 2.852 N/A HIS 280.A N LEU 299.A O no hydrogen 3.171 N/A HIS 280.A ND1 SER 281.A O no hydrogen 2.777 N/A SER 281.A N ASP 267.A O no hydrogen 3.095 N/A ALA 282.A N VAL 301.A O no hydrogen 2.923 N/A SER 285.A N ALA 282.A O no hydrogen 3.143 N/A SER 285.A OG ALA 282.A O no hydrogen 3.456 N/A VAL 286.A N PRO 283.A O no hydrogen 3.222 N/A GLN 289.A N SER 285.A O no hydrogen 2.977 N/A GLN 289.A NE2 ALA 282.A O no hydrogen 3.034 N/A GLN 289.A NE2 SER 285.A OG no hydrogen 2.934 N/A GLY 290.A N THR 222.A O no hydrogen 3.262 N/A HIS 291.A N ALA 288.A O no hydrogen 2.834 N/A HIS 291.A ND1 GLY 287.A O no hydrogen 3.237 N/A THR 292.A N ALA 288.A O no hydrogen 2.848 N/A ASN 293.A ND2 ASP 203.A OD1 no hydrogen 2.822 N/A THR 294.A N SER 223.A OG no hydrogen 2.818 N/A THR 294.A OG1 SER 223.A OG no hydrogen 2.718 N/A SER 295.A N MET 224.A O no hydrogen 2.953 N/A SER 295.A OG CYS 298.A O no hydrogen 2.669 N/A GLY 297.A N SER 295.A OG no hydrogen 2.713 N/A CYS 298.A SG GLY 276.A O no hydrogen 3.884 N/A LEU 299.A N PHE 278.A O no hydrogen 2.980 N/A ASN 300.A N SER 223.A O no hydrogen 2.963 N/A ASN 300.A ND2 SER 285.A OG no hydrogen 2.901 N/A VAL 301.A N HIS 280.A O no hydrogen 3.117 N/A SER 302.A OG SER 304.A OG no hydrogen 3.147 N/A SER 304.A OG SER 302.A OG no hydrogen 3.147 N/A ASN 305.A N SER 302.A OG no hydrogen 2.899 N/A ALA 306.A N SER 302.A O no hydrogen 2.871 N/A GLN 307.A N PRO 303.A O no hydrogen 3.087 N/A TRP 308.A N SER 304.A O no hydrogen 2.711 N/A PHE 309.A N ASN 305.A O no hydrogen 2.938 N/A TYR 310.A N ALA 306.A O no hydrogen 2.906 N/A ASP 311.A N GLN 307.A O no hydrogen 2.995 N/A HIS 312.A N TRP 308.A O no hydrogen 2.876 N/A HIS 312.A ND1 TRP 308.A O no hydrogen 3.127 N/A VAL 313.A N PHE 309.A O no hydrogen 2.999 N/A LYS 314.A N ASP 317.A OD2 no hydrogen 2.797 N/A ARG 315.A NH2 SER 240.A OG no hydrogen 3.022 N/A GLY 316.A N VAL 238.A O no hydrogen 2.822 N/A ASP 317.A N LYS 314.A O no hydrogen 2.980 N/A ILE 318.A N VAL 197.A O no hydrogen 3.029 N/A VAL 319.A N TYR 236.A O no hydrogen 3.044 N/A GLU 320.A N ALA 199.A O no hydrogen 2.781 N/A VAL 321.A N GLY 234.A O no hydrogen 2.885 N/A VAL 322.A N ALA 201.A O no hydrogen 2.934 N/A ASN 323.A ND2 ASP 202.A OD1 no hydrogen 3.021 N/A THR 324.A N ASN 233.A OD1 no hydrogen 2.845 N/A THR 324.A OG1 THR 231.A O no hydrogen 2.653 N/A GLY 326.A N THR 324.A OG1 no hydrogen 3.072 N/A LEU 329.A N ASN 233.A O no hydrogen 2.878 N/A ASP 333.A N PRO 330.A O no hydrogen 3.163 N/A LEU 335.A N ASP 333.A OD2 no hydrogen 2.739 N/A TRP 338.A NE1 GLY 111.A O no hydrogen 2.720 N/A ASN 339.A N GLY 336.A O no hydrogen 2.844 N/A ASN 339.A ND2 ILE 235.A O no hydrogen 2.839 N/A ASN 339.A ND2 GLY 336.A O no hydrogen 2.808 N/A ILE 340.A N ASP 337.A O no hydrogen 3.353 N/A TRP 345.A N PRO 341.A O no hydrogen 2.897 N/A TRP 345.A NE1 ALA 143.A O no hydrogen 2.822 N/A ARG 346.A N TRP 342.A O no hydrogen 2.743 N/A ARG 346.A NH1 GLU 141.A OE1 no hydrogen 2.910 N/A ALA 347.A N ASP 343.A O no hydrogen 3.212 N/A GLY 348.A N GLN 344.A O no hydrogen 3.152 N/A ASN 349.A ND2 TRP 146.A O no hydrogen 2.994 N/A