Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4fju_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N ILE 323.A O no hydrogen 3.161 N/A LYS 2.A NZ GLU 322.A OE2 no hydrogen 3.324 N/A ILE 3.A N ILE 321.A O no hydrogen 2.674 N/A THR 7.A OG1 SER 4.A O no hydrogen 3.343 N/A LEU 8.A N SER 4.A O no hydrogen 3.455 N/A HIS 9.A N ARG 5.A O no hydrogen 3.030 N/A HIS 9.A NE2 ALA 27.A O no hydrogen 3.073 N/A GLN 10.A N GLU 6.A O no hydrogen 3.058 N/A LEU 11.A N THR 7.A O no hydrogen 2.925 N/A ILE 12.A N LEU 8.A O no hydrogen 2.922 N/A GLU 13.A N HIS 9.A O no hydrogen 2.817 N/A ASN 14.A N GLN 10.A O no hydrogen 2.924 N/A LYS 15.A N LEU 11.A O no hydrogen 3.073 N/A LYS 15.A NZ GLN 18.A OE1 no hydrogen 3.438 N/A LYS 15.A NZ TYR 330.A O no hydrogen 3.531 N/A LYS 15.A NZ SER 333.A O no hydrogen 2.437 N/A LYS 15.A NZ ALA 335.A O no hydrogen 2.854 N/A LEU 16.A N ILE 12.A O no hydrogen 3.036 N/A CYS 17.A N GLU 13.A O no hydrogen 2.991 N/A CYS 17.A SG LEU 21.A O no hydrogen 3.467 N/A GLN 18.A N ASN 14.A O no hydrogen 2.958 N/A ALA 19.A N LYS 15.A O no hydrogen 3.292 N/A GLY 20.A N LEU 16.A O no hydrogen 3.224 N/A GLY 20.A N CYS 17.A O no hydrogen 3.040 N/A LEU 21.A N LEU 16.A O no hydrogen 3.052 N/A LYS 22.A NZ GLU 64.A OE1 no hydrogen 3.265 N/A ARG 23.A NE GLU 13.A OE1 no hydrogen 2.841 N/A ALA 26.A N LYS 22.A O no hydrogen 2.798 N/A ALA 27.A N ARG 23.A O no hydrogen 2.920 N/A THR 28.A N GLU 24.A O no hydrogen 3.316 N/A THR 28.A OG1 GLU 24.A O no hydrogen 3.315 N/A VAL 29.A N HIS 25.A O no hydrogen 2.920 N/A ALA 30.A N ALA 26.A O no hydrogen 2.986 N/A GLU 31.A N ALA 27.A O no hydrogen 3.002 N/A VAL 32.A N THR 28.A O no hydrogen 3.322 N/A LEU 33.A N VAL 29.A O no hydrogen 3.160 N/A VAL 34.A N ALA 30.A O no hydrogen 2.913 N/A TYR 35.A N GLU 31.A O no hydrogen 2.979 N/A TYR 35.A OH SER 121.A OG no hydrogen 2.599 N/A ALA 36.A N VAL 32.A O no hydrogen 3.142 N/A ASP 37.A N LEU 33.A O no hydrogen 3.035 N/A ALA 38.A N VAL 34.A O no hydrogen 2.834 N/A ARG 39.A N TYR 35.A O no hydrogen 3.170 N/A ARG 39.A NE GLN 309.A OE1 no hydrogen 3.010 N/A ARG 39.A NH1 ASP 310.A OD2 no hydrogen 2.891 N/A ARG 39.A NH1 GLN 313.A OE1 no hydrogen 3.063 N/A ARG 39.A NH2 ASP 310.A OD2 no hydrogen 2.786 N/A GLY 40.A N ASP 37.A O no hydrogen 2.971 N/A ILE 41.A N ALA 36.A O no hydrogen 2.825 N/A HIS 42.A ND1 ASP 37.A OD1 no hydrogen 2.549 N/A SER 43.A OG HIS 44.A ND1 no hydrogen 3.351 N/A HIS 44.A N ILE 41.A O no hydrogen 3.122 N/A GLY 45.A N HIS 42.A O no hydrogen 2.888 N/A ALA 46.A N ASP 37.A OD2 no hydrogen 2.686 N/A ARG 48.A N GLY 45.A O no hydrogen 3.141 N/A ARG 48.A NE SER 43.A O no hydrogen 2.726 N/A VAL 49.A N ALA 46.A O no hydrogen 2.968 N/A TYR 51.A OH MET 251.A O no hydrogen 3.417 N/A TYR 52.A N ARG 48.A O no hydrogen 2.922 N/A TYR 52.A OH HIS 116.A ND1 no hydrogen 2.706 N/A ALA 53.A N VAL 49.A O no hydrogen 2.704 N/A GLU 54.A N GLU 50.A O no hydrogen 3.167 N/A ARG 55.A N TYR 51.A O no hydrogen 3.073 N/A ARG 55.A NE TYR 51.A OH no hydrogen 2.937 N/A ARG 55.A NH1 GLY 60.A O no hydrogen 3.426 N/A ARG 55.A NH1 ASP 254.A O no hydrogen 3.287 N/A ARG 55.A NH1 ALA 257.A O no hydrogen 2.624 N/A ARG 55.A NH2 MET 251.A O no hydrogen 2.775 N/A ARG 55.A NH2 ASP 254.A O no hydrogen 3.390 N/A ILE 56.A N TYR 52.A O no hydrogen 2.811 N/A SER 57.A N ALA 53.A O no hydrogen 2.857 N/A LYS 58.A N GLU 54.A O no hydrogen 2.895 N/A LYS 58.A NZ GLU 54.A OE2 no hydrogen 2.861 N/A GLY 59.A N ILE 56.A O no hydrogen 3.218 N/A GLY 60.A N ARG 55.A O no hydrogen 2.731 N/A ASN 62.A N ASN 83.A O no hydrogen 2.862 N/A ASN 62.A ND2 ASP 82.A O no hydrogen 2.804 N/A ARG 63.A NH2 ILE 56.A O no hydrogen 2.859 N/A GLU 64.A N ASN 62.A OD1 no hydrogen 3.018 N/A GLU 66.A N ASP 82.A OD1 no hydrogen 3.009 N/A ARG 68.A N HIS 80.A O no hydrogen 3.011 N/A GLU 70.A N ILE 78.A O no hydrogen 2.765 N/A THR 72.A N SER 76.A O no hydrogen 3.066 N/A THR 72.A OG1 SER 76.A OG no hydrogen 2.710 N/A CYS 75.A SG ASN 104.A O no hydrogen 3.657 N/A CYS 75.A SG VAL 106.A O no hydrogen 3.367 N/A SER 76.A N GLY 73.A O no hydrogen 3.508 N/A SER 76.A OG THR 72.A OG1 no hydrogen 2.710 N/A ALA 77.A N VAL 108.A O no hydrogen 3.242 N/A ILE 78.A N GLU 70.A O no hydrogen 2.959 N/A LEU 79.A N GLY 110.A O no hydrogen 2.829 N/A HIS 80.A N ARG 68.A O no hydrogen 2.780 N/A HIS 80.A NE2 GLU 70.A OE1 no hydrogen 3.006 N/A ALA 81.A N SER 112.A O no hydrogen 2.901 N/A ASN 83.A N ARG 113.A O no hydrogen 2.733 N/A ASN 83.A ND2 ASN 260.A OD1 no hydrogen 2.900 N/A ALA 84.A N ALA 81.A O no hydrogen 2.853 N/A GLN 87.A N GLN 87.A OE1 no hydrogen 2.894 N/A GLN 87.A NE2 TYR 52.A OH no hydrogen 3.020 N/A ALA 89.A N ALA 85.A O no hydrogen 3.037 N/A ALA 90.A N GLY 86.A O no hydrogen 2.715 N/A LYS 91.A N GLN 87.A O no hydrogen 3.195 N/A LYS 91.A NZ GLU 31.A OE2 no hydrogen 2.456 N/A LYS 91.A NZ TYR 122.A OH no hydrogen 3.171 N/A MET 92.A N VAL 88.A O no hydrogen 3.057 N/A GLY 93.A N ALA 89.A O no hydrogen 2.994 N/A MET 94.A N ALA 90.A O no hydrogen 2.947 N/A GLU 95.A N LYS 91.A O no hydrogen 2.896 N/A HIS 96.A N MET 92.A O no hydrogen 3.173 N/A ALA 97.A N GLY 93.A O no hydrogen 2.920 N/A ILE 98.A N MET 94.A O no hydrogen 2.876 N/A LYS 99.A N GLU 95.A O no hydrogen 3.059 N/A THR 100.A N HIS 96.A O no hydrogen 2.909 N/A THR 100.A OG1 HIS 96.A NE2 no hydrogen 3.141 N/A THR 100.A OG1 HIS 96.A O no hydrogen 2.978 N/A ALA 101.A N ALA 97.A O no hydrogen 2.876 N/A GLN 102.A N ILE 98.A O no hydrogen 2.929 N/A GLN 103.A N LYS 99.A O no hydrogen 3.245 N/A ASN 104.A N THR 100.A O no hydrogen 2.776 N/A ASN 104.A ND2 PRO 74.A O no hydrogen 2.892 N/A GLY 105.A N ALA 101.A O no hydrogen 2.852 N/A ALA 107.A N VAL 267.A O no hydrogen 2.883 N/A VAL 108.A N CYS 75.A O no hydrogen 2.909 N/A VAL 109.A N HIS 265.A O no hydrogen 2.955 N/A GLY 110.A N ALA 77.A O no hydrogen 2.983 N/A ILE 111.A N GLN 263.A O no hydrogen 2.784 N/A SER 112.A N LEU 79.A O no hydrogen 2.840 N/A ARG 113.A N LEU 261.A O no hydrogen 2.969 N/A MET 114.A N LEU 261.A O no hydrogen 3.082 N/A GLY 115.A N ALA 84.A O no hydrogen 2.963 N/A HIS 116.A ND1 TYR 52.A OH no hydrogen 2.706 N/A SER 117.A OG GLN 263.A OE1 no hydrogen 2.794 N/A SER 121.A N ASP 174.A OD2 no hydrogen 3.166 N/A SER 121.A OG TYR 35.A OH no hydrogen 2.599 N/A SER 121.A OG ASP 174.A OD2 no hydrogen 2.788 N/A TYR 122.A N ALA 119.A O no hydrogen 3.122 N/A TYR 122.A OH GLU 31.A OE1 no hydrogen 3.013 N/A PHE 123.A N ILE 120.A O no hydrogen 3.111 N/A GLN 125.A N SER 121.A O no hydrogen 2.981 N/A GLN 125.A NE2 THR 172.A OG1 no hydrogen 2.853 N/A GLN 126.A N TYR 122.A O no hydrogen 3.255 N/A GLN 126.A NE2 LYS 91.A O no hydrogen 3.687 N/A ALA 128.A N VAL 124.A O no hydrogen 3.021 N/A ARG 129.A N GLN 125.A O no hydrogen 2.824 N/A ALA 130.A N GLN 126.A O no hydrogen 3.148 N/A GLY 131.A N ALA 128.A O no hydrogen 2.915 N/A PHE 132.A N ALA 127.A O no hydrogen 2.880 N/A ILE 133.A N ILE 268.A O no hydrogen 2.899 N/A GLY 134.A N ALA 162.A O no hydrogen 2.938 N/A ILE 135.A N ILE 266.A O no hydrogen 2.890 N/A SER 136.A N ALA 160.A O no hydrogen 2.972 N/A SER 136.A OG LEU 264.A O no hydrogen 3.367 N/A SER 136.A OG HIS 265.A ND1 no hydrogen 2.781 N/A MET 137.A N LEU 264.A O no hydrogen 3.191 N/A CYS 138.A SG GLN 139.A O no hydrogen 3.646 N/A GLN 139.A N GLY 262.A O no hydrogen 3.109 N/A GLN 139.A NE2 ASP 233.A OD2 no hydrogen 3.089 N/A GLN 139.A NE2 PRO 243.A O no hydrogen 2.822 N/A SER 140.A N ASN 157.A OD1 no hydrogen 3.027 N/A MET 143.A N TYR 154.A O no hydrogen 2.966 N/A VAL 144.A N TYR 154.A O no hydrogen 2.982 N/A VAL 145.A N LEU 217.A O no hydrogen 3.117 N/A GLY 149.A N PRO 146.A O no hydrogen 2.885 N/A TYR 153.A N VAL 144.A O no hydrogen 2.926 N/A ASN 157.A ND2 MET 229.A O no hydrogen 3.118 N/A LEU 159.A N MET 175.A O no hydrogen 2.938 N/A ALA 160.A N SER 136.A O no hydrogen 2.872 N/A PHE 161.A N PHE 173.A O no hydrogen 2.844 N/A ALA 162.A N GLY 134.A O no hydrogen 2.957 N/A ALA 163.A N LEU 171.A O no hydrogen 3.047 N/A GLY 165.A N GLU 169.A O no hydrogen 2.761 N/A GLU 166.A N SER 284.A OG no hydrogen 2.913 N/A GLU 169.A N GLU 166.A O no hydrogen 3.027 N/A LEU 171.A N ALA 163.A O no hydrogen 2.937 N/A PHE 173.A N PHE 161.A O no hydrogen 2.822 N/A MET 175.A N LEU 159.A O no hydrogen 2.936 N/A THR 177.A N THR 156.A O no hydrogen 3.038 N/A THR 177.A OG1 THR 156.A O no hydrogen 3.195 N/A THR 177.A OG1 ASN 157.A O no hydrogen 2.685 N/A THR 178.A OG1 GLN 180.A O no hydrogen 2.754 N/A VAL 179.A N LEU 218.A O no hydrogen 3.107 N/A LYS 184.A N ALA 181.A O no hydrogen 3.190 N/A LYS 184.A NZ GLN 180.A OE1 no hydrogen 3.407 N/A VAL 185.A N TRP 182.A O no hydrogen 2.925 N/A LEU 186.A N TRP 182.A O no hydrogen 3.092 N/A ASP 187.A N GLY 183.A O no hydrogen 2.696 N/A ALA 188.A N LYS 184.A O no hydrogen 3.300 N/A ARG 189.A N LEU 186.A O no hydrogen 3.119 N/A ARG 189.A NE PRO 211.A O no hydrogen 2.969 N/A ARG 189.A NH2 PRO 211.A O no hydrogen 3.399 N/A SER 190.A N LEU 186.A O no hydrogen 2.977 N/A MET 193.A N ALA 188.A O no hydrogen 3.375 N/A SER 194.A OG THR 209.A O no hydrogen 3.374 N/A ILE 195.A N THR 209.A O no hydrogen 2.928 N/A VAL 201.A N ALA 216.A O no hydrogen 2.882 N/A ASP 202.A N VAL 206.A O no hydrogen 2.925 N/A ASN 204.A N ASP 202.A OD1 no hydrogen 2.906 N/A GLY 205.A N ASP 202.A O no hydrogen 2.983 N/A VAL 206.A N ASP 202.A OD1 no hydrogen 3.124 N/A THR 208.A N ALA 200.A O no hydrogen 3.080 N/A THR 208.A OG1 ASP 210.A O no hydrogen 3.540 N/A ASP 210.A N THR 208.A OG1 no hydrogen 2.963 N/A PHE 212.A N ASP 210.A OD2 no hydrogen 3.342 N/A ALA 213.A N ASP 210.A O no hydrogen 2.908 N/A HIS 215.A N VAL 201.A O no hydrogen 2.774 N/A ALA 216.A N VAL 201.A O no hydrogen 3.305 N/A LEU 217.A N MET 143.A O no hydrogen 2.725 N/A LEU 218.A N TRP 199.A O no hydrogen 2.959 N/A ALA 220.A N THR 177.A O no hydrogen 2.866 N/A LYS 224.A N ALA 221.A O no hydrogen 3.163 N/A GLY 225.A N ALA 220.A O no hydrogen 2.784 N/A TYR 226.A N GLY 222.A O no hydrogen 3.243 N/A GLY 227.A N PRO 223.A O no hydrogen 2.884 N/A LEU 228.A N LYS 224.A O no hydrogen 2.894 N/A MET 229.A N GLY 225.A O no hydrogen 2.857 N/A MET 230.A N TYR 226.A O no hydrogen 3.066 N/A MET 231.A N GLY 227.A O no hydrogen 2.878 N/A ILE 232.A N LEU 228.A O no hydrogen 2.967 N/A ASP 233.A N MET 229.A O no hydrogen 2.903 N/A VAL 234.A N MET 230.A O no hydrogen 2.842 N/A LEU 235.A N MET 231.A O no hydrogen 2.831 N/A SER 236.A N ILE 232.A O no hydrogen 2.905 N/A SER 236.A OG ILE 232.A O no hydrogen 2.750 N/A VAL 238.A N ASP 233.A O no hydrogen 3.054 N/A LEU 239.A N VAL 234.A O no hydrogen 2.875 N/A LEU 240.A N GLY 237.A O no hydrogen 3.033 N/A GLY 241.A N VAL 238.A O no hydrogen 2.991 N/A LEU 242.A N GLY 237.A O no hydrogen 3.036 N/A PHE 244.A N GLN 247.A OE1 no hydrogen 3.254 N/A GLY 245.A N ASP 233.A OD2 no hydrogen 2.824 N/A ARG 246.A NH1 ARG 246.A O no hydrogen 2.697 N/A GLN 247.A N PHE 244.A O no hydrogen 3.014 N/A VAL 248.A N GLY 245.A O no hydrogen 3.219 N/A SER 249.A OG ARG 259.A O no hydrogen 2.726 N/A SER 250.A N ASP 253.A OD1 no hydrogen 3.042 N/A MET 251.A N ASP 141.A OD2 no hydrogen 2.656 N/A ASP 253.A N SER 250.A O no hydrogen 3.153 N/A HIS 256.A N ASP 254.A OD2 no hydrogen 3.013 N/A ALA 257.A N ASP 254.A O no hydrogen 3.021 N/A ARG 259.A NE SER 249.A OG no hydrogen 2.804 N/A ARG 259.A NH2 ASP 141.A OD1 no hydrogen 2.782 N/A ARG 259.A NH2 SER 249.A O no hydrogen 2.928 N/A ASN 260.A N ASN 83.A OD1 no hydrogen 2.676 N/A LEU 261.A N MET 114.A O no hydrogen 3.094 N/A GLY 262.A N GLN 139.A OE1 no hydrogen 3.061 N/A GLN 263.A N ILE 111.A O no hydrogen 3.194 N/A GLN 263.A NE2 SER 136.A OG no hydrogen 2.858 N/A LEU 264.A N MET 137.A O no hydrogen 2.880 N/A HIS 265.A N VAL 109.A O no hydrogen 2.851 N/A HIS 265.A ND1 SER 136.A OG no hydrogen 2.781 N/A HIS 265.A NE2 ALA 90.A O no hydrogen 2.888 N/A ILE 266.A N ILE 135.A O no hydrogen 2.850 N/A VAL 267.A N ALA 107.A O no hydrogen 2.819 N/A ILE 268.A N ILE 133.A O no hydrogen 2.966 N/A ASN 269.A N GLY 105.A O no hydrogen 2.884 N/A ASN 269.A ND2 ALA 101.A O no hydrogen 3.127 N/A ASN 271.A N ASN 269.A OD1 no hydrogen 2.974 N/A ASN 271.A ND2 ASN 269.A OD1 no hydrogen 2.799 N/A PHE 272.A N ASN 269.A O no hydrogen 2.975 N/A PHE 273.A N PRO 270.A O no hydrogen 2.860 N/A SER 274.A N PRO 270.A O no hydrogen 3.051 N/A SER 276.A OG ASN 271.A OD1 no hydrogen 2.759 N/A LEU 278.A N SER 275.A OG no hydrogen 3.009 N/A PHE 279.A N SER 275.A O no hydrogen 2.956 N/A ARG 280.A N SER 276.A O no hydrogen 2.995 N/A ARG 280.A NE GLY 165.A O no hydrogen 2.810 N/A GLN 281.A N GLU 277.A O no hydrogen 2.984 N/A GLN 281.A NE2 GLU 277.A OE2 no hydrogen 2.890 N/A HIS 282.A N LEU 278.A O no hydrogen 2.922 N/A LEU 283.A N PHE 279.A O no hydrogen 2.902 N/A SER 284.A N ARG 280.A O no hydrogen 2.961 N/A SER 284.A OG GLU 169.A OE1 no hydrogen 2.670 N/A SER 284.A OG ARG 280.A O no hydrogen 3.562 N/A GLN 285.A N GLN 281.A O no hydrogen 2.832 N/A GLN 285.A NE2 GLU 289.A OE1 no hydrogen 2.881 N/A THR 286.A N HIS 282.A O no hydrogen 2.869 N/A THR 286.A OG1 HIS 282.A O no hydrogen 2.902 N/A MET 287.A N LEU 283.A O no hydrogen 3.066 N/A ARG 288.A N SER 284.A O no hydrogen 3.038 N/A GLU 289.A N GLN 285.A O no hydrogen 2.869 N/A LEU 290.A N THR 286.A O no hydrogen 2.988 N/A ASN 291.A N MET 287.A O no hydrogen 3.223 N/A ASN 291.A ND2 VAL 302.A O no hydrogen 3.005 N/A ASN 291.A ND2 GLN 307.A OE1 no hydrogen 2.711 N/A ALA 292.A N GLU 289.A O no hydrogen 3.129 N/A ILE 293.A N LEU 290.A O no hydrogen 3.227 N/A PHE 299.A N ALA 296.A O no hydrogen 3.058 N/A TYR 304.A N GLN 307.A OE1 no hydrogen 2.934 N/A TYR 304.A OH ASP 310.A OD1 no hydrogen 3.308 N/A GLN 307.A N TYR 304.A O no hydrogen 2.952 N/A GLN 307.A NE2 ASN 291.A OD1 no hydrogen 3.495 N/A ASP 310.A N GLY 306.A O no hydrogen 3.053 N/A ILE 311.A N GLN 307.A O no hydrogen 2.922 N/A LYS 312.A N ASP 308.A O no hydrogen 3.248 N/A GLN 313.A N GLN 309.A O no hydrogen 2.877 N/A ARG 314.A N ASP 310.A O no hydrogen 2.865 N/A LYS 315.A N ILE 311.A O no hydrogen 2.827 N/A ALA 316.A N LYS 312.A O no hydrogen 2.818 N/A ALA 317.A N GLN 313.A O no hydrogen 3.219 N/A ALA 317.A N ARG 314.A O no hydrogen 3.234 N/A GLU 319.A N LYS 315.A O no hydrogen 2.909 N/A GLY 320.A N ALA 316.A O no hydrogen 3.011 N/A ILE 321.A N ILE 3.A O no hydrogen 2.560 N/A ILE 323.A N MET 1.A O no hydrogen 2.974 N/A ILE 327.A N VAL 324.A O no hydrogen 2.928 N/A GLN 329.A N ASP 325.A O no hydrogen 2.998 N/A TYR 330.A N ASP 326.A O no hydrogen 3.205 N/A TYR 330.A OH LEU 336.A O no hydrogen 2.483 N/A LEU 331.A N ILE 327.A O no hydrogen 2.978 N/A ILE 332.A N TYR 328.A O no hydrogen 3.168 N/A SER 333.A N GLN 329.A O no hydrogen 3.358 N/A SER 333.A OG GLN 329.A O no hydrogen 2.358 N/A ASN 338.A N GLU 50.A OE2 no hydrogen 3.466 N/A