Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4uej_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLU 16.A OE2 no hydrogen 2.721 N/A MET 1.A N SER 17.A O no hydrogen 2.628 N/A LYS 2.A N GLU 119.A OE2 no hydrogen 2.611 N/A SER 3.A N ALA 15.A O no hydrogen 2.992 N/A VAL 4.A N PHE 117.A O no hydrogen 2.867 N/A VAL 5.A N ARG 13.A O no hydrogen 2.753 N/A ASN 6.A N ILE 55.A O no hydrogen 2.869 N/A ASP 7.A N ILE 11.A O no hydrogen 2.875 N/A THR 8.A N ASP 7.A OD1 no hydrogen 2.701 N/A ASP 9.A N ASN 48.A OD1 no hydrogen 2.824 N/A ARG 13.A N VAL 5.A O no hydrogen 2.890 N/A ALA 15.A N SER 3.A O no hydrogen 2.790 N/A SER 17.A N MET 1.A O no hydrogen 2.872 N/A LYS 23.A N GLU 27.A OE1 no hydrogen 2.871 N/A HIS 24.A N GLU 27.A OE1 no hydrogen 3.194 N/A GLU 27.A N HIS 24.A O no hydrogen 3.067 N/A VAL 28.A N VAL 123.A O no hydrogen 2.820 N/A ARG 29.A N ALA 67.A O no hydrogen 2.843 N/A ARG 29.A NE ASP 66.A OD2 no hydrogen 2.868 N/A ARG 29.A NH1 PRO 20.A O no hydrogen 2.966 N/A ARG 29.A NH1 GLU 21.A OE1 no hydrogen 3.520 N/A ARG 29.A NH2 ASP 66.A OD2 no hydrogen 3.088 N/A VAL 30.A N ILE 121.A O no hydrogen 2.822 N/A LYS 31.A N TYR 64.A O no hydrogen 2.803 N/A ILE 32.A N GLU 119.A O no hydrogen 2.885 N/A ALA 33.A N SER 62.A O no hydrogen 2.788 N/A SER 34.A N SER 62.A O no hydrogen 3.278 N/A SER 34.A OG GLU 138.A O no hydrogen 3.539 N/A SER 35.A N LEU 344.A O no hydrogen 2.909 N/A SER 35.A OG GLY 116.A O no hydrogen 2.934 N/A GLY 36.A N GLU 60.A O no hydrogen 2.699 N/A LEU 37.A N VAL 342.A O no hydrogen 2.963 N/A CYS 38.A N ASP 41.A OD2 no hydrogen 2.969 N/A CYS 38.A SG SER 40.A OG no hydrogen 3.015 N/A CYS 38.A SG HIS 59.A NE2 no hydrogen 3.738 N/A CYS 38.A SG GLU 60.A OE2 no hydrogen 3.426 N/A ASP 41.A N CYS 38.A O no hydrogen 2.876 N/A LEU 42.A N GLY 39.A O no hydrogen 3.191 N/A ARG 44.A NH1 SER 40.A OG no hydrogen 3.139 N/A ARG 44.A NH1 ASP 41.A OD1 no hydrogen 2.711 N/A ILE 45.A N ASP 41.A O no hydrogen 2.942 N/A ILE 45.A N LEU 42.A O no hydrogen 3.246 N/A PHE 46.A N LEU 42.A O no hydrogen 2.937 N/A LYS 47.A N PRO 43.A O no hydrogen 2.983 N/A LYS 47.A NZ PHE 46.A O no hydrogen 3.467 N/A ASN 48.A ND2 ASP 9.A OD1 no hydrogen 3.219 N/A GLY 49.A N PRO 43.A O no hydrogen 2.971 N/A ALA 50.A N TYR 53.A OH no hydrogen 3.008 N/A TYR 52.A OH ASP 114.A OD1 no hydrogen 2.755 N/A TYR 53.A OH ARG 44.A O no hydrogen 2.468 N/A ILE 55.A N ASN 6.A O no hydrogen 3.029 N/A THR 56.A N ASP 114.A OD1 no hydrogen 3.127 N/A THR 56.A OG1 VAL 4.A O no hydrogen 3.210 N/A SER 62.A N SER 34.A O no hydrogen 2.836 N/A SER 62.A OG ILE 137.A O no hydrogen 2.527 N/A GLY 63.A N VAL 81.A O no hydrogen 3.049 N/A TYR 64.A N LYS 31.A O no hydrogen 2.952 N/A ILE 65.A N ASP 79.A O no hydrogen 2.830 N/A ASP 66.A N ARG 29.A O no hydrogen 2.722 N/A ALA 67.A N ARG 29.A O no hydrogen 3.488 N/A GLY 69.A N GLU 27.A O no hydrogen 2.721 N/A GLY 71.A N GLN 25.A O no hydrogen 2.862 N/A VAL 72.A N GLY 69.A O no hydrogen 3.045 N/A HIS 76.A N ASP 79.A OD2 no hydrogen 2.804 N/A GLY 78.A N ILE 65.A O no hydrogen 2.738 N/A ASP 79.A N HIS 76.A O no hydrogen 3.017 N/A VAL 81.A N GLY 63.A O no hydrogen 2.939 N/A ALA 82.A N PHE 129.A O no hydrogen 2.824 N/A CYS 83.A N PHE 61.A O no hydrogen 2.944 N/A CYS 83.A SG ASN 127.A O no hydrogen 3.761 N/A VAL 84.A N ASN 127.A O no hydrogen 2.770 N/A LEU 86.A N TYR 290.A OH no hydrogen 3.318 N/A LEU 87.A N ASP 107.A O no hydrogen 2.830 N/A CYS 89.A SG THR 91.A OG1 no hydrogen 3.603 N/A GLU 94.A N GLU 94.A OE1 no hydrogen 2.696 N/A LEU 96.A N CYS 92.A O no hydrogen 2.983 N/A LYS 97.A N PRO 93.A O no hydrogen 3.135 N/A LYS 97.A N GLU 94.A O no hydrogen 3.025 N/A GLY 98.A N CYS 95.A O no hydrogen 2.856 N/A PHE 99.A N GLU 94.A O no hydrogen 2.813 N/A SER 101.A OG TRP 287.A O no hydrogen 3.308 N/A GLN 102.A N PHE 99.A O no hydrogen 3.044 N/A CYS 103.A N TYR 100.A O no hydrogen 3.049 N/A ASP 107.A N LEU 87.A O no hydrogen 2.882 N/A PHE 108.A N ASP 107.A OD1 no hydrogen 2.834 N/A ILE 109.A N PRO 85.A O no hydrogen 2.800 N/A GLY 110.A N ARG 113.A O no hydrogen 2.845 N/A SER 111.A N PHE 108.A O no hydrogen 3.131 N/A ARG 112.A N PHE 108.A O no hydrogen 2.886 N/A ARG 112.A NH1 TYR 106.A O no hydrogen 2.765 N/A ARG 113.A N PHE 108.A O no hydrogen 3.144 N/A ARG 113.A NE ASP 114.A O no hydrogen 3.079 N/A ARG 113.A NH1 VAL 122.A O no hydrogen 3.021 N/A ARG 113.A NH2 VAL 122.A O no hydrogen 2.883 N/A GLY 115.A N THR 56.A O no hydrogen 2.702 N/A GLY 116.A N GLY 58.A O no hydrogen 2.768 N/A PHE 117.A N LEU 57.A O no hydrogen 2.921 N/A GLU 119.A N LYS 2.A O no hydrogen 3.217 N/A ILE 121.A N VAL 30.A O no hydrogen 3.061 N/A VAL 123.A N VAL 28.A O no hydrogen 3.015 N/A LYS 124.A N ASN 127.A OD1 no hydrogen 3.317 N/A LYS 124.A NZ GLU 27.A OE2 no hydrogen 2.936 N/A ARG 125.A N ASP 26.A O no hydrogen 2.793 N/A ARG 125.A NE ASP 74.A OD1 no hydrogen 2.883 N/A ARG 125.A NE ASP 74.A OD2 no hydrogen 3.372 N/A ARG 125.A NH1 ARG 125.A O no hydrogen 2.844 N/A ARG 125.A NH1 VAL 128.A O no hydrogen 3.022 N/A ARG 125.A NH2 ASP 74.A OD2 no hydrogen 2.865 N/A ASN 127.A N LYS 124.A O no hydrogen 2.753 N/A ASN 127.A ND2 VAL 84.A O no hydrogen 2.835 N/A VAL 128.A N ARG 125.A O no hydrogen 3.150 N/A PHE 129.A N ALA 82.A O no hydrogen 2.827 N/A LEU 131.A N ALA 80.A O no hydrogen 2.939 N/A MET 135.A N PRO 132.A O no hydrogen 3.081 N/A ASP 139.A N PRO 136.A O no hydrogen 2.900 N/A GLY 140.A N ILE 137.A O no hydrogen 2.921 N/A ALA 141.A N GLU 138.A O no hydrogen 3.201 N/A PHE 142.A N ASP 139.A O no hydrogen 3.031 N/A ILE 143.A N GLY 140.A O no hydrogen 3.252 N/A ILE 146.A N PHE 142.A O no hydrogen 2.970 N/A THR 147.A N ILE 143.A O no hydrogen 2.996 N/A THR 147.A OG1 GLU 144.A O no hydrogen 2.676 N/A VAL 148.A N PRO 145.A O no hydrogen 3.266 N/A LEU 150.A N ILE 146.A O no hydrogen 3.172 N/A HIS 151.A N THR 147.A O no hydrogen 2.798 N/A HIS 151.A ND1 GLU 298.A OE2 no hydrogen 2.630 N/A ALA 152.A N VAL 148.A O no hydrogen 3.237 N/A PHE 153.A N GLY 149.A O no hydrogen 2.990 N/A HIS 154.A N LEU 150.A O no hydrogen 2.886 N/A LEU 155.A N HIS 151.A O no hydrogen 2.960 N/A ALA 156.A N ALA 152.A O no hydrogen 3.117 N/A ALA 156.A N PHE 153.A O no hydrogen 3.095 N/A GLN 157.A N HIS 154.A O no hydrogen 3.022 N/A GLY 158.A N PHE 153.A O no hydrogen 2.773 N/A CYS 159.A SG ALA 180.A O no hydrogen 3.901 N/A ASN 161.A N GLY 184.A O no hydrogen 2.882 N/A LYS 162.A N CYS 159.A O no hydrogen 2.999 N/A LYS 162.A NZ GLY 158.A O no hydrogen 2.815 N/A LYS 162.A NZ GLN 255.A OE1 no hydrogen 2.766 N/A ASN 163.A N ASN 230.A O no hydrogen 2.848 N/A ASN 163.A ND2 PHE 229.A O no hydrogen 2.796 N/A VAL 164.A N SER 187.A O no hydrogen 2.904 N/A ILE 165.A N LEU 232.A O no hydrogen 2.812 N/A ILE 166.A N THR 189.A O no hydrogen 2.837 N/A ILE 167.A N LEU 234.A O no hydrogen 2.827 N/A GLY 168.A N ILE 191.A O no hydrogen 2.782 N/A ALA 169.A N ASP 192.A OD1 no hydrogen 2.987 N/A LEU 174.A N GLY 170.A O no hydrogen 2.899 N/A LEU 175.A N THR 171.A O no hydrogen 2.902 N/A ALA 176.A N ILE 172.A O.A no hydrogen 2.979 N/A ALA 176.A N ILE 172.A O.B no hydrogen 2.931 N/A ILE 177.A N GLY 173.A O no hydrogen 3.009 N/A GLN 178.A N LEU 174.A O no hydrogen 3.274 N/A GLN 178.A NE2 SER 312.A O no hydrogen 2.989 N/A CYS 179.A N LEU 175.A O no hydrogen 2.872 N/A CYS 179.A SG LEU 175.A O no hydrogen 3.508 N/A ALA 180.A N ALA 176.A O no hydrogen 2.868 N/A VAL 181.A N ILE 177.A O no hydrogen 3.091 N/A ALA 182.A N GLN 178.A O no hydrogen 3.087 N/A LEU 183.A N CYS 179.A O no hydrogen 2.901 N/A GLY 184.A N VAL 181.A O no hydrogen 3.261 N/A ALA 185.A N ALA 180.A O no hydrogen 2.989 N/A LYS 186.A N LYS 162.A O no hydrogen 2.796 N/A SER 187.A N LYS 162.A O no hydrogen 3.383 N/A SER 187.A OG ASN 163.A OD1 no hydrogen 2.603 N/A THR 189.A N VAL 164.A O no hydrogen 2.795 N/A ALA 190.A N GLN 208.A O no hydrogen 3.021 N/A ILE 191.A N ILE 166.A O no hydrogen 2.911 N/A ASP 192.A N PHE 210.A O no hydrogen 3.137 N/A SER 194.A N ASP 192.A OD2 no hydrogen 3.215 N/A LYS 197.A NZ MET 338.A O no hydrogen 3.175 N/A ALA 201.A N LYS 197.A O no hydrogen 2.539 N/A LYS 202.A N LEU 198.A O no hydrogen 2.913 N/A SER 203.A N.A ALA 199.A O no hydrogen 2.987 N/A SER 203.A N.B ALA 199.A O no hydrogen 3.009 N/A SER 203.A OG.A LEU 200.A O no hydrogen 2.637 N/A PHE 204.A N LEU 200.A O no hydrogen 3.022 N/A PHE 204.A N ALA 201.A O no hydrogen 3.098 N/A GLY 205.A N LYS 202.A O no hydrogen 2.967 N/A ALA 206.A N ALA 201.A O no hydrogen 3.046 N/A MET 207.A N VAL 188.A O no hydrogen 2.840 N/A GLN 208.A NE2 THR 189.A OG1 no hydrogen 3.052 N/A PHE 210.A N ALA 190.A O no hydrogen 2.930 N/A SER 212.A N ASP 192.A O no hydrogen 2.954 N/A SER 213.A N ASN 211.A OD1 no hydrogen 2.932 N/A SER 213.A OG ILE 193.A O no hydrogen 3.159 N/A SER 213.A OG ASN 211.A OD1 no hydrogen 2.480 N/A GLU 214.A N ASN 211.A O no hydrogen 2.916 N/A MET 215.A N ASN 211.A O no hydrogen 2.871 N/A SER 216.A N GLN 219.A OE1 no hydrogen 2.922 N/A GLN 219.A N SER 216.A OG no hydrogen 3.409 N/A MET 220.A N SER 216.A O no hydrogen 3.078 N/A GLN 221.A N ALA 217.A O no hydrogen 2.803 N/A SER 222.A N PRO 218.A O no hydrogen 2.920 N/A VAL 223.A N GLN 219.A O no hydrogen 3.209 N/A LEU 224.A N MET 220.A O no hydrogen 2.883 N/A ARG 225.A N SER 222.A O no hydrogen 3.394 N/A LEU 227.A N LEU 224.A O no hydrogen 2.721 N/A ARG 228.A N ARG 225.A O no hydrogen 3.303 N/A ARG 228.A NH1 ARG 225.A O no hydrogen 2.848 N/A GLN 231.A NE2 LEU 227.A O no hydrogen 3.148 N/A LEU 232.A N ASN 163.A O no hydrogen 2.982 N/A ILE 233.A N GLN 255.A O no hydrogen 2.743 N/A LEU 234.A N ILE 165.A O no hydrogen 2.731 N/A GLU 235.A N ALA 257.A O no hydrogen 2.876 N/A THR 236.A N ILE 167.A O no hydrogen 2.875 N/A THR 236.A OG1 ILE 167.A O no hydrogen 2.635 N/A THR 236.A OG1 GLY 168.A O no hydrogen 3.184 N/A ALA 237.A N GLU 235.A OE2 no hydrogen 2.851 N/A GLY 238.A N GLU 235.A OE1 no hydrogen 2.815 N/A GLN 241.A N GLN 241.A OE1 no hydrogen 2.697 N/A THR 242.A N VAL 239.A O no hydrogen 3.074 N/A THR 242.A OG1 GLU 235.A OE2 no hydrogen 2.600 N/A THR 242.A OG1 VAL 239.A O no hydrogen 2.915 N/A VAL 243.A N VAL 239.A O no hydrogen 3.335 N/A GLU 244.A N PRO 240.A O no hydrogen 3.026 N/A LEU 245.A N GLN 241.A O no hydrogen 2.929 N/A ALA 246.A N THR 242.A O no hydrogen 2.954 N/A VAL 247.A N VAL 243.A O no hydrogen 3.267 N/A GLU 248.A N GLU 244.A O no hydrogen 2.973 N/A ILE 249.A N LEU 245.A O no hydrogen 2.868 N/A GLY 251.A N GLN 231.A OE1 no hydrogen 2.782 N/A HIS 253.A N LYS 279.A O no hydrogen 2.768 N/A ALA 254.A N GLY 251.A O no hydrogen 3.224 N/A GLN 255.A N GLN 231.A O no hydrogen 2.895 N/A GLN 255.A NE2 ALA 156.A O no hydrogen 2.976 N/A LEU 256.A N.A THR 282.A O no hydrogen 2.750 N/A LEU 256.A N.B THR 282.A O no hydrogen 2.705 N/A ALA 257.A N ILE 233.A O no hydrogen 2.715 N/A LEU 258.A N ILE 284.A O no hydrogen 2.843 N/A VAL 259.A N.A GLU 235.A O no hydrogen 2.963 N/A VAL 259.A N.B GLU 235.A O no hydrogen 2.913 N/A GLY 260.A N GLU 235.A O no hydrogen 3.019 N/A THR 261.A OG1.B HIS 263.A NE2 no hydrogen 3.289 N/A THR 269.A OG1 THR 272.A OG1 no hydrogen 3.047 N/A THR 272.A N THR 269.A OG1 no hydrogen 2.965 N/A THR 272.A OG1 GLU 248.A OE2 no hydrogen 2.617 N/A THR 272.A OG1 THR 269.A OG1 no hydrogen 3.047 N/A PHE 273.A N THR 269.A O no hydrogen 2.881 N/A GLY 274.A N SER 270.A O no hydrogen 2.756 N/A LYS 275.A N ALA 271.A O no hydrogen 3.105 N/A LYS 275.A N THR 272.A O no hydrogen 3.068 N/A LYS 275.A NZ GLU 248.A OE1 no hydrogen 2.585 N/A ILE 276.A N PHE 273.A O no hydrogen 2.954 N/A ARG 278.A N GLY 274.A O no hydrogen 2.733 N/A LYS 279.A N LYS 275.A O no hydrogen 2.867 N/A LYS 279.A NZ VAL 247.A O no hydrogen 2.849 N/A LYS 279.A NZ GLU 248.A O no hydrogen 3.014 N/A LYS 279.A NZ ALA 250.A O no hydrogen 2.802 N/A GLU 280.A N LEU 277.A O no hydrogen 2.816 N/A LEU 281.A N ILE 276.A O no hydrogen 3.009 N/A THR 282.A N ALA 254.A O no hydrogen 3.038 N/A ILE 284.A N LEU 256.A O.A no hydrogen 2.822 N/A ILE 284.A N LEU 256.A O.B no hydrogen 2.547 N/A SER 286.A N LEU 258.A O no hydrogen 3.070 N/A ASN 289.A ND2 GLU 144.A OE2 no hydrogen 3.340 N/A ASN 289.A ND2 THR 147.A OG1 no hydrogen 2.757 N/A SER 291.A N PRO 295.A O no hydrogen 3.097 N/A SER 291.A OG GLU 298.A OE1 no hydrogen 2.546 N/A SER 291.A OG GLU 298.A OE2 no hydrogen 3.474 N/A TRP 294.A NE1 LYS 126.A O no hydrogen 3.014 N/A GLU 298.A N GLU 298.A OE1 no hydrogen 2.705 N/A TRP 299.A N GLY 296.A O no hydrogen 3.074 N/A TRP 299.A NE1 ASN 289.A O no hydrogen 2.958 N/A THR 301.A N GLN 297.A O no hydrogen 2.813 N/A THR 301.A OG1 GLN 297.A O no hydrogen 3.009 N/A THR 301.A OG1 GLN 297.A OE1 no hydrogen 3.272 N/A ALA 302.A N GLU 298.A O no hydrogen 2.909 N/A SER 303.A N TRP 299.A O no hydrogen 3.091 N/A ARG 304.A N GLU 300.A O no hydrogen 2.936 N/A LEU 305.A N THR 301.A O no hydrogen 2.846 N/A LEU 306.A N ALA 302.A O no hydrogen 3.095 N/A THR 307.A N SER 303.A O no hydrogen 2.960 N/A THR 307.A OG1 SER 303.A O no hydrogen 3.481 N/A THR 307.A OG1 ARG 304.A O no hydrogen 2.778 N/A GLU 308.A N ARG 304.A O no hydrogen 2.859 N/A ARG 309.A N LEU 306.A O no hydrogen 3.029 N/A LYS 310.A N LEU 305.A O no hydrogen 2.974 N/A LYS 310.A NZ GLU 308.A OE1 no hydrogen 2.803 N/A SER 312.A N GLN 178.A OE1 no hydrogen 2.526 N/A LEU 316.A N LEU 313.A O no hydrogen 2.845 N/A ILE 317.A N GLU 314.A O no hydrogen 3.140 N/A ALA 318.A N LYS 341.A O no hydrogen 2.828 N/A HIS 319.A N LYS 341.A O no hydrogen 3.279 N/A HIS 319.A NE2 SER 325.A OG no hydrogen 2.866 N/A ARG 320.A NE GLU 138.A OE1 no hydrogen 2.777 N/A ARG 320.A NE GLU 138.A OE2 no hydrogen 3.009 N/A ARG 320.A NH1 GLU 314.A OE2 no hydrogen 2.952 N/A ARG 320.A NH2 GLU 138.A OE2 no hydrogen 2.465 N/A ARG 320.A NH2 GLU 314.A OE1 no hydrogen 2.597 N/A ARG 320.A NH2 GLU 314.A OE2 no hydrogen 3.066 N/A GLY 321.A N LEU 343.A O no hydrogen 3.300 N/A SER 325.A OG HIS 319.A NE2 no hydrogen 2.866 N/A PHE 326.A N SER 322.A O no hydrogen 2.727 N/A ALA 327.A N PHE 323.A O no hydrogen 2.828 N/A GLN 328.A N GLU 324.A O no hydrogen 3.017 N/A GLN 328.A NE2 ASP 332.A OD1 no hydrogen 3.063 N/A ALA 329.A N SER 325.A O no hydrogen 3.079 N/A VAL 330.A N PHE 326.A O no hydrogen 2.926 N/A ARG 331.A N ALA 327.A O no hydrogen 2.966 N/A ARG 331.A NE GLN 328.A OE1 no hydrogen 2.989 N/A ARG 331.A NH2 GLN 328.A OE1 no hydrogen 3.306 N/A ASP 332.A N GLN 328.A O no hydrogen 2.749 N/A ILE 333.A N ALA 329.A O no hydrogen 3.263 N/A ILE 333.A N VAL 330.A O no hydrogen 3.063 N/A ALA 334.A N ARG 331.A O no hydrogen 3.040 N/A ASN 336.A N ILE 333.A O no hydrogen 3.038 N/A LYS 341.A N LEU 316.A O no hydrogen 2.821 N/A LYS 341.A NZ LEU 37.A O no hydrogen 2.930 N/A LYS 341.A NZ GLU 60.A OE1 no hydrogen 2.573 N/A LYS 341.A NZ GLU 60.A OE2 no hydrogen 3.533 N/A LEU 343.A N HIS 319.A O no hydrogen 2.747 N/A LEU 344.A N SER 35.A O no hydrogen 2.712 N/A ILE 345.A N GLY 321.A O no hydrogen 2.679 N/A