Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4hjj_L.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N SER 26.A OG no hydrogen 2.792 N/A THR 5.A N LYS 24.A O no hydrogen 2.779 N/A GLN 6.A NE2 TYR 86.A O no hydrogen 2.709 N/A SER 7.A N ASN 22.A O no hydrogen 3.052 N/A LEU 11.A N LYS 103.A O no hydrogen 2.791 N/A VAL 13.A N GLU 105.A O no hydrogen 2.996 N/A GLY 16.A N LEU 78.A O no hydrogen 2.760 N/A GLU 17.A N SER 14.A O no hydrogen 3.109 N/A ALA 19.A N ILE 75.A O no hydrogen 2.835 N/A ILE 21.A N LEU 73.A O no hydrogen 2.937 N/A ASN 22.A N SER 7.A O no hydrogen 3.067 N/A ASN 22.A ND2 SER 7.A O no hydrogen 3.505 N/A CYS 23.A N PHE 71.A O no hydrogen 2.912 N/A LYS 24.A N THR 5.A O no hydrogen 2.823 N/A LYS 24.A NZ ASP 70.A OD2 no hydrogen 2.802 N/A ALA 25.A N THR 69.A O no hydrogen 2.858 N/A SER 26.A N VAL 3.A O no hydrogen 2.851 N/A SER 26.A OG VAL 3.A O no hydrogen 3.391 N/A VAL 29.A N GLY 68.A O no hydrogen 2.841 N/A ASP 32.A N VAL 29.A O no hydrogen 3.148 N/A ALA 34.A N GLN 89.A O no hydrogen 2.900 N/A TRP 35.A N ILE 48.A O no hydrogen 3.030 N/A TYR 36.A N TYR 87.A O no hydrogen 2.842 N/A TYR 36.A OH GLN 89.A OE1 no hydrogen 2.727 N/A GLN 37.A N LYS 45.A O no hydrogen 2.814 N/A GLN 37.A NE2 TYR 86.A OH no hydrogen 2.896 N/A GLN 38.A N VAL 85.A O no hydrogen 2.718 N/A GLN 38.A NE2 GLN 42.A O no hydrogen 3.014 N/A LYS 39.A NZ GLU 81.A O no hydrogen 2.882 N/A GLN 42.A N LYS 39.A O no hydrogen 3.073 N/A LYS 45.A N GLN 37.A O no hydrogen 2.717 N/A LEU 47.A N TRP 35.A O no hydrogen 2.916 N/A ILE 48.A N TRP 35.A O no hydrogen 3.283 N/A TYR 49.A N ASN 53.A O no hydrogen 2.813 N/A ALA 51.A N VAL 33.A O no hydrogen 2.793 N/A SER 52.A N TYR 50.A O no hydrogen 2.733 N/A SER 52.A OG TYR 50.A O no hydrogen 3.437 N/A ASN 53.A N TYR 49.A O no hydrogen 2.870 N/A ASN 53.A ND2 TYR 49.A O no hydrogen 3.239 N/A ASN 53.A ND2 TYR 50.A O no hydrogen 3.253 N/A ARG 54.A NE PHE 62.A O no hydrogen 2.713 N/A ARG 54.A NH2 PHE 62.A O no hydrogen 3.132 N/A TYR 55.A N LEU 47.A O no hydrogen 2.887 N/A VAL 58.A N TYR 55.A O no hydrogen 3.151 N/A ARG 61.A NE ASP 82.A OD1 no hydrogen 3.214 N/A ARG 61.A NE ASP 82.A OD2 no hydrogen 2.880 N/A ARG 61.A NH2 ASP 82.A OD1 no hydrogen 2.844 N/A PHE 62.A N PRO 59.A O no hydrogen 3.383 N/A SER 63.A N THR 74.A O no hydrogen 2.931 N/A SER 65.A N THR 72.A O no hydrogen 2.879 N/A GLY 68.A N SER 30.A O no hydrogen 2.690 N/A THR 69.A N SER 67.A O no hydrogen 3.110 N/A THR 69.A OG1 ALA 25.A O no hydrogen 3.041 N/A PHE 71.A N CYS 23.A O no hydrogen 2.744 N/A THR 72.A N SER 65.A O no hydrogen 2.770 N/A LEU 73.A N ILE 21.A O no hydrogen 3.080 N/A THR 74.A N SER 63.A O no hydrogen 2.805 N/A ILE 75.A N ALA 19.A O no hydrogen 2.833 N/A SER 76.A N ARG 61.A O no hydrogen 2.958 N/A SER 76.A OG ARG 61.A O no hydrogen 3.562 N/A SER 77.A OG GLU 79.A OE2 no hydrogen 3.253 N/A LEU 78.A N GLU 17.A O no hydrogen 2.737 N/A GLU 79.A N ASP 82.A OD2 no hydrogen 2.864 N/A GLU 81.A N GLU 81.A OE1 no hydrogen 2.879 N/A ASP 82.A N GLU 79.A O no hydrogen 2.877 N/A VAL 83.A N ALA 80.A O no hydrogen 3.402 N/A VAL 85.A N GLN 38.A O no hydrogen 2.912 N/A TYR 86.A N THR 102.A O no hydrogen 2.862 N/A TYR 86.A OH ASP 82.A O no hydrogen 2.528 N/A TYR 87.A N TYR 36.A O no hydrogen 2.961 N/A CYS 88.A N GLN 6.A OE1 no hydrogen 3.224 N/A GLN 89.A N ALA 34.A O no hydrogen 2.940 N/A GLN 89.A NE2 GLN 90.A O no hydrogen 3.591 N/A GLN 90.A N THR 97.A O no hydrogen 2.835 N/A GLN 90.A NE2 ASN 93.A O no hydrogen 3.049 N/A GLN 90.A NE2 PRO 95.A O no hydrogen 3.174 N/A GLN 90.A NE2 THR 97.A OG1 no hydrogen 3.036 N/A ASP 91.A N ASP 32.A O no hydrogen 2.923 N/A ASN 93.A N GLN 90.A OE1 no hydrogen 3.109 N/A THR 97.A N GLN 90.A O no hydrogen 3.330 N/A THR 97.A OG1 ILE 2.A O no hydrogen 2.898 N/A GLY 99.A N CYS 88.A O no hydrogen 2.914 N/A GLY 101.A N GLN 6.A OE1 no hydrogen 2.861 N/A THR 102.A N TYR 86.A O no hydrogen 3.014 N/A THR 102.A OG1 PRO 8.A O no hydrogen 2.812 N/A LYS 103.A N ASP 9.A O no hydrogen 3.060 N/A LYS 103.A NZ GLU 105.A OE1 no hydrogen 3.310 N/A LYS 103.A NZ GLU 105.A OE2 no hydrogen 2.858 N/A VAL 104.A N ALA 84.A O no hydrogen 2.901 N/A GLU 105.A N LEU 11.A O no hydrogen 2.637 N/A LYS 107.A N VAL 13.A O no hydrogen 2.983 N/A LYS 107.A NZ SER 14.A OG no hydrogen 2.748 N/A VAL 116.A N SER 139.A OG no hydrogen 3.110 N/A THR 118.A N ARG 137.A O no hydrogen 2.670 N/A SER 120.A N SER 135.A O no hydrogen 3.162 N/A SER 120.A OG SER 135.A OG no hydrogen 3.230 N/A LEU 124.A N ARG 217.A O no hydrogen 2.796 N/A SER 125.A OG GLU 219.A OE2 no hydrogen 2.626 N/A VAL 126.A N GLU 219.A O no hydrogen 3.182 N/A SER 127.A OG LYS 221.A O no hydrogen 3.309 N/A GLY 129.A N LEU 191.A O no hydrogen 2.823 N/A GLU 130.A N SER 127.A O no hydrogen 2.980 N/A ALA 132.A N ILE 188.A O no hydrogen 2.790 N/A LEU 134.A N LEU 186.A O no hydrogen 2.916 N/A SER 135.A N SER 120.A O no hydrogen 3.071 N/A SER 135.A OG SER 120.A OG no hydrogen 3.230 N/A CYS 136.A N PHE 184.A O no hydrogen 2.778 N/A ARG 137.A N THR 118.A O no hydrogen 2.732 N/A ALA 138.A N THR 182.A O no hydrogen 3.014 N/A SER 139.A N VAL 116.A O no hydrogen 2.942 N/A ILE 142.A N GLY 181.A O no hydrogen 2.888 N/A SER 144.A OG THR 163.A OG1 no hydrogen 3.367 N/A ASN 145.A N ILE 142.A O no hydrogen 2.848 N/A ASN 145.A ND2 ILE 142.A O no hydrogen 3.257 N/A ASN 145.A ND2 ASN 205.A OD1 no hydrogen 2.856 N/A LEU 146.A N SER 144.A O no hydrogen 2.904 N/A ALA 147.A N GLN 202.A O no hydrogen 2.961 N/A TRP 148.A N ILE 161.A O no hydrogen 2.749 N/A TYR 149.A N TYR 200.A O no hydrogen 2.816 N/A TYR 149.A OH GLN 202.A OE1 no hydrogen 2.595 N/A GLN 150.A N ARG 158.A O no hydrogen 2.979 N/A GLN 150.A NE2 TYR 199.A OH no hydrogen 2.763 N/A GLN 151.A N VAL 198.A O no hydrogen 2.772 N/A GLN 151.A NE2 GLN 155.A O no hydrogen 2.800 N/A LYS 152.A NZ GLU 194.A O no hydrogen 3.165 N/A GLN 155.A N LYS 152.A O no hydrogen 2.976 N/A ARG 158.A N GLN 150.A O no hydrogen 2.841 N/A PHE 160.A N TRP 148.A O no hydrogen 2.808 N/A ILE 161.A N TRP 148.A O no hydrogen 3.150 N/A TYR 162.A N THR 166.A O no hydrogen 2.810 N/A THR 163.A N TYR 204.A OH no hydrogen 2.858 N/A THR 163.A OG1 SER 144.A O no hydrogen 3.514 N/A THR 163.A OG1 SER 144.A OG no hydrogen 3.367 N/A ALA 164.A N LEU 146.A O no hydrogen 2.755 N/A SER 165.A N THR 163.A O no hydrogen 2.735 N/A THR 166.A N TYR 162.A O no hydrogen 3.007 N/A ARG 167.A NH1 ILE 171.A O no hydrogen 3.138 N/A ALA 168.A N PHE 160.A O no hydrogen 2.771 N/A ARG 174.A NE ASP 195.A OD1 no hydrogen 3.394 N/A ARG 174.A NE ASP 195.A OD2 no hydrogen 2.604 N/A ARG 174.A NH2 ASP 195.A OD1 no hydrogen 2.801 N/A PHE 175.A N PRO 172.A O no hydrogen 3.084 N/A SER 176.A N THR 187.A O no hydrogen 2.826 N/A SER 178.A N THR 185.A O no hydrogen 2.926 N/A GLY 181.A N SER 143.A O no hydrogen 2.781 N/A THR 182.A OG1 ALA 138.A O no hydrogen 3.030 N/A PHE 184.A N CYS 136.A O no hydrogen 2.675 N/A THR 185.A N SER 178.A O no hydrogen 2.948 N/A LEU 186.A N LEU 134.A O no hydrogen 2.898 N/A THR 187.A N SER 176.A O no hydrogen 2.728 N/A ILE 188.A N ALA 132.A O no hydrogen 2.921 N/A SER 189.A N ARG 174.A O no hydrogen 3.057 N/A LEU 191.A N GLU 130.A O no hydrogen 2.827 N/A GLN 192.A N ASP 195.A OD2 no hydrogen 3.131 N/A SER 193.A OG GLU 194.A OE2 no hydrogen 3.517 N/A GLU 194.A N GLU 194.A OE2 no hydrogen 2.897 N/A ASP 195.A N GLN 192.A O no hydrogen 3.118 N/A PHE 196.A N SER 193.A O no hydrogen 3.408 N/A VAL 198.A N GLN 151.A O no hydrogen 3.086 N/A TYR 199.A N THR 216.A O no hydrogen 2.965 N/A TYR 199.A OH ASP 195.A O no hydrogen 2.454 N/A TYR 200.A N TYR 149.A O no hydrogen 2.785 N/A GLN 202.A N ALA 147.A O no hydrogen 2.896 N/A GLN 202.A NE2 GLN 203.A O no hydrogen 3.466 N/A GLN 203.A N THR 211.A O no hydrogen 2.926 N/A GLN 203.A NE2 SER 209.A O no hydrogen 3.161 N/A GLN 203.A NE2 THR 211.A OG1 no hydrogen 2.942 N/A TYR 204.A N ASN 145.A O no hydrogen 3.014 N/A ASN 205.A N GLN 203.A OE1 no hydrogen 3.011 N/A SER 209.A N ASN 206.A O no hydrogen 3.028 N/A SER 209.A OG ASN 206.A O no hydrogen 3.449 N/A ILE 210.A N PRO 208.A O no hydrogen 2.801 N/A THR 211.A OG1 ILE 115.A O no hydrogen 2.815 N/A GLY 213.A N CYS 201.A O no hydrogen 2.940 N/A THR 216.A N TYR 199.A O no hydrogen 3.091 N/A ARG 217.A N ALA 122.A O no hydrogen 2.848 N/A ARG 217.A NH1 TYR 287.A OH no hydrogen 3.484 N/A ARG 217.A NH2 TYR 287.A OH no hydrogen 3.131 N/A LEU 218.A N ALA 197.A O no hydrogen 2.792 N/A GLU 219.A N LEU 124.A O no hydrogen 2.716 N/A ILE 220.A N GLN 280.A OE1 no hydrogen 2.811 N/A LYS 221.A N VAL 126.A O no hydrogen 2.852 N/A ARG 222.A NE THR 223.A O no hydrogen 2.689 N/A ARG 222.A NH1 ASP 284.A O no hydrogen 2.873 N/A ARG 222.A NH2 THR 223.A O no hydrogen 3.098 N/A ALA 225.A N TYR 254.A O no hydrogen 2.950 N/A SER 228.A N ASN 251.A O no hydrogen 2.986 N/A PHE 230.A N LEU 249.A O no hydrogen 2.939 N/A PHE 232.A N VAL 247.A O no hydrogen 2.630 N/A GLN 238.A N SER 235.A OG no hydrogen 3.225 N/A GLN 238.A NE2 SER 245.A OG no hydrogen 2.755 N/A LEU 239.A N SER 235.A O no hydrogen 3.393 N/A SER 241.A N GLN 238.A O no hydrogen 2.796 N/A SER 241.A OG GLN 238.A O no hydrogen 2.694 N/A GLY 242.A N LEU 239.A O no hydrogen 3.015 N/A ALA 244.A N LEU 295.A O no hydrogen 2.779 N/A SER 245.A N GLN 238.A OE1 no hydrogen 2.960 N/A VAL 246.A N LEU 293.A O no hydrogen 2.888 N/A VAL 247.A N PHE 232.A O no hydrogen 3.076 N/A CYS 248.A N SER 291.A O no hydrogen 2.837 N/A CYS 248.A SG PHE 230.A O no hydrogen 3.931 N/A LEU 249.A N PHE 230.A O no hydrogen 2.690 N/A LEU 250.A N LEU 289.A O no hydrogen 2.833 N/A ASN 251.A N SER 228.A O no hydrogen 2.746 N/A ASN 252.A N SER 288.A OG no hydrogen 3.142 N/A ASN 252.A ND2 ASP 284.A OD2 no hydrogen 2.700 N/A PHE 253.A N TYR 287.A O no hydrogen 2.862 N/A TYR 254.A N ALA 225.A O no hydrogen 2.895 N/A TYR 254.A OH GLU 219.A OE2 no hydrogen 2.704 N/A TYR 254.A OH ILE 220.A O no hydrogen 3.078 N/A LYS 259.A N THR 311.A O no hydrogen 2.979 N/A GLN 261.A N GLU 309.A O no hydrogen 2.917 N/A TRP 262.A NE1 SER 291.A OG no hydrogen 2.973 N/A LYS 263.A N ALA 307.A O no hydrogen 2.810 N/A LYS 263.A NZ GLU 309.A OE2 no hydrogen 3.230 N/A VAL 264.A N ALA 267.A O no hydrogen 3.045 N/A ASP 265.A N VAL 305.A O no hydrogen 2.873 N/A ALA 267.A N VAL 264.A O no hydrogen 3.037 N/A GLN 269.A N TRP 262.A O no hydrogen 2.895 N/A GLN 269.A NE2 ALA 267.A O no hydrogen 3.121 N/A ASN 272.A ND2 GLN 269.A OE1 no hydrogen 2.853 N/A GLN 274.A N THR 292.A O no hydrogen 3.021 N/A SER 276.A N SER 290.A O no hydrogen 2.921 N/A THR 278.A N SER 288.A O no hydrogen 3.010 N/A THR 278.A OG1 GLU 279.A O no hydrogen 3.478 N/A THR 278.A OG1 SER 288.A O no hydrogen 3.477 N/A GLN 280.A NE2 ILE 220.A O no hydrogen 2.888 N/A GLN 280.A NE2 SER 285.A O no hydrogen 2.910 N/A ASP 281.A N THR 286.A O no hydrogen 2.767 N/A LYS 283.A N ASP 281.A OD2 no hydrogen 2.949 N/A ASP 284.A N ASP 281.A OD2 no hydrogen 3.028 N/A SER 285.A N ASP 281.A O no hydrogen 2.994 N/A THR 286.A N ASP 284.A OD1 no hydrogen 3.124 N/A THR 286.A OG1 ASP 284.A OD1 no hydrogen 2.517 N/A TYR 287.A N PHE 253.A O no hydrogen 2.876 N/A TYR 287.A OH GLU 219.A OE1 no hydrogen 2.573 N/A SER 288.A N THR 278.A OG1 no hydrogen 3.155 N/A LEU 289.A N LEU 250.A O no hydrogen 2.879 N/A SER 290.A N SER 276.A O no hydrogen 2.980 N/A SER 291.A N CYS 248.A O no hydrogen 3.033 N/A THR 292.A N GLN 274.A O no hydrogen 2.863 N/A LEU 293.A N VAL 246.A O no hydrogen 2.784 N/A THR 294.A N ASN 272.A O no hydrogen 2.976 N/A LEU 295.A N ALA 244.A O no hydrogen 2.867 N/A LYS 297.A N GLY 242.A O no hydrogen 3.039 N/A ASP 299.A N SER 296.A OG no hydrogen 3.166 N/A TYR 300.A N SER 296.A O no hydrogen 3.004 N/A GLU 301.A N LYS 297.A O no hydrogen 2.772 N/A LYS 302.A N ALA 298.A O no hydrogen 3.111 N/A LYS 302.A N ASP 299.A O no hydrogen 3.281 N/A HIS 303.A N TYR 300.A O no hydrogen 3.400 N/A HIS 303.A ND1 ASP 299.A O no hydrogen 2.843 N/A LYS 304.A N ASP 265.A OD1 no hydrogen 3.186 N/A LYS 304.A N ASP 265.A OD2 no hydrogen 3.007 N/A VAL 305.A N ASP 265.A OD2 no hydrogen 2.708 N/A TYR 306.A N PHE 323.A O no hydrogen 2.890 N/A TYR 306.A OH TYR 300.A O no hydrogen 2.635 N/A ALA 307.A N LYS 263.A O no hydrogen 2.839 N/A CYS 308.A N LYS 321.A O no hydrogen 3.014 N/A GLU 309.A N GLN 261.A O no hydrogen 2.840 N/A VAL 310.A N VAL 319.A O no hydrogen 2.793 N/A THR 311.A N LYS 259.A O no hydrogen 3.037 N/A HIS 312.A NE2 PRO 255.A O no hydrogen 2.888 N/A GLY 314.A N HIS 312.A ND1 no hydrogen 2.989 N/A LEU 315.A N HIS 312.A O no hydrogen 3.077 N/A SER 317.A OG PRO 318.A O no hydrogen 3.564 N/A VAL 319.A N VAL 310.A O no hydrogen 2.984 N/A LYS 321.A N CYS 308.A O no hydrogen 3.176 N/A PHE 323.A N TYR 306.A O no hydrogen 3.050 N/A ARG 325.A N LYS 304.A O no hydrogen 2.769 N/A ARG 325.A NE HIS 303.A O no hydrogen 2.609 N/A ARG 325.A NH2 HIS 303.A O no hydrogen 2.983 N/A