Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4aj2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 5.A N ALA 1.A O no hydrogen 3.095 N/A LEU 6.A N LEU 2.A O no hydrogen 2.963 N/A ILE 7.A N LYS 3.A O no hydrogen 2.800 N/A ASN 9.A ND2 LEU 11.A O no hydrogen 2.731 N/A GLN 15.A N ASP 41.A OD2 no hydrogen 2.862 N/A GLN 15.A NE2 VAL 13.A O no hydrogen 3.636 N/A ASN 16.A N ASP 41.A OD1 no hydrogen 2.913 N/A LYS 17.A NZ GLU 42.A OE2 no hydrogen 2.874 N/A LYS 17.A NZ VAL 80.A O no hydrogen 2.650 N/A LYS 17.A NZ ALA 82.A O no hydrogen 2.789 N/A ILE 18.A N GLU 42.A O no hydrogen 3.017 N/A THR 19.A N LEU 86.A O no hydrogen 3.013 N/A THR 19.A OG1 SER 84.A OG no hydrogen 2.707 N/A VAL 20.A N ALA 44.A O no hydrogen 2.886 N/A VAL 21.A N ILE 88.A O no hydrogen 2.767 N/A GLY 22.A N VAL 46.A O no hydrogen 2.743 N/A VAL 23.A N ASP 47.A OD2 no hydrogen 2.906 N/A MET 28.A N GLY 24.A O no hydrogen 2.977 N/A ALA 29.A N ALA 25.A O no hydrogen 3.087 N/A CYS 30.A N VAL 26.A O no hydrogen 2.963 N/A CYS 30.A SG VAL 26.A O no hydrogen 3.269 N/A ALA 31.A N GLY 27.A O no hydrogen 2.846 N/A ILE 32.A N MET 28.A O no hydrogen 2.878 N/A SER 33.A N ALA 29.A O no hydrogen 3.049 N/A SER 33.A OG ALA 29.A O no hydrogen 2.932 N/A ILE 34.A N CYS 30.A O no hydrogen 2.928 N/A LEU 35.A N ALA 31.A O no hydrogen 2.963 N/A MET 36.A N ILE 32.A O no hydrogen 2.967 N/A LYS 37.A N SER 33.A O no hydrogen 3.094 N/A LYS 37.A N ILE 34.A O no hydrogen 3.339 N/A LYS 37.A NZ GLU 256.A OE1 no hydrogen 3.142 N/A ASP 38.A N LEU 35.A O no hydrogen 3.448 N/A ASP 41.A N ASN 16.A O no hydrogen 3.110 N/A LEU 43.A N LYS 71.A O no hydrogen 2.930 N/A ALA 44.A N ILE 18.A O no hydrogen 3.027 N/A LEU 45.A N VAL 73.A O no hydrogen 2.907 N/A VAL 46.A N VAL 20.A O no hydrogen 3.048 N/A VAL 48.A N ASP 47.A OD1 no hydrogen 2.646 N/A LYS 52.A NZ GLU 56.A OE2 no hydrogen 2.848 N/A LEU 53.A N ILE 49.A O.A no hydrogen 2.953 N/A LEU 53.A N ILE 49.A O.B no hydrogen 2.944 N/A LYS 54.A N GLU 50.A O no hydrogen 3.030 N/A GLY 55.A N ASP 51.A O no hydrogen 2.868 N/A GLU 56.A N LYS 52.A O no hydrogen 2.993 N/A MET 57.A N LEU 53.A O no hydrogen 3.044 N/A MET 58.A N LYS 54.A O no hydrogen 2.910 N/A ASP 59.A N GLY 55.A O no hydrogen 2.936 N/A LEU 60.A N GLU 56.A O no hydrogen 2.977 N/A GLN 61.A N MET 57.A O no hydrogen 2.756 N/A GLN 61.A NE2 ILE 72.A O no hydrogen 2.885 N/A HIS 62.A N MET 58.A O no hydrogen 2.910 N/A GLY 63.A N LEU 60.A O no hydrogen 3.045 N/A SER 64.A N GLN 61.A O no hydrogen 2.986 N/A SER 64.A OG GLN 61.A O no hydrogen 2.720 N/A PHE 66.A N GLY 63.A O no hydrogen 2.873 N/A LEU 67.A N SER 64.A O no hydrogen 3.032 N/A THR 69.A OG1 ALA 40.A O no hydrogen 3.276 N/A VAL 73.A N LEU 43.A O no hydrogen 2.874 N/A SER 75.A N LEU 45.A O no hydrogen 3.154 N/A LYS 76.A NZ GLU 50.A OE2 no hydrogen 3.440 N/A ASP 77.A N SER 75.A OG no hydrogen 2.991 N/A SER 79.A N ASP 77.A OD1 no hydrogen 3.010 N/A SER 79.A OG ASP 77.A OD1 no hydrogen 3.111 N/A VAL 80.A N ASP 77.A O no hydrogen 3.183 N/A THR 81.A N TYR 78.A O no hydrogen 2.854 N/A THR 81.A OG1 TYR 78.A O no hydrogen 2.558 N/A ALA 82.A N SER 79.A O no hydrogen 3.224 N/A SER 84.A N SER 123.A OG no hydrogen 3.022 N/A SER 84.A OG THR 19.A OG1 no hydrogen 2.707 N/A SER 84.A OG THR 81.A O no hydrogen 2.632 N/A LYS 85.A N LYS 17.A O no hydrogen 2.833 N/A LYS 85.A NZ GLN 15.A O no hydrogen 3.307 N/A LEU 86.A N LYS 17.A O no hydrogen 3.494 N/A VAL 87.A N LYS 127.A O no hydrogen 2.914 N/A ILE 88.A N THR 19.A O no hydrogen 2.813 N/A ILE 89.A N LEU 129.A O no hydrogen 2.868 N/A THR 90.A N VAL 21.A O no hydrogen 2.859 N/A THR 90.A OG1 VAL 21.A O no hydrogen 2.943 N/A THR 90.A OG1 GLY 22.A O no hydrogen 3.123 N/A ALA 93.A N ASN 108.A OD1 no hydrogen 2.820 N/A GLN 95.A NE2 GLU 99.A O no hydrogen 3.002 N/A GLN 96.A NE2 ARG 94.A O no hydrogen 2.962 N/A GLU 99.A N GLN 96.A O no hydrogen 3.096 N/A LEU 102.A N SER 100.A OG no hydrogen 3.010 N/A ASN 103.A N SER 100.A O no hydrogen 3.278 N/A ASN 103.A ND2 GLU 99.A OE1 no hydrogen 2.927 N/A LEU 104.A N ARG 101.A O no hydrogen 3.159 N/A VAL 105.A N LEU 102.A O no hydrogen 3.460 N/A GLN 106.A NE2 GLN 106.A O no hydrogen 3.249 N/A GLN 106.A NE2 ASN 110.A OD1 no hydrogen 3.110 N/A ARG 107.A NH2 ASN 103.A O no hydrogen 2.875 N/A ASN 108.A N LEU 104.A O no hydrogen 3.152 N/A ASN 108.A ND2 ALA 93.A O no hydrogen 3.028 N/A ASN 108.A ND2 ASN 133.A O no hydrogen 2.724 N/A VAL 109.A N VAL 105.A O no hydrogen 2.888 N/A ASN 110.A N GLN 106.A O no hydrogen 3.018 N/A ILE 111.A N ARG 107.A O no hydrogen 3.113 N/A PHE 112.A N ASN 108.A O no hydrogen 2.902 N/A LYS 113.A N VAL 109.A O no hydrogen 3.085 N/A PHE 114.A N ILE 111.A O no hydrogen 3.009 N/A ILE 115.A N ILE 111.A O no hydrogen 2.943 N/A ILE 116.A N PHE 112.A O no hydrogen 3.085 N/A VAL 119.A N ILE 115.A O no hydrogen 2.932 N/A VAL 120.A N ILE 116.A O no hydrogen 2.836 N/A LYS 121.A N PRO 117.A O no hydrogen 3.010 N/A TYR 122.A N VAL 119.A O no hydrogen 3.286 N/A SER 123.A N VAL 119.A O no hydrogen 3.023 N/A CYS 126.A N SER 123.A O no hydrogen 3.189 N/A CYS 126.A SG SER 123.A O no hydrogen 3.325 N/A CYS 126.A SG LYS 127.A O no hydrogen 3.788 N/A LYS 127.A N LYS 85.A O no hydrogen 2.924 N/A LYS 127.A NZ LYS 85.A O no hydrogen 3.519 N/A LYS 127.A NZ GLN 292.A O no hydrogen 2.866 N/A LEU 128.A N ARG 152.A O no hydrogen 2.768 N/A LEU 129.A N VAL 87.A O no hydrogen 2.864 N/A ILE 130.A N ILE 154.A O no hydrogen 2.723 N/A VAL 131.A N ILE 89.A O no hydrogen 2.869 N/A SER 132.A N ILE 89.A O no hydrogen 3.144 N/A SER 132.A OG ILE 89.A O no hydrogen 3.133 N/A SER 132.A OG ALA 91.A O no hydrogen 2.660 N/A VAL 135.A N ASN 133.A OD1 no hydrogen 3.233 N/A LEU 138.A N PRO 134.A O no hydrogen 2.978 N/A THR 139.A N VAL 135.A O no hydrogen 2.974 N/A THR 139.A OG1 VAL 135.A O no hydrogen 2.604 N/A TYR 140.A N ASP 136.A O no hydrogen 3.383 N/A VAL 141.A N ILE 137.A O no hydrogen 2.890 N/A ALA 142.A N LEU 138.A O no hydrogen 2.813 N/A TRP 143.A N THR 139.A O no hydrogen 2.900 N/A LYS 144.A N TYR 140.A O no hydrogen 2.942 N/A ILE 145.A N VAL 141.A O no hydrogen 2.930 N/A SER 146.A N ALA 142.A O no hydrogen 2.805 N/A SER 146.A OG ALA 142.A O no hydrogen 2.918 N/A SER 146.A OG TRP 143.A O no hydrogen 3.166 N/A GLY 147.A N TRP 143.A O no hydrogen 3.263 N/A PHE 148.A N SER 146.A OG no hydrogen 3.031 N/A ASN 151.A ND2 ASN 293.A O no hydrogen 2.785 N/A ARG 152.A N PRO 149.A O no hydrogen 3.014 N/A ARG 152.A NH1 PRO 124.A O no hydrogen 3.116 N/A ARG 152.A NH1 CYS 126.A O no hydrogen 2.763 N/A VAL 153.A N LYS 150.A O no hydrogen 3.215 N/A ILE 154.A N LEU 128.A O no hydrogen 2.825 N/A GLY 155.A N SER 269.A O no hydrogen 3.229 N/A SER 156.A N ILE 130.A O no hydrogen 2.818 N/A SER 156.A OG ILE 130.A O no hydrogen 3.377 N/A CYS 158.A N SER 285.A OG no hydrogen 2.864 N/A CYS 158.A SG GLY 186.A O no hydrogen 3.551 N/A CYS 158.A SG GLU 187.A O no hydrogen 3.593 N/A ASN 159.A N SER 156.A O no hydrogen 3.231 N/A ASN 159.A ND2 SER 250.A O no hydrogen 3.361 N/A ASN 159.A ND2 SER 250.A OG no hydrogen 3.075 N/A ASN 159.A ND2 ASP 253.A OD2 no hydrogen 3.013 N/A SER 162.A N CYS 158.A O no hydrogen 2.923 N/A SER 162.A OG CYS 158.A O no hydrogen 3.072 N/A ALA 163.A N ASN 159.A O no hydrogen 3.106 N/A ARG 164.A N LEU 160.A O no hydrogen 2.805 N/A PHE 165.A N ASP 161.A O no hydrogen 2.898 N/A ARG 166.A N SER 162.A O no hydrogen 2.920 N/A ARG 166.A NE PRO 177.A O no hydrogen 3.287 N/A ARG 166.A NE CYS 180.A O no hydrogen 2.795 N/A ARG 166.A NH2 PRO 177.A O no hydrogen 3.135 N/A TYR 167.A N ALA 163.A O no hydrogen 2.888 N/A LEU 168.A N ARG 164.A O no hydrogen 2.976 N/A MET 169.A N PHE 165.A O no hydrogen 2.936 N/A GLY 170.A N ARG 166.A O no hydrogen 2.891 N/A GLU 171.A N TYR 167.A O no hydrogen 2.816 N/A ARG 172.A N LEU 168.A O no hydrogen 3.012 N/A LEU 173.A N MET 169.A O no hydrogen 2.889 N/A GLY 174.A N GLY 170.A O no hydrogen 2.798 N/A VAL 175.A N GLY 170.A O no hydrogen 3.033 N/A LEU 178.A N HIS 176.A ND1 no hydrogen 3.017 N/A SER 179.A N HIS 176.A O no hydrogen 2.923 N/A CYS 180.A N PRO 177.A O no hydrogen 3.153 N/A CYS 180.A SG.A VAL 175.A O no hydrogen 3.995 N/A CYS 180.A SG.A HIS 176.A O no hydrogen 3.699 N/A HIS 181.A N ASN 200.A O no hydrogen 2.864 N/A VAL 184.A N SER 162.A OG no hydrogen 3.080 N/A LEU 185.A N VAL 193.A O no hydrogen 2.887 N/A GLY 186.A N SER 285.A O no hydrogen 2.917 N/A GLU 187.A N SER 314.A OG no hydrogen 2.913 N/A HIS 188.A N ASP 136.A OD2 no hydrogen 2.803 N/A HIS 188.A ND1 ASP 161.A OD1 no hydrogen 2.565 N/A SER 191.A N GLU 187.A OE1 no hydrogen 3.075 N/A SER 191.A OG GLU 187.A OE1 no hydrogen 2.647 N/A SER 191.A OG SER 314.A OG no hydrogen 2.805 N/A SER 192.A N GLY 189.A O no hydrogen 3.218 N/A SER 192.A OG GLY 189.A O no hydrogen 3.551 N/A SER 192.A OG HIS 226.A NE2 no hydrogen 2.633 N/A VAL 193.A N LEU 185.A O no hydrogen 2.740 N/A VAL 195.A N TRP 183.A O no hydrogen 2.831 N/A SER 197.A N GLU 307.A OE2 no hydrogen 2.838 N/A SER 197.A OG GLU 307.A OE1 no hydrogen 2.716 N/A SER 197.A OG GLU 307.A OE2 no hydrogen 3.225 N/A GLY 198.A N VAL 195.A O no hydrogen 2.964 N/A VAL 199.A N TRP 196.A O no hydrogen 3.250 N/A ASN 200.A N HIS 181.A O no hydrogen 2.888 N/A ASN 200.A ND2 GLY 198.A O no hydrogen 2.937 N/A VAL 201.A N VAL 204.A O no hydrogen 3.236 N/A GLY 203.A N ASN 200.A OD1 no hydrogen 3.121 N/A VAL 204.A N VAL 201.A O no hydrogen 2.922 N/A LEU 206.A N VAL 199.A O no hydrogen 3.071 N/A LYS 207.A NZ PRO 211.A O no hydrogen 2.903 N/A SER 208.A N SER 205.A O no hydrogen 3.147 N/A SER 208.A N SER 205.A OG no hydrogen 3.275 N/A SER 208.A OG SER 205.A O no hydrogen 2.540 N/A LEU 209.A N LEU 206.A O no hydrogen 3.097 N/A ASN 210.A N LEU 206.A O no hydrogen 2.989 N/A ASN 210.A N LYS 207.A O no hydrogen 3.253 N/A ASN 210.A ND2 ASP 218.A OD1 no hydrogen 2.864 N/A LEU 213.A N ASN 210.A O no hydrogen 2.842 N/A GLY 214.A N ASP 218.A OD2 no hydrogen 2.995 N/A THR 215.A N GLN 212.A O no hydrogen 2.973 N/A THR 215.A OG1 GLN 212.A O no hydrogen 2.643 N/A ALA 217.A N THR 215.A OG1 no hydrogen 3.258 N/A ASP 218.A N THR 215.A O no hydrogen 3.148 N/A GLU 220.A N ASP 218.A OD1 no hydrogen 3.088 N/A GLN 221.A N ASP 218.A O no hydrogen 2.839 N/A GLN 221.A NE2 ASP 216.A O no hydrogen 2.822 N/A GLN 221.A NE2 ASP 218.A O no hydrogen 2.651 N/A TRP 222.A N ASP 218.A OD2 no hydrogen 2.965 N/A TRP 222.A NE1 GLU 220.A OE1 no hydrogen 3.212 N/A LYS 223.A NZ ASP 216.A OD1 no hydrogen 2.780 N/A ASP 224.A N GLN 221.A O no hydrogen 3.034 N/A VAL 225.A N TRP 222.A O no hydrogen 2.891 N/A HIS 226.A NE2 SER 192.A OG no hydrogen 2.633 N/A LYS 227.A N LYS 223.A O no hydrogen 2.940 N/A LYS 227.A NZ ASP 231.A OD2 no hydrogen 2.600 N/A GLN 228.A N ASP 224.A O no hydrogen 2.937 N/A VAL 229.A N VAL 225.A O no hydrogen 3.065 N/A VAL 230.A N HIS 226.A O no hydrogen 2.884 N/A ASP 231.A N LYS 227.A O no hydrogen 2.884 N/A SER 232.A OG VAL 229.A O no hydrogen 2.650 N/A TYR 234.A OH ASP 190.A OD1 no hydrogen 2.666 N/A GLU 235.A N ASP 231.A O no hydrogen 2.964 N/A VAL 236.A N SER 232.A O no hydrogen 2.932 N/A ILE 237.A N ALA 233.A O no hydrogen 2.807 N/A LYS 238.A N TYR 234.A O no hydrogen 2.949 N/A LEU 239.A N GLU 235.A O no hydrogen 2.914 N/A LYS 240.A N VAL 236.A O no hydrogen 2.816 N/A LYS 240.A NZ SER 244.A OG no hydrogen 2.998 N/A GLY 241.A N ILE 237.A O no hydrogen 2.764 N/A GLY 248.A N SER 244.A O no hydrogen 2.949 N/A LEU 249.A N TRP 245.A O no hydrogen 3.112 N/A SER 250.A N ALA 246.A O no hydrogen 2.875 N/A VAL 251.A N ILE 247.A O no hydrogen 2.829 N/A ALA 252.A N GLY 248.A O no hydrogen 2.948 N/A ASP 253.A N LEU 249.A O no hydrogen 2.907 N/A LEU 254.A N SER 250.A O no hydrogen 3.130 N/A ALA 255.A N VAL 251.A O no hydrogen 2.851 N/A GLU 256.A N ALA 252.A O no hydrogen 2.847 N/A SER 257.A N ASP 253.A O no hydrogen 3.271 N/A SER 257.A OG HIS 266.A NE2 no hydrogen 2.737 N/A ILE 258.A N LEU 254.A O no hydrogen 3.006 N/A MET 259.A N ALA 255.A O no hydrogen 2.781 N/A LYS 260.A N GLU 256.A O no hydrogen 2.916 N/A ASN 261.A N ILE 258.A O no hydrogen 3.247 N/A LEU 262.A N SER 257.A O no hydrogen 2.937 N/A ARG 263.A NH1 SER 296.A OG no hydrogen 2.896 N/A ARG 263.A NH2 ASP 297.A OD1 no hydrogen 3.096 N/A ARG 264.A NE SER 257.A OG no hydrogen 2.954 N/A ARG 264.A NH1 ASP 253.A OD1 no hydrogen 3.050 N/A ARG 264.A NH2 ASP 253.A OD1 no hydrogen 3.001 N/A ARG 264.A NH2 SER 257.A OG no hydrogen 2.909 N/A HIS 266.A N CYS 288.A O no hydrogen 2.878 N/A HIS 266.A ND1 ASN 159.A OD1 no hydrogen 2.917 N/A HIS 266.A NE2 SER 257.A OG no hydrogen 2.737 N/A ILE 268.A N VAL 286.A O no hydrogen 3.342 N/A SER 269.A N GLY 155.A O no hydrogen 2.916 N/A SER 269.A OG ASP 136.A OD1 no hydrogen 2.740 N/A THR 270.A N LEU 284.A O no hydrogen 3.092 N/A ILE 272.A N VAL 282.A O no hydrogen 3.005 N/A LYS 273.A NZ ASP 281.A OD1 no hydrogen 2.833 N/A GLY 274.A N ILE 278.A O no hydrogen 2.607 N/A LEU 275.A N ILE 272.A O no hydrogen 3.079 N/A ILE 278.A N LEU 275.A O no hydrogen 2.899 N/A LEU 284.A N THR 270.A O no hydrogen 3.076 N/A SER 285.A N GLY 186.A O no hydrogen 3.061 N/A CYS 288.A N HIS 266.A O no hydrogen 2.795 N/A CYS 288.A SG ILE 268.A O no hydrogen 4.000 N/A CYS 288.A SG VAL 286.A O no hydrogen 3.448 N/A ILE 289.A N ASP 297.A O no hydrogen 2.912 N/A LEU 290.A N ARG 264.A O no hydrogen 2.980 N/A GLY 291.A N GLY 294.A O no hydrogen 3.022 N/A GLN 292.A N ASN 261.A OD1 no hydrogen 2.905 N/A GLY 294.A N GLY 291.A O no hydrogen 3.062 N/A ILE 295.A N ASN 151.A O no hydrogen 2.908 N/A SER 296.A N ILE 289.A O no hydrogen 3.267 N/A SER 296.A OG ASP 297.A OD1 no hydrogen 2.529 N/A VAL 299.A N PRO 287.A O no hydrogen 2.799 N/A THR 304.A N GLU 307.A OE1 no hydrogen 2.923 N/A GLU 307.A N THR 304.A OG1 no hydrogen 3.170 N/A GLU 308.A N THR 304.A O no hydrogen 2.690 N/A ALA 309.A N PRO 305.A O no hydrogen 2.850 N/A ARG 310.A N ASP 306.A O no hydrogen 3.020 N/A ARG 310.A NE ASP 306.A OD1 no hydrogen 2.740 N/A LEU 311.A N GLU 307.A O no hydrogen 2.912 N/A LYS 312.A N GLU 308.A O no hydrogen 3.021 N/A LYS 312.A NZ GLU 308.A OE2 no hydrogen 2.793 N/A LYS 313.A N ALA 309.A O no hydrogen 3.042 N/A SER 314.A N ARG 310.A O no hydrogen 2.971 N/A SER 314.A OG SER 191.A O no hydrogen 3.318 N/A SER 314.A OG SER 191.A OG no hydrogen 2.805 N/A ALA 315.A N LEU 311.A O no hydrogen 2.919 N/A ASP 316.A N LYS 312.A O no hydrogen 2.799 N/A THR 317.A N LYS 313.A O no hydrogen 2.971 N/A THR 317.A OG1 LYS 313.A O no hydrogen 3.049 N/A LEU 318.A N SER 314.A O no hydrogen 3.110 N/A TRP 319.A N ALA 315.A O no hydrogen 2.968 N/A GLY 320.A N ASP 316.A O no hydrogen 2.881 N/A ILE 321.A N THR 317.A O no hydrogen 3.339 N/A GLN 322.A N LEU 318.A O no hydrogen 2.875 N/A GLN 322.A NE2 ASP 281.A O no hydrogen 3.039 N/A LYS 323.A N TRP 319.A O no hydrogen 2.849 N/A GLU 324.A N ILE 321.A O no hydrogen 3.301 N/A LEU 325.A N GLN 322.A O no hydrogen 3.384 N/A