Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3aj5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 1.A OG1 GLU 189.A OE1 no hydrogen 3.344 N/A THR 1.A OG1 GLU 189.A OE2 no hydrogen 2.520 N/A ASN 2.A N GLU 189.A OE1 no hydrogen 2.914 N/A ASN 2.A ND2 GLU 189.A O no hydrogen 2.987 N/A ALA 3.A N THR 1.A OG1 no hydrogen 3.068 N/A ASP 5.A N ASN 2.A O no hydrogen 3.206 N/A ARG 7.A N ASP 5.A O no hydrogen 2.704 N/A ARG 7.A NH1 ASN 2.A O no hydrogen 2.702 N/A ARG 7.A NH2 ASN 2.A O no hydrogen 3.064 N/A ARG 7.A NH2 ASN 2.A OD1 no hydrogen 3.375 N/A ASN 9.A N LEU 47.A O no hydrogen 2.796 N/A PHE 12.A N TRP 45.A O no hydrogen 2.753 N/A PHE 13.A N SER 137.A O no hydrogen 2.825 N/A SER 15.A N LYS 135.A O no hydrogen 2.834 N/A SER 15.A OG LYS 22.A O no hydrogen 2.867 N/A SER 17.A N PHE 133.A O no hydrogen 2.947 N/A SER 17.A OG TYR 115.A OH no hydrogen 3.333 N/A SER 17.A OG SER 130.A O no hydrogen 3.139 N/A SER 17.A OG PHE 133.A O no hydrogen 3.346 N/A ASN 18.A N TYR 115.A OH no hydrogen 3.361 N/A ASN 19.A N PRO 16.A O no hydrogen 3.181 N/A ASN 21.A N ASN 19.A OD1 no hydrogen 3.029 N/A ASN 21.A ND2 ASN 19.A OD1 no hydrogen 3.517 N/A LYS 22.A N ASN 19.A O no hydrogen 3.198 N/A LYS 22.A NZ ASP 119.A OD1 no hydrogen 2.986 N/A LYS 22.A NZ ASP 119.A OD2 no hydrogen 3.322 N/A VAL 23.A N TRP 35.A O no hydrogen 2.869 N/A LEU 24.A N ILE 14.A O no hydrogen 2.755 N/A ASP 25.A N LYS 33.A O no hydrogen 2.792 N/A LYS 26.A N ASN 42.A O no hydrogen 2.956 N/A LYS 26.A NZ SER 28.A O no hydrogen 3.072 N/A LYS 26.A NZ GLN 29.A OE1 no hydrogen 3.130 N/A LYS 26.A NZ ASP 62.A OD2 no hydrogen 2.772 N/A ILE 27.A N GLU 31.A O no hydrogen 2.973 N/A SER 30.A N SER 28.A OG no hydrogen 3.250 N/A SER 30.A OG GLU 31.A OE2 no hydrogen 2.314 N/A GLU 31.A N SER 28.A OG no hydrogen 2.890 N/A LYS 33.A N ASP 25.A O no hydrogen 2.955 N/A LEU 34.A N ASP 119.A O no hydrogen 2.857 N/A TRP 35.A N VAL 23.A O no hydrogen 2.933 N/A LYS 37.A N ASN 21.A O no hydrogen 2.841 N/A LYS 37.A NZ GLU 142.A OE1 no hydrogen 2.893 N/A LYS 37.A NZ GLU 142.A OE2 no hydrogen 2.953 N/A LEU 38.A N GLN 43.A OE1 no hydrogen 2.755 N/A SER 39.A N GLN 43.A OE1 no hydrogen 2.946 N/A ASN 42.A ND2 LYS 26.A O no hydrogen 3.137 N/A GLN 43.A N GLY 40.A O no hydrogen 2.929 N/A GLN 43.A NE2 ASP 25.A OD2 no hydrogen 2.960 N/A GLN 43.A NE2 ASN 36.A O no hydrogen 2.939 N/A LYS 44.A N ALA 41.A O no hydrogen 3.172 N/A LYS 44.A NZ TYR 232.A OH no hydrogen 2.999 N/A TRP 45.A N PHE 12.A O no hydrogen 2.961 N/A TRP 45.A NE1 LEU 24.A O no hydrogen 3.083 N/A ARG 46.A N LYS 59.A O no hydrogen 2.768 N/A ARG 46.A NE ASP 234.A O no hydrogen 3.083 N/A ARG 46.A NH1 ASN 9.A OD1 no hydrogen 2.979 N/A ARG 46.A NH1 ASN 231.A OD1 no hydrogen 2.996 N/A ARG 46.A NH2 TYR 232.A O no hydrogen 3.031 N/A ARG 46.A NH2 LEU 233.A O no hydrogen 2.931 N/A ARG 46.A NH2 ASP 234.A O no hydrogen 3.484 N/A LEU 47.A N GLU 10.A O no hydrogen 2.987 N/A ILE 48.A N LYS 57.A O no hydrogen 3.008 N/A TYR 49.A N ASN 8.A OD1 no hydrogen 2.796 N/A ASP 50.A N ALA 55.A O no hydrogen 2.840 N/A LYS 53.A N ASP 50.A OD1 no hydrogen 2.979 N/A GLN 54.A N THR 51.A O no hydrogen 3.252 N/A ALA 55.A N ASP 50.A O no hydrogen 3.319 N/A TYR 56.A N TRP 90.A O no hydrogen 2.817 N/A TYR 56.A OH LEU 6.A O no hydrogen 2.743 N/A LYS 57.A N ILE 48.A O no hydrogen 2.877 N/A LYS 57.A NZ ASP 82.A OD1 no hydrogen 3.144 N/A LYS 57.A NZ ASP 82.A OD2 no hydrogen 2.630 N/A LYS 57.A NZ ASN 84.A OD1 no hydrogen 2.752 N/A LYS 59.A N ARG 46.A O no hydrogen 2.913 N/A LYS 59.A NZ ASP 234.A O no hydrogen 2.857 N/A LYS 59.A NZ ASN 235.A OD1 no hydrogen 3.113 N/A VAL 60.A N LEU 66.A O no hydrogen 2.976 N/A MET 61.A N LYS 44.A O no hydrogen 2.910 N/A THR 64.A N ASP 62.A OD1 no hydrogen 3.022 N/A THR 64.A OG1 ASP 62.A OD1 no hydrogen 2.605 N/A ILE 67.A N LYS 80.A O no hydrogen 2.939 N/A LEU 68.A N ILE 58.A O no hydrogen 2.936 N/A THR 69.A N SER 78.A O no hydrogen 2.793 N/A THR 69.A OG1 ILE 67.A O no hydrogen 2.832 N/A TRP 70.A N ASN 87.A O no hydrogen 3.123 N/A TRP 70.A NE1 LEU 74.A O no hydrogen 2.659 N/A ASN 71.A N SER 76.A O no hydrogen 2.987 N/A ASN 71.A ND2 SER 78.A OG no hydrogen 2.838 N/A LEU 74.A N ASN 71.A O no hydrogen 2.887 N/A SER 76.A OG ASN 71.A OD1 no hydrogen 2.977 N/A SER 78.A N THR 69.A O no hydrogen 2.885 N/A VAL 79.A N SER 30.A O no hydrogen 2.945 N/A LYS 80.A N ILE 67.A O no hydrogen 3.089 N/A THR 83.A N GLN 88.A OE1 no hydrogen 2.999 N/A THR 83.A OG1 GLN 88.A OE1 no hydrogen 3.498 N/A ASN 84.A N ASP 82.A OD1 no hydrogen 2.834 N/A GLY 85.A N GLN 88.A OE1 no hydrogen 3.069 N/A ASN 87.A ND2 TRP 70.A O no hydrogen 2.794 N/A GLN 88.A N GLY 85.A O no hydrogen 2.911 N/A GLN 88.A NE2 THR 69.A OG1 no hydrogen 2.990 N/A GLN 88.A NE2 THR 81.A O no hydrogen 2.981 N/A TYR 89.A N ASP 86.A O no hydrogen 3.381 N/A TRP 90.A N TYR 56.A O no hydrogen 2.823 N/A TRP 90.A NE1 LEU 68.A O no hydrogen 2.992 N/A TYR 91.A N ARG 104.A O no hydrogen 2.745 N/A LEU 93.A N ILE 102.A O no hydrogen 3.156 N/A GLN 94.A NE2 ARG 99.A O no hydrogen 2.880 N/A ASN 95.A N ASN 100.A O no hydrogen 2.857 N/A ILE 97.A N ASN 95.A OD1 no hydrogen 2.974 N/A SER 98.A N ASN 95.A OD1 no hydrogen 2.907 N/A ARG 99.A N ASN 95.A O no hydrogen 2.855 N/A ARG 99.A NH1 TYR 96.A O no hydrogen 2.927 N/A ASN 100.A N SER 98.A OG no hydrogen 3.202 N/A VAL 101.A N PHE 134.A O no hydrogen 2.729 N/A ILE 102.A N LEU 93.A O no hydrogen 2.901 N/A ARG 104.A N TYR 91.A O no hydrogen 2.954 N/A ARG 104.A NH1 PRO 109.A O no hydrogen 2.805 N/A ARG 104.A NH1 GLN 126.A OE1 no hydrogen 3.362 N/A ARG 104.A NH2 GLN 126.A OE1 no hydrogen 2.692 N/A ASN 105.A N LEU 111.A O no hydrogen 2.850 N/A ASN 105.A ND2 ASN 87.A O no hydrogen 3.123 N/A TYR 106.A N TYR 89.A O no hydrogen 2.917 N/A MET 107.A N ASN 105.A OD1 no hydrogen 2.859 N/A ASN 108.A N ASN 105.A OD1 no hydrogen 3.340 N/A ASN 110.A N ASN 108.A OD1 no hydrogen 2.992 N/A ASN 110.A ND2 ASN 108.A OD1 no hydrogen 3.247 N/A LEU 111.A N ASN 108.A O no hydrogen 2.894 N/A VAL 112.A N SER 124.A O no hydrogen 2.868 N/A LEU 113.A N ILE 103.A O no hydrogen 2.755 N/A GLN 114.A N MET 122.A O no hydrogen 2.801 N/A GLN 114.A NE2 ASN 116.A OD1 no hydrogen 3.014 N/A TYR 115.A N ASN 131.A O no hydrogen 2.961 N/A TYR 115.A OH SER 17.A OG no hydrogen 3.333 N/A TYR 115.A OH SER 130.A O no hydrogen 2.832 N/A ASN 116.A N THR 120.A O no hydrogen 2.884 N/A ASN 116.A ND2 THR 120.A OG1 no hydrogen 3.066 N/A ASP 119.A N ASN 116.A O no hydrogen 2.915 N/A THR 120.A N ASP 118.A OD1 no hydrogen 3.059 N/A THR 120.A OG1 ASP 118.A OD1 no hydrogen 2.644 N/A MET 122.A N GLN 114.A O no hydrogen 3.023 N/A VAL 123.A N SER 75.A O no hydrogen 2.837 N/A SER 124.A N VAL 112.A O no hydrogen 2.954 N/A SER 124.A OG GLN 114.A OE1 no hydrogen 3.309 N/A SER 124.A OG THR 125.A O no hydrogen 3.008 N/A THR 127.A N GLN 132.A OE1 no hydrogen 2.912 N/A THR 127.A OG1 SER 129.A OG no hydrogen 2.548 N/A SER 129.A N THR 127.A OG1 no hydrogen 3.182 N/A SER 129.A OG THR 127.A OG1 no hydrogen 2.548 N/A SER 129.A OG ASN 131.A OD1 no hydrogen 2.734 N/A GLN 132.A N SER 129.A O no hydrogen 3.197 N/A GLN 132.A NE2 GLN 114.A OE1 no hydrogen 2.976 N/A GLN 132.A NE2 THR 125.A O no hydrogen 2.977 N/A PHE 133.A N SER 130.A O no hydrogen 3.078 N/A PHE 134.A N VAL 101.A O no hydrogen 2.940 N/A LYS 135.A N SER 15.A O no hydrogen 2.815 N/A LYS 135.A NZ SER 98.A O no hydrogen 3.049 N/A LYS 135.A NZ ASN 100.A OD1 no hydrogen 2.698 N/A SER 137.A N PHE 13.A O no hydrogen 2.881 N/A ASN 138.A N ASN 4.A OD1 no hydrogen 2.814 N/A ASN 138.A ND2 GLU 10.A OE1 no hydrogen 2.945 N/A CYS 139.A N VAL 11.A O no hydrogen 3.019 N/A CYS 139.A SG VAL 11.A O no hydrogen 3.586 N/A TYR 141.A N ASN 138.A OD1 no hydrogen 2.998 N/A GLU 142.A N ASN 138.A O no hydrogen 3.101 N/A ALA 143.A N CYS 139.A O no hydrogen 2.982 N/A LEU 144.A N ILE 140.A O no hydrogen 2.865 N/A ASN 145.A N TYR 141.A O no hydrogen 3.211 N/A ARG 147.A N LEU 144.A O no hydrogen 3.110 N/A ASN 148.A ND2 GLN 199.A OE1.A no hydrogen 3.394 N/A CYS 149.A N TRP 183.A O no hydrogen 2.807 N/A CYS 149.A SG ARG 147.A O no hydrogen 3.673 N/A LYS 150.A N ASN 281.A O no hydrogen 2.820 N/A GLN 152.A N ILE 279.A O no hydrogen 2.922 N/A GLN 152.A NE2 THR 153.A O no hydrogen 2.863 N/A GLN 152.A NE2 ASN 156.A O no hydrogen 3.293 N/A THR 153.A N ARG 159.A O no hydrogen 2.980 N/A GLN 154.A N GLN 277.A O no hydrogen 2.966 N/A LEU 155.A N THR 153.A OG1 no hydrogen 3.051 N/A ASN 156.A N THR 153.A O no hydrogen 3.218 N/A ASP 158.A N ASN 156.A OD1 no hydrogen 2.857 N/A ARG 159.A N ASN 156.A O no hydrogen 3.234 N/A ARG 159.A NE ILE 259.A O no hydrogen 2.740 N/A ARG 159.A NH1 ASP 158.A O no hydrogen 2.895 N/A PHE 160.A N TRP 173.A O no hydrogen 2.779 N/A LEU 161.A N LEU 151.A O no hydrogen 2.780 N/A SER 162.A N VAL 171.A O no hydrogen 2.867 N/A SER 162.A OG PHE 160.A O no hydrogen 2.830 N/A LYS 163.A N ARG 180.A O no hydrogen 2.910 N/A LYS 163.A NZ ASN 164.A O no hydrogen 2.888 N/A LYS 163.A NZ SER 167.A O no hydrogen 2.859 N/A ASN 164.A N ILE 169.A O no hydrogen 2.792 N/A ILE 169.A N SER 167.A OG no hydrogen 2.993 N/A ILE 170.A N VAL 215.A O no hydrogen 3.041 N/A VAL 171.A N SER 162.A O no hydrogen 2.733 N/A LEU 172.A N THR 263.A O no hydrogen 2.885 N/A TRP 173.A N PHE 160.A O no hydrogen 2.957 N/A GLN 174.A N ASN 261.A OD1 no hydrogen 2.817 N/A TRP 175.A N ASP 158.A OD1 no hydrogen 2.913 N/A PHE 176.A N GLN 181.A OE1 no hydrogen 2.956 N/A SER 178.A N GLN 181.A OE1 no hydrogen 3.388 N/A ARG 180.A N SER 178.A OG no hydrogen 3.127 N/A ARG 180.A NH1 LYS 163.A O no hydrogen 2.951 N/A GLN 181.A N SER 178.A O no hydrogen 2.843 N/A GLN 181.A NE2 SER 162.A OG no hydrogen 3.086 N/A GLN 181.A NE2 GLN 174.A O no hydrogen 2.817 N/A LYS 182.A N SER 179.A O no hydrogen 3.431 N/A LYS 182.A NZ ASP 177.A O no hydrogen 3.374 N/A LYS 182.A NZ ASP 177.A OD1 no hydrogen 2.756 N/A TRP 183.A N CYS 149.A O no hydrogen 2.940 N/A TRP 183.A NE1 LEU 161.A O no hydrogen 2.876 N/A ILE 184.A N LYS 197.A O no hydrogen 2.875 N/A ILE 185.A N ARG 147.A O no hydrogen 3.052 N/A GLU 186.A N THR 195.A O no hydrogen 3.072 N/A TYR 187.A N ASN 145.A OD1 no hydrogen 2.711 N/A TYR 187.A OH ASN 2.A OD1 no hydrogen 2.727 N/A ASN 188.A N ALA 193.A O no hydrogen 2.746 N/A LYS 191.A N ASN 188.A OD1 no hydrogen 2.973 N/A LYS 191.A NZ ASP 222.A O no hydrogen 2.852 N/A SER 192.A OG ASN 2.A OD1 no hydrogen 3.338 N/A SER 192.A OG GLU 189.A O no hydrogen 3.491 N/A ALA 193.A N ASN 188.A O no hydrogen 3.374 N/A TYR 194.A N TRP 228.A O no hydrogen 2.834 N/A THR 195.A N GLU 186.A O no hydrogen 2.900 N/A THR 195.A OG1 GLU 186.A O no hydrogen 3.525 N/A LYS 197.A N ILE 184.A O no hydrogen 2.889 N/A LYS 197.A NZ ASN 202.A OD1 no hydrogen 3.466 N/A CYS 198.A N ARG 203.A O no hydrogen 2.847 N/A CYS 198.A SG SER 179.A O no hydrogen 3.758 N/A CYS 198.A SG ARG 180.A O no hydrogen 3.893 N/A GLN 199.A N LYS 182.A O no hydrogen 2.905 N/A GLU 200.A N SER 179.A O no hydrogen 3.089 N/A ASN 201.A ND2 THR 217.A OG1 no hydrogen 3.103 N/A ASN 202.A N CYS 198.A O no hydrogen 2.839 N/A ARG 203.A N ASN 201.A OD1 no hydrogen 3.235 N/A ARG 203.A NE GLN 168.A OE1 no hydrogen 2.707 N/A ARG 203.A NH1 GLN 219.A OE1 no hydrogen 3.341 N/A ARG 203.A NH2 GLN 168.A OE1 no hydrogen 3.066 N/A ARG 203.A NH2 THR 217.A O no hydrogen 3.057 N/A TYR 204.A N TYR 218.A O no hydrogen 2.897 N/A LEU 205.A N LEU 196.A O no hydrogen 2.803 N/A THR 206.A N GLU 216.A O no hydrogen 2.938 N/A THR 206.A OG1 TYR 204.A O no hydrogen 2.708 N/A THR 206.A OG1 GLN 226.A OE1 no hydrogen 3.080 N/A TRP 207.A N ILE 225.A O no hydrogen 3.020 N/A TRP 207.A NE1 ASN 213.A OD1 no hydrogen 2.879 N/A ILE 208.A N TYR 214.A O no hydrogen 2.963 N/A ASN 210.A N ILE 208.A O no hydrogen 3.178 N/A ASN 212.A N ASN 210.A OD1 no hydrogen 3.044 N/A ASN 213.A N ASN 210.A O no hydrogen 3.191 N/A VAL 215.A N VAL 265.A O no hydrogen 3.193 N/A GLU 216.A N THR 206.A O no hydrogen 2.938 N/A THR 217.A N GLN 168.A O no hydrogen 2.825 N/A THR 217.A OG1 GLN 168.A OE1 no hydrogen 2.845 N/A TYR 218.A N TYR 204.A O no hydrogen 2.918 N/A GLN 219.A N GLN 219.A OE1 no hydrogen 2.972 N/A THR 221.A OG1 SER 223.A OG.B no hydrogen 3.167 N/A SER 223.A N THR 221.A OG1 no hydrogen 3.093 N/A SER 223.A OG.B THR 221.A OG1 no hydrogen 3.167 N/A GLN 226.A N SER 223.A O no hydrogen 3.223 N/A TYR 227.A N LEU 224.A O no hydrogen 3.023 N/A TYR 227.A OH THR 221.A O no hydrogen 2.840 N/A TRP 228.A N TYR 194.A O no hydrogen 2.874 N/A TRP 228.A NE1 LEU 205.A O no hydrogen 2.931 N/A ASN 229.A N TYR 243.A O no hydrogen 2.765 N/A ASN 231.A N ILE 241.A O no hydrogen 2.969 N/A ASN 231.A ND2 ASN 9.A O no hydrogen 2.750 N/A LEU 233.A N LYS 239.A O no hydrogen 2.964 N/A ASN 235.A ND2 ASN 63.A O no hydrogen 3.208 N/A ASP 236.A N LEU 233.A O no hydrogen 3.231 N/A SER 238.A N ASP 236.A OD1 no hydrogen 2.952 N/A SER 238.A OG ASP 236.A OD1 no hydrogen 2.682 N/A SER 238.A OG ASP 236.A OD2 no hydrogen 3.458 N/A LYS 239.A NZ ASP 236.A OD2 no hydrogen 2.872 N/A LYS 239.A NZ SER 238.A OG no hydrogen 3.228 N/A TYR 240.A N TRP 278.A O no hydrogen 2.816 N/A ILE 241.A N ASN 231.A O no hydrogen 2.841 N/A TYR 243.A N ASN 229.A O no hydrogen 2.950 N/A ASN 244.A N ARG 250.A O no hydrogen 2.958 N/A ASN 244.A ND2 ILE 225.A O no hydrogen 2.976 N/A LEU 245.A N TYR 227.A O no hydrogen 2.909 N/A GLN 246.A N ASN 244.A OD1 no hydrogen 2.957 N/A ASP 247.A N ASN 244.A O no hydrogen 3.185 N/A ASN 249.A N ASP 247.A OD1 no hydrogen 3.109 N/A ARG 250.A N ASP 247.A O no hydrogen 2.815 N/A ARG 250.A NE ASP 247.A OD2 no hydrogen 3.032 N/A VAL 251.A N ASP 268.A O no hydrogen 2.801 N/A LEU 252.A N LEU 242.A O no hydrogen 2.925 N/A ASP 253.A N ILE 266.A O no hydrogen 2.832 N/A VAL 254.A N ASN 275.A O no hydrogen 2.923 N/A TYR 255.A N HIS 264.A O no hydrogen 2.956 N/A SER 257.A N VAL 254.A O no hydrogen 3.065 N/A GLN 258.A N TYR 255.A O no hydrogen 3.051 N/A GLN 258.A NE2 ASN 256.A O no hydrogen 2.919 N/A ASN 261.A ND2 GLN 174.A OE1 no hydrogen 2.947 N/A GLY 262.A N LEU 172.A O no hydrogen 2.729 N/A THR 263.A N ALA 260.A O no hydrogen 3.002 N/A THR 263.A OG1 ALA 260.A O no hydrogen 2.683 N/A VAL 265.A N ILE 170.A O no hydrogen 3.205 N/A ILE 266.A N ASP 253.A O no hydrogen 2.750 N/A VAL 267.A N ASN 213.A O no hydrogen 2.976 N/A ASP 268.A N VAL 251.A O no hydrogen 3.040 N/A TYR 270.A N ASN 249.A O no hydrogen 2.862 N/A HIS 271.A N GLN 276.A OE1 no hydrogen 2.849 N/A GLY 272.A N GLN 276.A OE1 no hydrogen 2.921 N/A ASN 273.A N HIS 271.A ND1.B no hydrogen 3.114 N/A ASN 275.A ND2 VAL 254.A O no hydrogen 2.997 N/A GLN 276.A N ASN 273.A O no hydrogen 2.942 N/A GLN 276.A NE2 ASP 253.A OD2 no hydrogen 2.997 N/A GLN 276.A NE2 SER 269.A O no hydrogen 2.820 N/A GLN 277.A N THR 274.A O no hydrogen 3.121 N/A GLN 277.A NE2 GLY 272.A O no hydrogen 2.891 N/A TRP 278.A N TYR 240.A O no hydrogen 2.890 N/A TRP 278.A NE1 LEU 252.A O no hydrogen 3.079 N/A ILE 279.A N GLN 152.A O no hydrogen 2.723 N/A ASN 281.A N LYS 150.A O no hydrogen 3.095 N/A ILE 283.A N ASN 148.A O no hydrogen 2.841 N/A