Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4k89_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N VAL 26.A O no hydrogen 2.825 N/A ALA 3.A N LEU 24.A O no hydrogen 2.868 N/A GLY 4.A N PRO 59.A O no hydrogen 2.846 N/A GLY 5.A N TYR 17.A O no hydrogen 3.105 N/A GLY 7.A N TYR 15.A O no hydrogen 2.852 N/A GLY 8.A N ASP 75.A OD2 no hydrogen 2.868 N/A ASN 9.A N GLY 13.A O no hydrogen 3.155 N/A ASN 9.A ND2 ASP 189.A O no hydrogen 2.825 N/A GLN 10.A N GLY 68.A O no hydrogen 2.885 N/A LYS 11.A N ASN 9.A OD1 no hydrogen 2.796 N/A LYS 11.A NZ TYR 188.A O no hydrogen 2.834 N/A LYS 11.A NZ LYS 191.A O no hydrogen 2.835 N/A LYS 11.A NZ GLY 193.A O no hydrogen 2.592 N/A LYS 11.A NZ GLY 195.A O no hydrogen 3.010 N/A ILE 12.A N ASN 9.A OD1 no hydrogen 2.923 N/A GLY 13.A N ASN 9.A O no hydrogen 2.853 N/A TYR 15.A N GLY 7.A O no hydrogen 3.096 N/A TYR 15.A OH ASP 75.A OD1 no hydrogen 2.755 N/A THR 16.A N ASP 20.A OD2 no hydrogen 2.948 N/A TYR 17.A N GLY 5.A O no hydrogen 2.740 N/A TYR 17.A OH ASP 75.A OD1 no hydrogen 2.596 N/A GLY 18.A N TYR 21.A O no hydrogen 2.742 N/A GLY 18.A N GLY 22.A O no hydrogen 3.234 N/A SER 19.A N THR 16.A O no hydrogen 3.021 N/A ASP 20.A N THR 16.A O no hydrogen 2.896 N/A TYR 21.A N THR 16.A O no hydrogen 3.501 N/A LEU 24.A N ALA 3.A O no hydrogen 2.877 N/A VAL 26.A N ALA 1.A O no hydrogen 2.963 N/A ASN 27.A N GLU 31.A O no hydrogen 3.093 N/A ASN 27.A ND2 GLU 31.A OE1 no hydrogen 3.071 N/A ARG 29.A N ASN 27.A OD1 no hydrogen 2.798 N/A CYS 30.A N ASN 27.A O no hydrogen 2.912 N/A GLU 31.A N ASN 27.A OD1 no hydrogen 3.065 N/A MET 32.A N PHE 54.A O no hydrogen 2.797 N/A ASP 33.A N GLU 31.A O no hydrogen 2.832 N/A ASP 34.A N VAL 37.A O no hydrogen 3.018 N/A ASN 36.A N ASP 34.A OD1 no hydrogen 2.876 N/A VAL 37.A N ASP 34.A OD1 no hydrogen 2.833 N/A ILE 38.A N LEU 100.A O no hydrogen 2.909 N/A THR 39.A N MET 32.A O no hydrogen 3.001 N/A THR 39.A OG1 HIS 77.A ND1 no hydrogen 2.869 N/A VAL 40.A N MET 102.A O no hydrogen 2.840 N/A MET 42.A N VAL 104.A O no hydrogen 2.819 N/A ASN 43.A N ASP 41.A OD1 no hydrogen 2.862 N/A GLY 44.A N HIS 105.A O no hydrogen 2.748 N/A SER 45.A N MET 42.A O no hydrogen 2.915 N/A ASP 47.A N SER 45.A OG no hydrogen 2.873 N/A SER 49.A N ASP 47.A OD1 no hydrogen 3.000 N/A SER 49.A OG ASP 47.A OD1 no hydrogen 2.715 N/A SER 49.A OG ASP 47.A OD2 no hydrogen 3.266 N/A LYS 50.A N ASP 47.A O no hydrogen 3.190 N/A LYS 50.A NZ ASP 41.A O no hydrogen 2.944 N/A PHE 54.A N THR 39.A O no hydrogen 2.809 N/A ARG 55.A NE ARG 29.A O no hydrogen 2.923 N/A PHE 56.A N CYS 30.A O no hydrogen 3.088 N/A ASN 61.A N GLY 4.A O no hydrogen 2.872 N/A VAL 66.A N ALA 69.A O no hydrogen 2.950 N/A ASN 67.A ND2 ASP 124.A O no hydrogen 2.937 N/A ASN 67.A ND2 ALA 126.A O no hydrogen 3.154 N/A ASN 67.A ND2 PHE 129.A O no hydrogen 3.095 N/A ALA 69.A N VAL 66.A O no hydrogen 2.898 N/A TYR 70.A N GLY 8.A O no hydrogen 2.988 N/A SER 71.A OG TYR 63.A O no hydrogen 2.952 N/A ASN 74.A N SER 71.A OG no hydrogen 3.105 N/A ASN 74.A ND2 ASN 61.A OD1 no hydrogen 2.767 N/A ASP 75.A N SER 71.A O no hydrogen 3.082 N/A ALA 76.A N PRO 72.A O no hydrogen 2.819 N/A HIS 77.A N LEU 73.A O no hydrogen 3.057 N/A HIS 77.A ND1 THR 39.A OG1 no hydrogen 2.869 N/A HIS 77.A NE2 ILE 25.A O no hydrogen 2.849 N/A PHE 78.A N ASN 74.A O no hydrogen 3.049 N/A PHE 79.A N ASP 75.A O no hydrogen 2.771 N/A GLY 80.A N ALA 76.A O no hydrogen 2.933 N/A GLY 81.A N HIS 77.A O no hydrogen 3.200 N/A VAL 82.A N PHE 78.A O no hydrogen 2.942 N/A VAL 83.A N PHE 79.A O no hydrogen 3.054 N/A PHE 84.A N GLY 80.A O no hydrogen 3.299 N/A LYS 85.A N GLY 81.A O no hydrogen 2.859 N/A LEU 86.A N VAL 82.A O no hydrogen 2.837 N/A TYR 87.A N VAL 83.A O no hydrogen 3.323 N/A TYR 87.A OH SER 143.A OG no hydrogen 2.745 N/A ARG 88.A N PHE 84.A O no hydrogen 2.947 N/A ASP 89.A N LYS 85.A O no hydrogen 2.759 N/A TRP 90.A N LEU 86.A O no hydrogen 3.010 N/A PHE 91.A N TYR 87.A O no hydrogen 2.947 N/A GLY 92.A N ARG 88.A O no hydrogen 2.942 N/A THR 93.A N TYR 87.A O no hydrogen 3.107 N/A SER 94.A N THR 93.A OG1 no hydrogen 2.855 N/A SER 94.A OG LEU 96.A O no hydrogen 2.787 N/A LEU 96.A N SER 94.A OG no hydrogen 3.318 N/A HIS 98.A NE2 GLY 117.A O no hydrogen 2.909 N/A LYS 99.A NZ ASP 33.A OD1 no hydrogen 2.995 N/A LEU 100.A N ASN 36.A O no hydrogen 2.877 N/A TYR 101.A N THR 118.A O no hydrogen 3.073 N/A MET 102.A N ILE 38.A O no hydrogen 2.868 N/A LYS 103.A N MET 120.A O no hydrogen 2.745 N/A LYS 103.A NZ ASP 48.A O no hydrogen 2.633 N/A LYS 103.A NZ LYS 50.A O no hydrogen 2.806 N/A VAL 104.A N VAL 40.A O no hydrogen 2.922 N/A HIS 105.A ND1 ASP 124.A OD1 no hydrogen 2.749 N/A TYR 106.A N PHE 122.A O no hydrogen 2.891 N/A GLY 107.A N SER 45.A O no hydrogen 2.928 N/A ALA 113.A N ASN 112.A OD1 no hydrogen 2.979 N/A TYR 114.A N LEU 121.A O no hydrogen 2.852 N/A ASP 116.A N ALA 119.A O no hydrogen 3.250 N/A THR 118.A N ASP 116.A OD1 no hydrogen 2.856 N/A THR 118.A OG1 HIS 98.A NE2 no hydrogen 3.401 N/A ALA 119.A N ASP 116.A OD1 no hydrogen 2.835 N/A MET 120.A N TYR 101.A O no hydrogen 2.874 N/A LEU 121.A N TYR 114.A O no hydrogen 2.847 N/A PHE 122.A N LYS 103.A O no hydrogen 2.872 N/A GLY 123.A N ASN 112.A O no hydrogen 2.957 N/A GLY 125.A N VAL 110.A O no hydrogen 2.924 N/A ALA 126.A N PHE 129.A O no hydrogen 3.025 N/A MET 128.A N GLU 111.A OE2 no hydrogen 2.843 N/A PHE 129.A N GLU 111.A OE2 no hydrogen 3.008 N/A TYR 130.A N ILE 190.A O no hydrogen 2.857 N/A LEU 132.A N GLY 123.A O no hydrogen 3.001 N/A VAL 137.A N SER 134.A OG no hydrogen 3.069 N/A ALA 138.A N SER 134.A O no hydrogen 2.932 N/A ALA 139.A N LEU 135.A O no hydrogen 2.951 N/A HIS 140.A N ASP 136.A O no hydrogen 2.837 N/A HIS 140.A ND1 ASP 168.A OD1 no hydrogen 2.773 N/A GLU 141.A N VAL 137.A O no hydrogen 2.874 N/A VAL 142.A N ALA 138.A O no hydrogen 3.002 N/A SER 143.A N ALA 139.A O no hydrogen 2.934 N/A SER 143.A OG TYR 87.A OH no hydrogen 2.745 N/A SER 143.A OG ALA 139.A O no hydrogen 2.703 N/A HIS 144.A N HIS 140.A O no hydrogen 3.341 N/A HIS 144.A N GLU 141.A O no hydrogen 2.942 N/A HIS 144.A ND1 ASN 163.A OD1 no hydrogen 2.664 N/A GLY 145.A N VAL 142.A O no hydrogen 2.812 N/A PHE 146.A N VAL 142.A O no hydrogen 3.303 N/A THR 147.A N SER 143.A O no hydrogen 2.954 N/A THR 147.A OG1 SER 143.A O no hydrogen 3.299 N/A GLU 148.A N HIS 144.A O no hydrogen 2.957 N/A GLN 149.A N GLY 145.A O no hydrogen 3.056 N/A ASN 150.A N THR 147.A O no hydrogen 2.996 N/A ASN 150.A ND2 PHE 146.A O no hydrogen 2.875 N/A SER 151.A N ASN 255.A OD1 no hydrogen 3.241 N/A SER 151.A OG ASN 255.A OD1 no hydrogen 2.777 N/A GLY 152.A N THR 147.A O no hydrogen 2.846 N/A LEU 153.A N SER 151.A OG no hydrogen 3.385 N/A ILE 154.A N ALA 261.A O no hydrogen 2.956 N/A TYR 155.A OH GLU 164.A OE2 no hydrogen 2.694 N/A ARG 156.A NH1 TYR 155.A O no hydrogen 3.357 N/A SER 159.A OG ALA 261.A O no hydrogen 3.556 N/A SER 159.A OG SER 263.A O no hydrogen 2.597 N/A GLY 160.A N ARG 156.A O no hydrogen 2.947 N/A GLY 161.A N GLY 157.A O no hydrogen 3.109 N/A MET 162.A N GLN 158.A O no hydrogen 2.892 N/A ASN 163.A N SER 159.A O no hydrogen 2.857 N/A ASN 163.A ND2 LEU 153.A O no hydrogen 2.916 N/A GLU 164.A N GLY 160.A O no hydrogen 2.972 N/A ALA 165.A N GLY 161.A O no hydrogen 2.877 N/A PHE 166.A N MET 162.A O no hydrogen 2.847 N/A SER 167.A N ASN 163.A O no hydrogen 3.136 N/A SER 167.A OG HIS 140.A O no hydrogen 2.755 N/A ASP 168.A N GLU 164.A O no hydrogen 2.995 N/A MET 169.A N ALA 165.A O no hydrogen 2.828 N/A ALA 170.A N PHE 166.A O no hydrogen 2.860 N/A GLY 171.A N SER 167.A O no hydrogen 3.054 N/A GLU 172.A N ASP 168.A O no hydrogen 3.183 N/A ALA 173.A N MET 169.A O no hydrogen 2.848 N/A ALA 174.A N ALA 170.A O no hydrogen 2.827 N/A GLU 175.A N GLY 171.A O no hydrogen 3.017 N/A PHE 176.A N GLU 172.A O no hydrogen 2.934 N/A TYR 177.A N ALA 173.A O no hydrogen 2.803 N/A TYR 177.A OH ASP 89.A OD2 no hydrogen 2.672 N/A MET 178.A N ALA 174.A O no hydrogen 2.868 N/A ARG 179.A N GLU 175.A O no hydrogen 2.839 N/A ARG 179.A NH1 TYR 21.A OH no hydrogen 3.048 N/A ARG 179.A NH2 TYR 15.A OH no hydrogen 3.259 N/A GLY 180.A N PHE 176.A O no hydrogen 2.792 N/A ASN 182.A ND2 THR 244.A OG1 no hydrogen 2.658 N/A ASP 183.A N GLU 175.A OE2 no hydrogen 3.082 N/A PHE 184.A N GLU 172.A OE1 no hydrogen 2.783 N/A LEU 185.A N ASP 183.A OD1 no hydrogen 2.916 N/A ILE 186.A N ARG 198.A O no hydrogen 2.881 N/A LYS 191.A N GLY 187.A O no hydrogen 3.104 N/A LYS 191.A NZ ALA 196.A O no hydrogen 3.183 N/A LYS 192.A N MET 128.A O no hydrogen 2.900 N/A LYS 192.A NZ ASN 67.A OD1 no hydrogen 2.785 N/A LYS 192.A NZ ALA 126.A O no hydrogen 2.815 N/A ALA 196.A N TYR 199.A OH no hydrogen 2.941 N/A LEU 197.A N ILE 186.A O no hydrogen 2.707 N/A ARG 198.A N ILE 186.A O no hydrogen 3.053 N/A ARG 198.A NE ASP 168.A OD2 no hydrogen 2.975 N/A ARG 198.A NH2 ASP 168.A OD1 no hydrogen 2.835 N/A ARG 198.A NH2 ASP 168.A OD2 no hydrogen 3.531 N/A MET 200.A N PHE 184.A O no hydrogen 3.077 N/A GLN 202.A NE2 SER 204.A OG no hydrogen 3.300 N/A SER 204.A N ASP 211.A OD1 no hydrogen 2.814 N/A SER 204.A OG ASP 211.A OD1 no hydrogen 3.334 N/A SER 204.A OG ASP 211.A OD2 no hydrogen 2.668 N/A ARG 205.A N GLN 202.A O no hydrogen 2.923 N/A ARG 205.A NH1 ASP 201.A OD1 no hydrogen 2.931 N/A ASP 206.A N PRO 203.A O no hydrogen 3.134 N/A GLY 207.A N SER 204.A O no hydrogen 2.865 N/A ARG 208.A N ASP 206.A OD1 no hydrogen 2.866 N/A SER 209.A N ASP 206.A OD1 no hydrogen 2.763 N/A SER 209.A OG ASP 206.A OD1 no hydrogen 3.362 N/A SER 209.A OG ASP 206.A OD2 no hydrogen 2.587 N/A SER 209.A OG HIS 223.A O no hydrogen 3.537 N/A SER 209.A OG HIS 224.A ND1 no hydrogen 2.759 N/A ILE 210.A N HIS 224.A O no hydrogen 3.149 N/A ALA 213.A N VAL 293.A O no hydrogen 2.786 N/A SER 214.A N ASN 212.A OD1 no hydrogen 3.003 N/A SER 214.A OG ASN 212.A OD1 no hydrogen 3.193 N/A GLN 215.A N ASN 212.A O no hydrogen 2.942 N/A TYR 216.A N ALA 213.A O no hydrogen 3.072 N/A ILE 220.A N TYR 217.A O no hydrogen 3.036 N/A HIS 223.A N ASP 221.A OD2 no hydrogen 2.951 N/A HIS 223.A ND1 ASP 221.A OD2 no hydrogen 2.710 N/A HIS 224.A N ASP 221.A O no hydrogen 2.906 N/A HIS 224.A ND1 SER 209.A OG no hydrogen 2.759 N/A SER 225.A N ASP 221.A O no hydrogen 2.951 N/A SER 225.A OG ASP 221.A O no hydrogen 3.432 N/A SER 226.A N VAL 222.A O no hydrogen 3.215 N/A SER 226.A OG VAL 222.A O no hydrogen 3.423 N/A GLY 227.A N HIS 224.A O no hydrogen 3.264 N/A VAL 228.A N SER 225.A O no hydrogen 3.494 N/A TYR 229.A OH TYR 265.A O no hydrogen 2.695 N/A ASN 230.A N SER 226.A O no hydrogen 2.874 N/A ASN 230.A ND2 ASP 168.A OD2 no hydrogen 2.958 N/A ARG 231.A N GLY 227.A O no hydrogen 2.850 N/A ARG 231.A NH1 ASP 211.A O no hydrogen 2.874 N/A ALA 232.A N VAL 228.A O no hydrogen 3.050 N/A PHE 233.A N TYR 229.A O no hydrogen 2.934 N/A TYR 234.A N ASN 230.A O no hydrogen 2.952 N/A LEU 235.A N ARG 231.A O no hydrogen 2.847 N/A LEU 236.A N ALA 232.A O no hydrogen 2.869 N/A ALA 237.A N PHE 233.A O no hydrogen 2.834 N/A ASN 238.A N TYR 234.A O no hydrogen 3.096 N/A ASN 238.A ND2 TYR 234.A O no hydrogen 2.913 N/A SER 239.A N LEU 236.A O no hydrogen 2.928 N/A SER 239.A OG LEU 235.A O no hydrogen 2.747 N/A TRP 242.A N SER 239.A O no hydrogen 2.970 N/A TRP 242.A NE1 ASP 285.A OD2 no hydrogen 2.845 N/A ARG 245.A NE GLU 249.A OE2 no hydrogen 3.340 N/A LYS 246.A N ASP 243.A OD1 no hydrogen 2.813 N/A LYS 246.A NZ GLY 241.A O no hydrogen 3.258 N/A ALA 247.A N ASP 243.A O no hydrogen 2.941 N/A PHE 248.A N THR 244.A O no hydrogen 2.905 N/A GLU 249.A N ARG 245.A O no hydrogen 2.818 N/A VAL 250.A N LYS 246.A O no hydrogen 3.423 N/A PHE 251.A N ALA 247.A O no hydrogen 3.512 N/A VAL 252.A N PHE 248.A O no hydrogen 2.830 N/A ASP 253.A N GLU 249.A O no hydrogen 2.889 N/A ALA 254.A N VAL 250.A O no hydrogen 3.162 N/A ASN 255.A N PHE 251.A O no hydrogen 2.964 N/A ASN 255.A ND2 THR 147.A OG1 no hydrogen 2.965 N/A ARG 256.A N VAL 252.A O no hydrogen 2.864 N/A ARG 256.A NH1 PHE 91.A O no hydrogen 2.968 N/A TYR 257.A N ASP 253.A O no hydrogen 2.843 N/A TYR 258.A N ALA 254.A O no hydrogen 2.902 N/A TYR 258.A OH ASN 278.A OD1 no hydrogen 2.988 N/A TRP 259.A N ALA 254.A O no hydrogen 2.940 N/A TRP 259.A NE1 GLY 268.A O no hydrogen 2.925 N/A THR 260.A N SER 263.A OG no hydrogen 2.912 N/A THR 262.A N THR 260.A OG1 no hydrogen 3.056 N/A SER 263.A N THR 260.A O no hydrogen 3.293 N/A SER 263.A OG THR 260.A O no hydrogen 3.464 N/A ASN 264.A N SER 267.A OG no hydrogen 3.176 N/A TYR 265.A OH SER 225.A O no hydrogen 2.757 N/A SER 267.A N ASN 264.A OD1 no hydrogen 3.029 N/A SER 267.A OG ASN 264.A OD1 no hydrogen 3.332 N/A GLY 268.A N ASN 264.A O no hydrogen 2.766 N/A ALA 269.A N TYR 265.A O no hydrogen 3.024 N/A CYS 270.A N SER 267.A O no hydrogen 3.183 N/A CYS 270.A SG ASN 266.A O no hydrogen 3.694 N/A VAL 272.A N GLY 268.A O no hydrogen 3.353 N/A ILE 273.A N ALA 269.A O no hydrogen 2.922 N/A ARG 274.A N CYS 270.A O no hydrogen 2.923 N/A SER 275.A N GLY 271.A O no hydrogen 2.983 N/A SER 275.A OG GLY 271.A O no hydrogen 2.806 N/A ALA 276.A N VAL 272.A O no hydrogen 2.948 N/A GLN 277.A N ILE 273.A O no hydrogen 3.073 N/A ASN 278.A N ARG 274.A O no hydrogen 2.867 N/A ARG 279.A N SER 275.A O no hydrogen 3.037 N/A ARG 279.A N ALA 276.A O no hydrogen 3.126 N/A ARG 279.A NE ASP 253.A OD2 no hydrogen 2.668 N/A ARG 279.A NH2 ASP 253.A OD1 no hydrogen 2.854 N/A ARG 279.A NH2 ASP 253.A OD2 no hydrogen 3.353 N/A ASN 280.A N GLN 277.A O no hydrogen 3.136 N/A TYR 281.A N ALA 276.A O no hydrogen 2.916 N/A TYR 281.A OH GLU 249.A OE1 no hydrogen 2.566 N/A ASP 285.A N SER 282.A O no hydrogen 3.212 N/A ASP 285.A N SER 282.A OG no hydrogen 2.989 N/A VAL 286.A N SER 282.A O no hydrogen 3.381 N/A THR 287.A N ALA 283.A O no hydrogen 2.936 N/A THR 287.A OG1 ALA 283.A O no hydrogen 3.071 N/A ARG 288.A N ALA 284.A O no hydrogen 2.858 N/A ALA 289.A N ASP 285.A O no hydrogen 3.056 N/A PHE 290.A N VAL 286.A O no hydrogen 3.071 N/A SER 291.A N THR 287.A O no hydrogen 2.871 N/A SER 291.A OG ARG 288.A O no hydrogen 3.035 N/A THR 292.A N ARG 288.A O no hydrogen 3.036 N/A THR 292.A OG1 ARG 288.A O no hydrogen 3.007 N/A VAL 293.A N PHE 290.A O no hydrogen 2.956 N/A GLY 294.A N SER 291.A O no hydrogen 2.968 N/A VAL 295.A N PHE 290.A O no hydrogen 2.848 N/A CYS 297.A SG PRO 298.A O no hydrogen 3.616 N/A