Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4iv5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 5.A N SER 300.A OG no hydrogen 2.773 N/A SER 7.A OG ASP 23.A OD1 no hydrogen 2.577 N/A LEU 8.A N VAL 5.A O no hydrogen 2.960 N/A LYS 9.A N ALA 6.A O no hydrogen 2.913 N/A LYS 9.A NZ ALA 303.A O no hydrogen 2.718 N/A GLY 10.A N VAL 301.A O no hydrogen 3.007 N/A LYS 11.A N LEU 8.A O no hydrogen 3.043 N/A LYS 11.A NZ SER 7.A O no hydrogen 3.478 N/A ILE 13.A N ILE 129.A O no hydrogen 2.976 N/A THR 14.A N GLN 18.A OE1 no hydrogen 2.797 N/A THR 14.A OG1 GLN 18.A OE1 no hydrogen 3.389 N/A SER 15.A N GLN 18.A OE1 no hydrogen 3.157 N/A SER 15.A OG GLU 138.A OE2 no hydrogen 2.871 N/A ALA 16.A N GLU 138.A OE1 no hydrogen 2.975 N/A GLU 17.A N SER 15.A OG no hydrogen 2.962 N/A GLN 18.A N SER 15.A O no hydrogen 3.184 N/A GLN 18.A NE2 SER 12.A O no hydrogen 2.926 N/A SER 20.A N ASP 23.A OD2 no hydrogen 3.131 N/A ARG 21.A NH1 ASP 158.A OD1 no hydrogen 2.990 N/A ARG 21.A NH1 ASP 158.A OD2 no hydrogen 3.250 N/A ARG 21.A NH1 ASN 184.A O no hydrogen 3.031 N/A ARG 21.A NH2 ASP 158.A OD2 no hydrogen 2.732 N/A ASP 23.A N SER 20.A OG no hydrogen 3.112 N/A ILE 24.A N SER 20.A O no hydrogen 2.972 N/A TYR 25.A N ARG 21.A O no hydrogen 2.952 N/A ALA 26.A N ALA 22.A O no hydrogen 2.990 N/A LEU 27.A N ASP 23.A O no hydrogen 2.923 N/A ILE 28.A N ILE 24.A O no hydrogen 2.975 N/A HIS 29.A N TYR 25.A O no hydrogen 2.974 N/A LEU 30.A N ALA 26.A O no hydrogen 2.870 N/A ALA 31.A N LEU 27.A O no hydrogen 2.850 N/A SER 32.A N ILE 28.A O no hydrogen 3.099 N/A SER 32.A OG ILE 28.A O no hydrogen 3.124 N/A ALA 33.A N HIS 29.A O no hydrogen 3.097 N/A MET 34.A N LEU 30.A O no hydrogen 2.812 N/A GLN 35.A N ALA 31.A O no hydrogen 2.945 N/A GLN 35.A NE2 ASP 39.A OD2 no hydrogen 3.035 N/A ARG 36.A N SER 32.A O no hydrogen 3.070 N/A LYS 37.A N ALA 33.A O no hydrogen 3.166 N/A LYS 37.A NZ GLU 42.A OE1 no hydrogen 3.530 N/A ILE 38.A N MET 34.A O no hydrogen 2.902 N/A ASP 39.A N GLN 35.A O no hydrogen 2.902 N/A ALA 40.A N ARG 36.A O no hydrogen 2.852 N/A GLY 41.A N ILE 38.A O no hydrogen 3.007 N/A GLU 42.A N LYS 37.A O no hydrogen 3.043 N/A LEU 47.A N LEU 74.A O no hydrogen 2.868 N/A GLN 48.A N ASN 45.A O no hydrogen 3.171 N/A ARG 50.A N LEU 47.A O no hydrogen 2.951 N/A ARG 50.A NE ASP 106.A OD1 no hydrogen 3.076 N/A ARG 50.A NH1 ASP 106.A OD1 no hydrogen 3.549 N/A ARG 50.A NH1 LEU 302.A O no hydrogen 3.448 N/A ARG 50.A NH2 LEU 302.A O no hydrogen 2.868 N/A ILE 51.A N ASP 106.A OD2 no hydrogen 2.621 N/A MET 52.A N SER 77.A O no hydrogen 2.862 N/A THR 53.A N VAL 107.A O no hydrogen 3.031 N/A THR 53.A OG1 SER 105.A OG no hydrogen 2.548 N/A LEU 55.A N VAL 109.A O no hydrogen 2.625 N/A PHE 57.A N ARG 111.A O no hydrogen 2.819 N/A THR 63.A OG1 HIS 139.A NE2 no hydrogen 3.394 N/A PHE 64.A N SER 60.A OG no hydrogen 2.992 N/A SER 65.A N SER 61.A O no hydrogen 3.256 N/A SER 65.A OG SER 61.A O no hydrogen 2.946 N/A SER 66.A N ARG 62.A O no hydrogen 2.768 N/A SER 66.A OG ARG 62.A O no hydrogen 2.916 N/A SER 66.A OG THR 63.A O no hydrogen 3.348 N/A PHE 67.A N THR 63.A O no hydrogen 3.214 N/A CYS 68.A N PHE 64.A O no hydrogen 2.957 N/A CYS 68.A SG PHE 64.A O no hydrogen 3.350 N/A ALA 69.A N SER 65.A O no hydrogen 2.846 N/A ALA 70.A N SER 66.A O no hydrogen 2.726 N/A MET 71.A N PHE 67.A O no hydrogen 3.069 N/A ILE 72.A N CYS 68.A O no hydrogen 2.999 N/A ARG 73.A N ALA 69.A O no hydrogen 2.921 N/A LEU 74.A N ALA 70.A O no hydrogen 3.168 N/A LEU 74.A N MET 71.A O no hydrogen 3.131 N/A GLY 75.A N ILE 72.A O no hydrogen 2.797 N/A GLY 76.A N MET 71.A O no hydrogen 2.920 N/A SER 77.A N ARG 50.A O no hydrogen 2.840 N/A VAL 79.A N MET 52.A O no hydrogen 3.092 N/A PHE 81.A N VAL 79.A O no hydrogen 3.091 N/A ALA 85.A N LYS 82.A O no hydrogen 3.268 N/A SER 86.A N VAL 83.A O no hydrogen 3.249 N/A SER 86.A OG VAL 83.A O no hydrogen 2.543 N/A ASN 89.A N SER 86.A O no hydrogen 3.171 N/A ASN 89.A ND2 GLU 84.A O no hydrogen 2.834 N/A LYS 90.A N SER 87.A O no hydrogen 3.131 N/A GLY 91.A N ILE 88.A O no hydrogen 3.256 N/A GLU 92.A N SER 87.A O no hydrogen 3.308 N/A ASP 96.A N THR 93.A OG1 no hydrogen 3.147 N/A THR 97.A N THR 93.A O no hydrogen 2.909 N/A THR 97.A OG1 THR 93.A O no hydrogen 2.912 N/A ILE 98.A N LEU 94.A O no hydrogen 2.859 N/A ARG 99.A N ALA 95.A O no hydrogen 2.919 N/A THR 100.A N ASP 96.A O no hydrogen 2.834 N/A THR 100.A OG1 GLU 92.A OE2 no hydrogen 3.495 N/A THR 100.A OG1 ASP 96.A O no hydrogen 2.808 N/A LEU 101.A N THR 97.A O no hydrogen 3.039 N/A ASP 102.A N ILE 98.A O no hydrogen 2.807 N/A SER 103.A N THR 100.A O no hydrogen 3.221 N/A SER 103.A OG.A ARG 99.A O no hydrogen 2.535 N/A SER 103.A OG.A THR 100.A O no hydrogen 3.327 N/A SER 103.A OG.B THR 100.A O no hydrogen 2.666 N/A TYR 104.A N LEU 101.A O no hydrogen 3.210 N/A SER 105.A OG THR 53.A OG1 no hydrogen 2.548 N/A SER 105.A OG LEU 101.A O no hydrogen 2.879 N/A ASP 106.A N ILE 51.A O no hydrogen 2.857 N/A VAL 107.A N ILE 51.A O no hydrogen 3.134 N/A LEU 108.A N PRO 128.A O no hydrogen 2.992 N/A VAL 109.A N THR 53.A O no hydrogen 3.009 N/A MET 110.A N LEU 130.A O no hydrogen 2.964 N/A ARG 111.A N LEU 55.A O no hydrogen 2.992 N/A ARG 111.A NE ALA 132.A O no hydrogen 2.977 N/A ARG 111.A NH1 ASP 59.A O no hydrogen 3.117 N/A ARG 111.A NH2 ALA 132.A O no hydrogen 3.076 N/A HIS 112.A N GLY 133.A O no hydrogen 3.060 N/A ARG 114.A N HIS 112.A ND1 no hydrogen 3.098 N/A ARG 114.A NE ASP 116.A OD1 no hydrogen 3.398 N/A ARG 114.A NH2 ASP 116.A OD1 no hydrogen 3.071 N/A ALA 117.A N ARG 114.A O no hydrogen 3.346 N/A GLU 120.A N ASP 116.A O no hydrogen 3.306 N/A ALA 121.A N ALA 117.A O no hydrogen 2.994 N/A LEU 122.A N ILE 118.A O no hydrogen 2.983 N/A SER 123.A N GLU 119.A O no hydrogen 3.032 N/A SER 123.A OG GLU 120.A O no hydrogen 2.517 N/A VAL 124.A N ALA 121.A O no hydrogen 3.210 N/A ALA 125.A N ALA 121.A O no hydrogen 3.026 N/A GLN 126.A N ASP 102.A OD2 no hydrogen 2.894 N/A HIS 127.A N ASP 102.A OD1 no hydrogen 2.792 N/A HIS 127.A ND1 ASP 102.A OD1 no hydrogen 2.973 N/A ILE 129.A N SER 12.A OG no hydrogen 3.084 N/A LEU 130.A N LEU 108.A O no hydrogen 2.837 N/A ASN 131.A N ILE 13.A O no hydrogen 2.778 N/A ASN 131.A ND2 THR 14.A O no hydrogen 3.097 N/A ASN 131.A ND2 ASN 134.A OD1 no hydrogen 3.071 N/A ALA 132.A N MET 110.A O no hydrogen 2.814 N/A GLY 133.A N ASN 131.A OD1 no hydrogen 2.861 N/A ASN 134.A N GLU 138.A O no hydrogen 3.317 N/A ASN 134.A ND2 GLN 115.A O no hydrogen 2.949 N/A GLY 135.A N HIS 112.A O no hydrogen 2.916 N/A GLY 137.A N ASN 134.A O no hydrogen 2.904 N/A GLU 138.A N ASN 134.A OD1 no hydrogen 2.814 N/A HIS 139.A N SER 176.A OG no hydrogen 2.830 N/A GLN 142.A NE2 ASP 146.A OD1 no hydrogen 2.987 N/A ALA 143.A N HIS 139.A O no hydrogen 3.285 N/A LEU 144.A N PRO 140.A O no hydrogen 3.131 N/A LEU 145.A N THR 141.A O no hydrogen 3.041 N/A ASP 146.A N GLN 142.A O no hydrogen 2.794 N/A THR 147.A N ALA 143.A O no hydrogen 3.108 N/A THR 147.A OG1 ALA 143.A O no hydrogen 2.981 N/A LEU 148.A N LEU 144.A O no hydrogen 2.983 N/A THR 149.A N LEU 145.A O no hydrogen 2.889 N/A THR 149.A OG1 LEU 145.A O no hydrogen 2.801 N/A ILE 150.A N ASP 146.A O no hydrogen 2.928 N/A HIS 151.A N THR 147.A O no hydrogen 2.868 N/A SER 152.A N LEU 148.A O no hydrogen 2.844 N/A SER 152.A OG LEU 148.A O no hydrogen 2.688 N/A GLU 153.A N THR 149.A O no hydrogen 2.838 N/A LEU 154.A N ILE 150.A O no hydrogen 2.817 N/A GLY 155.A N HIS 151.A O no hydrogen 2.724 N/A SER 156.A OG ASP 158.A O no hydrogen 3.486 N/A GLY 159.A N SER 186.A O no hydrogen 2.712 N/A ILE 160.A N VAL 157.A O no hydrogen 3.323 N/A THR 161.A N ASP 234.A OD2 no hydrogen 2.829 N/A ILE 162.A N CYS 189.A O no hydrogen 2.899 N/A ALA 163.A N VAL 235.A O no hydrogen 2.887 N/A LEU 164.A N PHE 191.A O no hydrogen 2.898 N/A ILE 165.A N TYR 237.A O no hydrogen 2.755 N/A GLY 166.A N VAL 193.A O no hydrogen 3.004 N/A ASP 167.A N THR 239.A OG1 no hydrogen 3.170 N/A LYS 169.A N LEU 198.A O no hydrogen 2.903 N/A MET 170.A N ASP 167.A OD1 no hydrogen 2.911 N/A ARG 172.A NH1 GLU 58.A OE1 no hydrogen 2.911 N/A ARG 172.A NH1 GLY 135.A O no hydrogen 2.944 N/A ARG 172.A NH2 GLU 58.A OE1 no hydrogen 3.028 N/A THR 173.A OG1 TYR 237.A OH no hydrogen 3.385 N/A HIS 175.A N GLY 171.A O no hydrogen 3.175 N/A HIS 175.A ND1 GLY 137.A O no hydrogen 2.861 N/A HIS 175.A NE2 LEU 168.A O no hydrogen 2.741 N/A SER 176.A N ARG 172.A O no hydrogen 3.142 N/A SER 176.A OG GLU 138.A OE1 no hydrogen 2.678 N/A SER 176.A OG ARG 172.A O no hydrogen 3.466 N/A LEU 177.A N THR 173.A O no hydrogen 2.908 N/A LEU 178.A N VAL 174.A O no hydrogen 2.958 N/A LYS 179.A N HIS 175.A O no hydrogen 3.238 N/A LYS 179.A NZ GLU 138.A OE2 no hydrogen 2.780 N/A LEU 180.A N SER 176.A O no hydrogen 2.850 N/A LEU 181.A N LEU 177.A O no hydrogen 2.862 N/A VAL 182.A N LEU 178.A O no hydrogen 2.977 N/A ARG 183.A N LYS 179.A O no hydrogen 3.120 N/A ARG 183.A NH1 GLU 17.A O no hydrogen 2.906 N/A ASN 184.A ND2 LEU 180.A O no hydrogen 2.917 N/A SER 186.A N ASP 158.A OD1 no hydrogen 2.710 N/A LYS 188.A N ILE 160.A O no hydrogen 3.151 N/A CYS 189.A N ILE 160.A O no hydrogen 3.496 N/A CYS 189.A SG ILE 218.A O no hydrogen 3.765 N/A VAL 190.A N ILE 218.A O no hydrogen 2.779 N/A PHE 191.A N ILE 162.A O no hydrogen 2.863 N/A LEU 192.A N HIS 220.A O no hydrogen 2.937 N/A VAL 193.A N LEU 164.A O no hydrogen 3.001 N/A ALA 194.A N THR 222.A O no hydrogen 3.005 N/A LEU 198.A N PRO 195.A O no hydrogen 2.862 N/A GLN 199.A N ASP 196.A O no hydrogen 3.314 N/A GLN 199.A NE2 LEU 192.A O no hydrogen 2.826 N/A GLN 199.A NE2 ALA 194.A O no hydrogen 3.309 N/A GLN 199.A NE2 THR 222.A O no hydrogen 3.592 N/A MET 200.A N GLN 199.A OE1 no hydrogen 3.051 N/A VAL 204.A N PRO 201.A O no hydrogen 3.208 N/A LEU 205.A N PRO 201.A O no hydrogen 3.055 N/A GLU 206.A N GLN 202.A O no hydrogen 2.737 N/A LEU 208.A N LEU 205.A O no hydrogen 3.244 N/A GLN 209.A N GLU 206.A O no hydrogen 3.154 N/A ILE 212.A N LEU 208.A O no hydrogen 2.980 N/A ALA 213.A N GLN 209.A O no hydrogen 3.064 N/A THR 214.A N HIS 210.A O no hydrogen 2.883 N/A THR 214.A OG1 HIS 210.A O no hydrogen 3.225 N/A LYS 215.A N GLU 211.A O no hydrogen 2.881 N/A LYS 215.A NZ VAL 182.A O no hydrogen 3.310 N/A LYS 215.A NZ ARG 183.A O no hydrogen 3.200 N/A LYS 215.A NZ PHE 185.A O no hydrogen 3.060 N/A GLY 216.A N ALA 213.A O no hydrogen 3.375 N/A VAL 217.A N ILE 212.A O no hydrogen 3.025 N/A ILE 218.A N LYS 188.A O no hydrogen 2.905 N/A HIS 220.A N VAL 190.A O no hydrogen 2.967 N/A THR 222.A N LEU 192.A O no hydrogen 2.990 N/A THR 222.A OG1 ALA 224.A O no hydrogen 2.998 N/A LEU 225.A N ASP 244.A O no hydrogen 3.457 N/A THR 226.A N ALA 224.A O no hydrogen 3.046 N/A VAL 229.A N THR 226.A OG1 no hydrogen 3.248 N/A MET 230.A N THR 226.A O no hydrogen 3.162 N/A GLN 231.A N ASP 227.A O no hydrogen 2.841 N/A LYS 232.A N GLU 228.A O no hydrogen 2.953 N/A SER 233.A N VAL 229.A O no hydrogen 3.115 N/A SER 233.A OG VAL 229.A O no hydrogen 2.795 N/A ASP 234.A N THR 161.A O no hydrogen 2.724 N/A VAL 235.A N THR 161.A O no hydrogen 3.196 N/A LEU 236.A N ILE 260.A O no hydrogen 2.943 N/A TYR 237.A N ALA 163.A O no hydrogen 2.721 N/A TYR 237.A OH ASP 146.A OD2 no hydrogen 2.487 N/A TYR 237.A OH THR 173.A OG1 no hydrogen 3.385 N/A THR 238.A N MET 262.A O no hydrogen 2.934 N/A THR 239.A OG1 ILE 165.A O no hydrogen 2.640 N/A ARG 240.A NH1 ASN 268.A OD1 no hydrogen 3.556 N/A GLN 242.A N ASP 167.A OD2 no hydrogen 2.940 N/A ILE 247.A N GLU 270.A O no hydrogen 3.020 N/A ALA 249.A N THR 274.A OG1 no hydrogen 3.143 N/A ARG 251.A N ASP 248.A OD1 no hydrogen 2.825 N/A ARG 251.A NE THR 246.A O no hydrogen 2.878 N/A ARG 251.A NH2 THR 246.A O no hydrogen 2.887 N/A MET 252.A N ASP 248.A O no hydrogen 2.952 N/A ARG 253.A N ALA 250.A O no hydrogen 3.175 N/A LEU 254.A N ARG 251.A O no hydrogen 3.178 N/A ALA 255.A N MET 252.A O no hydrogen 3.106 N/A LYS 256.A NZ LYS 232.A O no hydrogen 3.112 N/A LYS 256.A NZ ASP 234.A OD1 no hydrogen 3.000 N/A LYS 258.A NZ LEU 154.A O no hydrogen 2.906 N/A MET 259.A N GLU 257.A O no hydrogen 3.237 N/A ILE 260.A N ASP 234.A O no hydrogen 3.000 N/A VAL 261.A N ARG 280.A O no hydrogen 2.790 N/A MET 262.A N LEU 236.A O no hydrogen 2.764 N/A HIS 263.A N GLN 286.A OE1 no hydrogen 3.179 N/A HIS 263.A NE2 GLU 270.A OE2 no hydrogen 2.711 N/A LEU 265.A N HIS 263.A ND1 no hydrogen 3.062 N/A ARG 267.A NH1 LEU 271.A O no hydrogen 3.091 N/A ARG 267.A NH1 ASP 276.A OD1 no hydrogen 2.858 N/A ARG 267.A NH2 ASP 276.A OD1 no hydrogen 3.358 N/A ARG 267.A NH2 ASP 276.A OD2 no hydrogen 2.932 N/A ASN 268.A N GLU 270.A OE1 no hydrogen 3.048 N/A ASN 268.A N GLU 270.A OE2 no hydrogen 2.996 N/A ASN 268.A ND2 ARG 267.A O no hydrogen 2.863 N/A GLU 270.A N GLU 270.A OE1 no hydrogen 2.718 N/A SER 272.A N ILE 247.A O no hydrogen 2.992 N/A SER 272.A OG THR 274.A OG1 no hydrogen 2.777 N/A THR 274.A N SER 272.A OG no hydrogen 3.224 N/A THR 274.A OG1 SER 272.A OG no hydrogen 2.777 N/A VAL 275.A N SER 272.A O no hydrogen 3.212 N/A ASP 276.A N THR 273.A O no hydrogen 3.243 N/A ASP 278.A N VAL 275.A O no hydrogen 2.943 N/A ARG 280.A N ASP 278.A OD1 no hydrogen 2.867 N/A ARG 280.A NE ASP 278.A OD1 no hydrogen 3.036 N/A ARG 280.A NE ASP 278.A OD2 no hydrogen 3.132 N/A ARG 280.A NH1 LYS 256.A O no hydrogen 3.237 N/A ARG 280.A NH2 ASP 278.A OD2 no hydrogen 2.623 N/A ALA 281.A N ASP 278.A O no hydrogen 2.920 N/A ALA 282.A N VAL 261.A O no hydrogen 2.997 N/A TYR 283.A OH ASP 276.A OD1 no hydrogen 2.625 N/A ARG 285.A NE GLU 153.A OE1 no hydrogen 3.462 N/A ARG 285.A NE GLU 153.A OE2 no hydrogen 2.791 N/A ARG 285.A NH2 GLU 153.A OE1 no hydrogen 2.963 N/A ARG 285.A NH2 PRO 279.A O no hydrogen 2.936 N/A GLN 286.A N ALA 282.A O no hydrogen 2.763 N/A GLN 286.A NE2 ASP 146.A OD1 no hydrogen 2.898 N/A MET 287.A N PHE 284.A O no hydrogen 2.873 N/A ARG 288.A NH2 ASP 39.A OD1 no hydrogen 2.738 N/A TYR 289.A N ARG 285.A O no hydrogen 2.999 N/A TYR 289.A OH GLU 153.A OE2 no hydrogen 3.097 N/A GLY 290.A N GLN 286.A O no hydrogen 2.907 N/A MET 291.A N MET 287.A O no hydrogen 3.165 N/A PHE 292.A N ARG 288.A O no hydrogen 3.285 N/A MET 293.A N TYR 289.A O no hydrogen 2.883 N/A ARG 294.A N GLY 290.A O no hydrogen 2.960 N/A ARG 294.A NE THR 141.A OG1 no hydrogen 3.364 N/A ARG 294.A NH2 THR 141.A OG1 no hydrogen 3.041 N/A MET 295.A N MET 291.A O no hydrogen 3.027 N/A ALA 296.A N PHE 292.A O no hydrogen 3.074 N/A ILE 297.A N MET 293.A O no hydrogen 2.979 N/A LEU 298.A N ARG 294.A O no hydrogen 2.897 N/A TRP 299.A N MET 295.A O no hydrogen 2.868 N/A TRP 299.A NE1 LEU 2.A O no hydrogen 2.639 N/A SER 300.A N ALA 296.A O no hydrogen 3.007 N/A SER 300.A OG ALA 296.A O no hydrogen 2.837 N/A VAL 301.A N ILE 297.A O no hydrogen 2.885 N/A LEU 302.A N LEU 298.A O no hydrogen 3.001 N/A ALA 303.A N TRP 299.A O no hydrogen 2.736 N/A