Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4iu4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A NZ LEU 38.A O no hydrogen 3.373 N/A LYS 2.A NZ GLY 92.A O no hydrogen 3.363 N/A MET 3.A N ASP 41.A O no hydrogen 2.673 N/A SER 4.A N PHE 94.A O no hydrogen 2.875 N/A ILE 5.A N ARG 43.A O no hydrogen 2.878 N/A VAL 6.A N LEU 96.A O no hydrogen 2.910 N/A LEU 7.A N GLU 45.A O no hydrogen 2.851 N/A ALA 8.A N ILE 98.A O no hydrogen 2.967 N/A PHE 10.A N ALA 8.A O no hydrogen 2.890 N/A SER 11.A OG GLU 54.A OE2 no hydrogen 2.585 N/A GLY 13.A N ASP 101.A OD2 no hydrogen 2.706 N/A GLN 14.A N SER 11.A O no hydrogen 3.255 N/A GLN 14.A NE2 SER 11.A O no hydrogen 2.791 N/A GLN 14.A NE2 HIS 16.A O no hydrogen 2.411 N/A GLU 20.A N SER 17.A O no hydrogen 3.505 N/A LEU 21.A N GLY 18.A O no hydrogen 2.931 N/A GLY 22.A N VAL 19.A O no hydrogen 3.239 N/A TYR 25.A N LEU 21.A O no hydrogen 3.099 N/A LEU 26.A N GLY 22.A O no hydrogen 2.965 N/A LEU 27.A N PRO 23.A O no hydrogen 3.113 N/A LYS 28.A N ASP 24.A O no hydrogen 2.871 N/A LYS 28.A NZ ASP 24.A O no hydrogen 3.234 N/A GLN 29.A N TYR 25.A O no hydrogen 2.997 N/A GLY 30.A N LEU 27.A O no hydrogen 2.992 N/A LEU 31.A N LEU 26.A O no hydrogen 3.254 N/A GLN 32.A NE2 THR 42.A OG1 no hydrogen 2.931 N/A ASP 34.A N GLY 30.A O no hydrogen 2.912 N/A MET 35.A N LEU 31.A O no hydrogen 3.097 N/A GLU 36.A N GLN 32.A O no hydrogen 2.975 N/A LYS 37.A N GLN 33.A O no hydrogen 2.799 N/A LEU 38.A N ASP 34.A O no hydrogen 2.929 N/A LEU 38.A N MET 35.A O no hydrogen 3.078 N/A GLY 39.A N GLU 36.A O no hydrogen 2.668 N/A TRP 40.A N MET 35.A O no hydrogen 2.949 N/A TRP 40.A NE1 MET 303.A O no hydrogen 3.220 N/A ASP 41.A N LYS 1.A O no hydrogen 3.048 N/A THR 42.A OG1 GLU 36.A OE2 no hydrogen 3.538 N/A GLU 45.A N ILE 5.A O no hydrogen 3.063 N/A LYS 51.A N ASP 49.A OD1 no hydrogen 2.722 N/A VAL 52.A N ASP 49.A OD1 no hydrogen 3.030 N/A VAL 53.A N ASP 49.A O no hydrogen 3.123 N/A GLU 54.A N GLY 50.A O no hydrogen 2.860 N/A ALA 55.A N LYS 51.A O no hydrogen 2.766 N/A ARG 56.A N VAL 52.A O no hydrogen 3.309 N/A ARG 56.A NH1 GLU 76.A OE1 no hydrogen 3.281 N/A LYS 57.A N VAL 53.A O no hydrogen 2.858 N/A LYS 57.A NZ GLN 14.A O no hydrogen 2.836 N/A ALA 58.A N GLU 54.A O no hydrogen 2.890 N/A SER 59.A OG ALA 55.A O no hydrogen 2.869 N/A SER 59.A OG ARG 56.A O no hydrogen 3.332 N/A ASP 60.A N ARG 56.A O no hydrogen 3.014 N/A ASN 61.A N SER 59.A O no hydrogen 2.967 N/A ASN 61.A ND2 SER 59.A O no hydrogen 3.008 N/A ASP 63.A N ASP 60.A O no hydrogen 3.231 N/A ARG 64.A NH2 GLY 66.A O no hydrogen 2.560 N/A ILE 65.A N VAL 68.A O no hydrogen 2.973 N/A LYS 69.A N GLY 139.A O no hydrogen 2.934 N/A LYS 69.A NZ SER 138.A O no hydrogen 2.962 N/A ARG 70.A N ASP 63.A O no hydrogen 2.728 N/A ARG 70.A NE GLY 12.A O no hydrogen 3.239 N/A ARG 72.A N ASP 63.A OD1 no hydrogen 3.007 N/A LEU 73.A N ASP 63.A OD2 no hydrogen 2.859 N/A THR 74.A N ARG 70.A O no hydrogen 3.063 N/A THR 74.A OG1 ARG 70.A O no hydrogen 2.684 N/A ALA 75.A N PRO 71.A O no hydrogen 2.832 N/A GLU 76.A N ARG 72.A O no hydrogen 2.938 N/A CYS 77.A N LEU 73.A O no hydrogen 3.000 N/A THR 78.A N THR 74.A O no hydrogen 2.937 N/A THR 78.A OG1 THR 74.A O no hydrogen 3.070 N/A THR 78.A OG1 SER 103.A O no hydrogen 3.400 N/A GLU 79.A N ALA 75.A O no hydrogen 3.057 N/A LYS 80.A N GLU 76.A O no hydrogen 3.253 N/A ILE 81.A N CYS 77.A O no hydrogen 3.113 N/A TYR 82.A N THR 78.A O no hydrogen 2.993 N/A LYS 83.A N GLU 79.A O no hydrogen 2.957 N/A CYS 84.A N LYS 80.A O no hydrogen 2.888 N/A VAL 85.A N ILE 81.A O no hydrogen 2.801 N/A ARG 86.A N TYR 82.A O no hydrogen 2.860 N/A ARG 87.A N LYS 83.A O no hydrogen 3.028 N/A VAL 88.A N CYS 84.A O no hydrogen 2.909 N/A ALA 89.A N VAL 85.A O no hydrogen 3.051 N/A GLU 90.A N ARG 86.A O no hydrogen 3.021 N/A GLN 91.A N ARG 87.A O no hydrogen 2.955 N/A GLY 92.A N ALA 89.A O no hydrogen 3.081 N/A ARG 93.A N VAL 88.A O no hydrogen 3.112 N/A ARG 93.A NE SER 4.A OG no hydrogen 2.830 N/A ARG 93.A NH2 MET 3.A O no hydrogen 2.998 N/A PHE 94.A N LYS 2.A O no hydrogen 2.909 N/A LEU 96.A N SER 4.A O no hydrogen 3.013 N/A THR 97.A N LEU 272.A O no hydrogen 2.855 N/A ILE 98.A N VAL 6.A O no hydrogen 2.981 N/A GLY 99.A N VAL 274.A O no hydrogen 2.982 N/A GLY 100.A N VAL 19.A O no hydrogen 2.856 N/A ASP 101.A N PHE 10.A O no hydrogen 2.911 N/A HIS 102.A N GLU 276.A OE2 no hydrogen 2.767 N/A HIS 102.A NE2 SER 229.A OG no hydrogen 2.714 N/A SER 103.A N ASP 101.A OD1 no hydrogen 2.655 N/A SER 103.A OG ASP 101.A OD1 no hydrogen 2.494 N/A ILE 104.A N ASP 101.A O no hydrogen 3.362 N/A ALA 105.A N HIS 102.A O no hydrogen 3.159 N/A LEU 106.A N SER 103.A O no hydrogen 3.155 N/A GLY 107.A N ILE 104.A O no hydrogen 2.975 N/A THR 108.A N ILE 104.A O no hydrogen 3.106 N/A THR 108.A OG1 ASP 273.A OD1 no hydrogen 3.531 N/A THR 108.A OG1 ASP 273.A OD2 no hydrogen 2.676 N/A VAL 109.A N ALA 105.A O no hydrogen 3.076 N/A GLY 111.A N GLY 107.A O no hydrogen 2.811 N/A VAL 112.A N THR 108.A O no hydrogen 2.910 N/A LEU 113.A N VAL 109.A O no hydrogen 2.964 N/A SER 114.A N ALA 110.A O no hydrogen 3.123 N/A SER 114.A OG ALA 110.A O no hydrogen 2.644 N/A VAL 115.A N VAL 112.A O no hydrogen 3.057 N/A HIS 116.A N VAL 112.A O no hydrogen 2.687 N/A ALA 119.A N HIS 116.A O no hydrogen 2.975 N/A GLY 120.A N PRO 225.A O no hydrogen 2.824 N/A VAL 121.A N LYS 172.A O no hydrogen 2.751 N/A ILE 122.A N MET 227.A O no hydrogen 2.850 N/A TRP 123.A N ALA 174.A O no hydrogen 2.751 N/A TRP 123.A NE1 ASP 125.A OD2 no hydrogen 2.951 N/A TRP 123.A NE1 ASP 129.A OD2 no hydrogen 3.223 N/A VAL 124.A N SER 229.A O no hydrogen 3.094 N/A ASP 125.A N ILE 176.A O no hydrogen 3.040 N/A ALA 126.A N ASP 233.A OD2 no hydrogen 3.415 N/A HIS 127.A N ASP 125.A OD1 no hydrogen 2.860 N/A ILE 130.A N GLU 185.A OE2 no hydrogen 2.991 N/A ASN 131.A N GLY 143.A O no hydrogen 3.074 N/A ASN 131.A ND2 ASP 182.A OD2 no hydrogen 2.727 N/A SER 134.A N ASP 153.A OD2 no hydrogen 3.409 N/A SER 134.A OG ASP 153.A OD2 no hydrogen 2.521 N/A GLY 135.A N THR 132.A O no hydrogen 3.203 N/A THR 136.A N THR 132.A O no hydrogen 2.898 N/A GLY 139.A N THR 136.A OG1 no hydrogen 2.833 N/A ASN 140.A N SER 138.A OG no hydrogen 3.328 N/A HIS 142.A N GLY 13.A O no hydrogen 2.750 N/A HIS 142.A ND1 GLU 276.A OE2 no hydrogen 3.029 N/A GLY 143.A N ASN 140.A O no hydrogen 3.085 N/A CYS 144.A N LEU 141.A O no hydrogen 3.029 N/A CYS 144.A SG ASN 140.A O no hydrogen 4.011 N/A LEU 146.A N ASP 129.A O no hydrogen 3.027 N/A SER 147.A N CYS 144.A O no hydrogen 2.994 N/A SER 147.A OG ASN 131.A O no hydrogen 2.529 N/A SER 147.A OG CYS 144.A O no hydrogen 2.693 N/A ILE 148.A N CYS 144.A O no hydrogen 3.389 N/A LEU 149.A N PRO 145.A O no hydrogen 2.912 N/A LEU 150.A N LEU 146.A O no hydrogen 2.969 N/A GLY 151.A N ILE 148.A O no hydrogen 3.194 N/A LEU 152.A N SER 147.A O no hydrogen 2.859 N/A ASN 156.A N ASP 153.A O no hydrogen 2.763 N/A ILE 157.A N ARG 154.A O no hydrogen 3.172 N/A CYS 160.A SG PRO 71.A O no hydrogen 3.879 N/A PHE 161.A N PRO 158.A O no hydrogen 3.204 N/A SER 162.A N GLU 159.A O no hydrogen 2.874 N/A SER 162.A OG GLU 159.A O no hydrogen 2.751 N/A SER 162.A OG GLU 159.A OE2 no hydrogen 2.928 N/A VAL 164.A N PHE 161.A O no hydrogen 3.074 N/A GLN 166.A NE2 VAL 164.A O no hydrogen 3.332 N/A LYS 172.A N LYS 169.A O no hydrogen 2.916 N/A LYS 172.A NZ ASP 118.A O no hydrogen 2.997 N/A LYS 172.A NZ VAL 218.A O no hydrogen 2.596 N/A ALA 174.A N VAL 121.A O no hydrogen 2.811 N/A TYR 175.A N ALA 195.A O no hydrogen 2.840 N/A TYR 175.A OH ALA 128.A O no hydrogen 2.792 N/A ILE 176.A N TRP 123.A O no hydrogen 3.013 N/A GLY 177.A N PHE 197.A O no hydrogen 2.931 N/A ARG 179.A N ALA 126.A O no hydrogen 2.905 N/A ARG 179.A NE VAL 247.A O no hydrogen 2.958 N/A ARG 179.A NH1 GLY 177.A O no hydrogen 3.238 N/A ARG 179.A NH1 THR 234.A O no hydrogen 2.955 N/A ARG 179.A NH2 ASP 233.A O no hydrogen 2.782 N/A ARG 179.A NH2 THR 234.A O no hydrogen 3.371 N/A ARG 179.A NH2 VAL 247.A O no hydrogen 2.818 N/A ALA 180.A N ALA 126.A O no hydrogen 2.931 N/A ASP 182.A N GLU 185.A OE1 no hydrogen 2.800 N/A LYS 186.A N ASP 182.A O no hydrogen 2.821 N/A LYS 187.A N ASP 183.A O no hydrogen 3.112 N/A LYS 187.A NZ ASP 191.A OD1 no hydrogen 3.225 N/A ILE 188.A N GLU 184.A O no hydrogen 3.090 N/A LEU 189.A N GLU 185.A O no hydrogen 2.905 N/A HIS 190.A N LYS 186.A O no hydrogen 3.027 N/A ASP 191.A N LYS 187.A O no hydrogen 2.805 N/A LEU 192.A N ILE 188.A O no hydrogen 2.981 N/A ASN 193.A N HIS 190.A O no hydrogen 3.089 N/A ILE 194.A N LEU 189.A O no hydrogen 2.978 N/A PHE 197.A N TYR 175.A O no hydrogen 3.071 N/A SER 198.A N HIS 201.A ND1 no hydrogen 2.938 N/A SER 198.A OG HIS 201.A ND1 no hydrogen 3.080 N/A MET 199.A N LEU 178.A O no hydrogen 2.959 N/A HIS 200.A N SER 198.A OG no hydrogen 3.135 N/A VAL 202.A N SER 198.A O no hydrogen 3.223 N/A ASP 203.A N MET 199.A O no hydrogen 2.848 N/A ARG 204.A N HIS 200.A O no hydrogen 2.689 N/A ARG 204.A NH1 HIS 200.A NE2 no hydrogen 3.173 N/A TYR 205.A N HIS 201.A O no hydrogen 2.709 N/A GLY 206.A N VAL 202.A O no hydrogen 2.758 N/A VAL 210.A N GLY 206.A O no hydrogen 3.300 N/A VAL 211.A N ILE 207.A O no hydrogen 2.947 N/A SER 212.A N ASP 208.A O no hydrogen 3.085 N/A SER 212.A OG ASP 208.A O no hydrogen 3.266 N/A MET 213.A N LYS 209.A O no hydrogen 2.881 N/A ALA 214.A N VAL 210.A O no hydrogen 2.925 N/A ILE 215.A N VAL 211.A O no hydrogen 2.968 N/A GLU 216.A N SER 212.A O no hydrogen 3.017 N/A ALA 217.A N MET 213.A O no hydrogen 2.864 N/A SER 219.A N GLU 216.A O no hydrogen 3.278 N/A SER 219.A OG ILE 215.A O no hydrogen 2.908 N/A LYS 221.A N GLU 224.A OE1 no hydrogen 2.574 N/A LYS 221.A NZ ASP 118.A OD2 no hydrogen 3.067 N/A LYS 221.A NZ GLU 224.A OE1 no hydrogen 2.998 N/A GLY 222.A N SER 219.A O no hydrogen 2.948 N/A THR 223.A N GLU 224.A OE2 no hydrogen 3.067 N/A GLU 224.A N GLU 224.A OE2 no hydrogen 2.587 N/A VAL 226.A N ARG 268.A O no hydrogen 2.699 N/A MET 227.A N GLY 120.A O no hydrogen 2.837 N/A VAL 228.A N ALA 271.A O no hydrogen 3.164 N/A SER 229.A N ILE 122.A O no hydrogen 3.032 N/A SER 229.A OG HIS 102.A NE2 no hydrogen 2.714 N/A SER 229.A OG ASP 273.A OD2 no hydrogen 2.953 N/A TYR 230.A N ASP 273.A O no hydrogen 2.784 N/A TYR 230.A OH ALA 256.A O no hydrogen 2.770 N/A ASP 231.A N VAL 124.A O no hydrogen 2.901 N/A VAL 232.A N VAL 275.A O no hydrogen 3.157 N/A ASP 233.A N ASP 231.A OD1 no hydrogen 3.008 N/A THR 234.A N ASP 231.A O no hydrogen 3.231 N/A THR 234.A OG1 ASP 231.A O no hydrogen 2.825 N/A ILE 235.A N VAL 232.A O no hydrogen 3.179 N/A ASP 236.A N LEU 251.A O no hydrogen 2.777 N/A LEU 238.A N ASP 236.A OD1 no hydrogen 3.156 N/A TYR 239.A N ASP 236.A O no hydrogen 2.708 N/A VAL 240.A N ASP 236.A O no hydrogen 3.214 N/A ALA 242.A N THR 291.A OG1 no hydrogen 3.107 N/A THR 243.A N PRO 241.A O no hydrogen 2.988 N/A THR 243.A OG1 GLU 276.A O no hydrogen 3.038 N/A THR 245.A OG1 ASP 233.A OD1 no hydrogen 2.823 N/A GLY 249.A N ASP 236.A OD2 no hydrogen 2.744 N/A GLY 250.A N ASP 236.A OD2 no hydrogen 2.899 N/A LEU 251.A N THR 234.A O no hydrogen 2.973 N/A SER 252.A N GLU 255.A OE1 no hydrogen 2.769 N/A GLU 255.A N SER 252.A OG no hydrogen 3.091 N/A ALA 256.A N SER 252.A O no hydrogen 2.942 N/A LEU 257.A N PHE 253.A O no hydrogen 3.161 N/A PHE 258.A N ARG 254.A O no hydrogen 2.735 N/A LEU 259.A N GLU 255.A O no hydrogen 2.972 N/A CYS 260.A SG ALA 256.A O no hydrogen 3.353 N/A CYS 260.A SG ILE 298.A O no hydrogen 3.788 N/A GLU 261.A N LEU 257.A O no hydrogen 3.045 N/A ARG 262.A N PHE 258.A O no hydrogen 2.945 N/A ARG 262.A NE GLU 265.A OE2 no hydrogen 3.120 N/A ARG 262.A NH1 ASP 208.A O no hydrogen 3.379 N/A ARG 262.A NH1 SER 212.A OG no hydrogen 3.163 N/A ARG 262.A NH2 SER 212.A OG no hydrogen 3.097 N/A ILE 263.A N LEU 259.A O no hydrogen 3.075 N/A ALA 264.A N CYS 260.A O no hydrogen 2.840 N/A GLU 265.A N GLU 261.A O no hydrogen 2.962 N/A CYS 266.A N ILE 263.A O no hydrogen 2.851 N/A CYS 266.A SG ILE 263.A O no hydrogen 3.158 N/A GLY 267.A N ALA 264.A O no hydrogen 3.073 N/A ARG 268.A NH1 SER 219.A OG no hydrogen 3.035 N/A ARG 268.A NH1 GLU 224.A O no hydrogen 2.472 N/A VAL 270.A N VAL 226.A O no hydrogen 2.610 N/A LEU 272.A N PRO 95.A O no hydrogen 3.241 N/A ASP 273.A N VAL 228.A O no hydrogen 2.919 N/A VAL 274.A N THR 97.A O no hydrogen 2.933 N/A VAL 275.A N TYR 230.A O no hydrogen 2.884 N/A GLU 276.A N GLY 100.A O no hydrogen 2.879 N/A ASN 278.A N ALA 242.A O no hydrogen 3.293 N/A LEU 281.A N ASN 278.A O no hydrogen 3.068 N/A LEU 281.A N ASN 278.A OD1 no hydrogen 3.137 N/A THR 284.A OG1 HIS 287.A ND1 no hydrogen 3.015 N/A SER 286.A N THR 284.A OG1 no hydrogen 3.245 N/A SER 286.A OG ASP 290.A OD1 no hydrogen 3.545 N/A HIS 287.A N THR 284.A O no hydrogen 3.135 N/A ASN 289.A N GLU 285.A O no hydrogen 3.036 N/A ASP 290.A N SER 286.A O no hydrogen 3.026 N/A THR 291.A N HIS 287.A O no hydrogen 3.141 N/A THR 291.A N VAL 288.A O no hydrogen 2.924 N/A THR 291.A OG1 HIS 287.A O no hydrogen 2.750 N/A ILE 292.A N VAL 288.A O no hydrogen 2.838 N/A SER 293.A N ASN 289.A O no hydrogen 2.876 N/A SER 293.A OG ASN 289.A O no hydrogen 2.667 N/A SER 293.A OG ASP 290.A O no hydrogen 3.333 N/A GLY 295.A N THR 291.A O no hydrogen 3.162 N/A CYS 296.A N ILE 292.A O no hydrogen 3.127 N/A CYS 296.A SG LEU 26.A O no hydrogen 3.597 N/A CYS 296.A SG ILE 292.A O no hydrogen 3.673 N/A ALA 297.A N SER 293.A O no hydrogen 2.934 N/A ILE 298.A N VAL 294.A O no hydrogen 2.929 N/A ALA 299.A N GLY 295.A O no hydrogen 3.229 N/A ARG 300.A N CYS 296.A O no hydrogen 2.910 N/A ARG 300.A NE ASP 34.A OD2 no hydrogen 3.416 N/A ARG 300.A NH1 GLU 305.A OE1 no hydrogen 2.633 N/A CYS 301.A N ALA 297.A O no hydrogen 2.902 N/A CYS 301.A SG ALA 297.A O no hydrogen 3.339 N/A MET 302.A N ILE 298.A O no hydrogen 2.799 N/A MET 303.A N ALA 299.A O no hydrogen 2.793 N/A GLU 305.A N ARG 300.A O no hydrogen 2.845 N/A THR 306.A OG1 LEU 308.A O no hydrogen 2.678 N/A THR 306.A OG1 THR 310.A OG1 no hydrogen 3.287 N/A THR 310.A OG1 THR 306.A OG1 no hydrogen 3.287 N/A