Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ix3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 11.A N GLU 89.A OE1 no hydrogen 2.869 N/A ARG 11.A NE GLU 89.A OE1 no hydrogen 2.951 N/A ARG 11.A NH1 GLU 64.A OE2 no hydrogen 2.887 N/A ARG 11.A NH2 GLU 64.A OE2 no hydrogen 3.281 N/A ARG 11.A NH2 GLU 89.A OE1 no hydrogen 3.423 N/A ARG 11.A NH2 GLU 89.A OE2 no hydrogen 3.006 N/A ARG 12.A NE GLU 89.A O no hydrogen 2.984 N/A ARG 12.A NH1 GLU 17.A OE2.A no hydrogen 3.550 N/A ARG 12.A NH2 GLU 89.A O no hydrogen 3.095 N/A THR 13.A OG1 CYS 87.A O no hydrogen 3.345 N/A VAL 16.A N THR 13.A O no hydrogen 2.957 N/A GLU 17.A N ASP 20.A OD2 no hydrogen 2.852 N/A ASP 20.A N GLU 17.A O no hydrogen 2.890 N/A ILE 21.A N PRO 18.A O no hydrogen 3.144 N/A ARG 22.A N VAL 40.A O no hydrogen 2.936 N/A VAL 23.A N GLY 101.A O no hydrogen 2.945 N/A LEU 24.A N ARG 38.A O no hydrogen 2.806 N/A LEU 28.A N VAL 36.A O no hydrogen 2.904 N/A GLY 31.A N GLY 34.A O no hydrogen 2.992 N/A THR 35.A N ASN 51.A O no hydrogen 3.005 N/A PHE 37.A N LEU 49.A O no hydrogen 2.781 N/A GLY 39.A N VAL 47.A O no hydrogen 2.873 N/A VAL 40.A N ARG 22.A O no hydrogen 2.826 N/A PHE 41.A N GLN 45.A O no hydrogen 2.771 N/A LYS 42.A N ASP 20.A O no hydrogen 2.795 N/A LYS 42.A NZ GLY 15.A O no hydrogen 2.887 N/A GLN 45.A N PHE 41.A O no hydrogen 3.019 N/A VAL 47.A N GLY 39.A O no hydrogen 2.998 N/A VAL 48.A N TRP 111.A O no hydrogen 2.860 N/A LEU 49.A N PHE 37.A O no hydrogen 2.841 N/A LYS 50.A N LEU 109.A O no hydrogen 2.900 N/A LYS 50.A NZ GLU 66.A OE1 no hydrogen 2.747 N/A LYS 50.A NZ GLU 66.A OE2 no hydrogen 3.569 N/A ASN 51.A N THR 35.A O no hydrogen 3.057 N/A LYS 53.A N PHE 33.A O no hydrogen 2.798 N/A VAL 56.A N LYS 53.A O no hydrogen 3.500 N/A ALA 59.A N VAL 56.A O no hydrogen 3.278 N/A LEU 62.A N ALA 58.A O no hydrogen 2.949 N/A LEU 63.A N ALA 59.A O no hydrogen 2.960 N/A GLU 64.A N GLU 60.A O no hydrogen 2.911 N/A CYS 65.A N GLU 61.A O no hydrogen 3.082 N/A GLU 66.A N LEU 62.A O no hydrogen 2.991 N/A MET 67.A N LEU 63.A O no hydrogen 2.847 N/A ASP 68.A N GLU 64.A O no hydrogen 2.961 N/A VAL 69.A N CYS 65.A O no hydrogen 2.941 N/A ASN 70.A N GLU 66.A O no hydrogen 2.894 N/A ASN 70.A ND2 GLU 66.A O no hydrogen 2.891 N/A TYR 71.A N MET 67.A O no hydrogen 2.899 N/A HIS 72.A N ASP 68.A O no hydrogen 3.015 N/A VAL 73.A N VAL 69.A O no hydrogen 2.897 N/A HIS 74.A N ASN 70.A O no hydrogen 2.891 N/A ALA 75.A N TYR 71.A O no hydrogen 2.990 N/A ASN 76.A N HIS 72.A O no hydrogen 2.957 N/A ASN 76.A N VAL 73.A O no hydrogen 3.272 N/A ASN 76.A ND2 HIS 72.A O no hydrogen 3.110 N/A ALA 77.A N VAL 73.A O no hydrogen 2.739 N/A LYS 78.A NZ HIS 74.A O no hydrogen 2.734 N/A THR 80.A N ALA 77.A O no hydrogen 3.241 N/A THR 80.A OG1 ALA 77.A O no hydrogen 2.788 N/A CYS 81.A SG THR 80.A OG1 no hydrogen 3.512 N/A ALA 82.A N LEU 186.A O no hydrogen 2.859 N/A ARG 83.A N GLU 114.A OE2 no hydrogen 2.927 N/A MET 85.A N MET 110.A O no hydrogen 2.820 N/A CYS 87.A N THR 13.A OG1 no hydrogen 2.910 N/A ILE 88.A N TRP 108.A O no hydrogen 2.890 N/A GLU 89.A N ARG 11.A O no hydrogen 3.043 N/A LEU 90.A N GLY 106.A O no hydrogen 2.968 N/A GLY 96.A N LEU 103.A O no hydrogen 2.751 N/A GLU 97.A N THR 102.A OG1 no hydrogen 2.838 N/A ASN 100.A N GLU 97.A O no hydrogen 2.940 N/A ASN 100.A ND2 GLU 97.A OE1 no hydrogen 3.097 N/A GLY 101.A N ILE 98.A O no hydrogen 2.843 N/A THR 102.A N GLU 97.A O no hydrogen 3.201 N/A THR 102.A OG1 GLU 97.A O no hydrogen 3.126 N/A GLY 106.A N LEU 90.A O no hydrogen 2.883 N/A LEU 107.A N GLU 60.A OE1 no hydrogen 3.259 N/A TRP 108.A N ILE 88.A O no hydrogen 2.875 N/A TRP 108.A NE1 THR 104.A O no hydrogen 2.818 N/A LEU 109.A N LYS 50.A O no hydrogen 2.883 N/A MET 110.A N GLY 86.A O no hydrogen 2.942 N/A TRP 111.A N VAL 48.A O no hydrogen 2.939 N/A TRP 111.A NE1 ASN 70.A OD1 no hydrogen 2.869 N/A ALA 112.A N ARG 83.A O no hydrogen 2.919 N/A ASN 113.A N ASP 46.A O no hydrogen 2.989 N/A ASN 113.A ND2 GLU 116.A OE2 no hydrogen 2.951 N/A GLY 115.A N ASN 113.A OD1 no hydrogen 2.955 N/A VAL 119.A N LEU 174.A O no hydrogen 2.860 N/A GLU 120.A N PRO 171.A O no hydrogen 3.160 N/A ALA 121.A N THR 118.A OG1 no hydrogen 3.019 N/A LEU 122.A N THR 118.A O no hydrogen 2.919 N/A MET 123.A N VAL 119.A O no hydrogen 2.797 N/A ARG 124.A N GLU 120.A O no hydrogen 3.171 N/A ARG 124.A NE ARG 266.A O no hydrogen 2.848 N/A ARG 124.A NH2 ARG 266.A O no hydrogen 2.978 N/A ARG 124.A NH2 ASP 268.A OD1 no hydrogen 2.816 N/A ARG 125.A N ALA 121.A O no hydrogen 3.069 N/A GLY 126.A N LEU 122.A O no hydrogen 2.992 N/A THR 127.A OG1 GLU 141.A OE2 no hydrogen 2.618 N/A LEU 130.A N GLY 126.A O no hydrogen 3.212 N/A ALA 131.A N THR 127.A O no hydrogen 2.827 N/A THR 132.A N ALA 128.A O no hydrogen 2.945 N/A THR 132.A OG1 ALA 128.A O no hydrogen 3.134 N/A ALA 133.A N PRO 129.A O no hydrogen 2.996 N/A MET 134.A N LEU 130.A O no hydrogen 2.957 N/A ALA 135.A N THR 132.A O no hydrogen 3.097 N/A CYS 136.A N ALA 131.A O no hydrogen 2.883 N/A CYS 136.A SG ASP 138.A O no hydrogen 3.482 N/A CYS 136.A SG GLY 143.A O no hydrogen 3.438 N/A THR 140.A OG1 ASP 138.A OD1 no hydrogen 2.701 N/A GLY 143.A N THR 140.A OG1 no hydrogen 3.023 N/A VAL 144.A N THR 140.A O no hydrogen 2.952 N/A THR 145.A N GLU 141.A O no hydrogen 2.964 N/A THR 145.A OG1 GLU 141.A O no hydrogen 2.741 N/A LYS 146.A N LEU 142.A O no hydrogen 2.941 N/A LYS 147.A N GLY 143.A O no hydrogen 3.112 N/A LYS 147.A NZ MET 134.A O no hydrogen 2.927 N/A LYS 147.A NZ GLU 151.A OE1 no hydrogen 2.791 N/A ALA 148.A N VAL 144.A O no hydrogen 2.875 N/A MET 149.A N THR 145.A O no hydrogen 2.867 N/A ARG 150.A N LYS 146.A O no hydrogen 3.042 N/A GLU 151.A N LYS 147.A O no hydrogen 3.164 N/A LEU 152.A N ALA 148.A O no hydrogen 2.817 N/A LEU 153.A N MET 149.A O no hydrogen 2.834 N/A GLY 154.A N ARG 150.A O no hydrogen 3.006 N/A SER 155.A N GLU 151.A O no hydrogen 2.966 N/A SER 155.A OG GLU 151.A O no hydrogen 3.263 N/A LEU 156.A N LEU 152.A O no hydrogen 2.829 N/A ALA 157.A N LEU 153.A O no hydrogen 2.862 N/A ARG 158.A N GLY 154.A O no hydrogen 3.089 N/A ARG 158.A NH1 LYS 78.A O no hydrogen 2.892 N/A ARG 158.A NH2 LYS 78.A O no hydrogen 2.816 N/A LEU 159.A N SER 155.A O no hydrogen 2.900 N/A HIS 160.A N LEU 156.A O no hydrogen 2.829 N/A HIS 160.A NE2 ASP 249.A OD2 no hydrogen 2.774 N/A GLU 161.A N ALA 157.A O no hydrogen 2.918 N/A CYS 162.A N ARG 158.A O no hydrogen 3.369 N/A CYS 162.A N LEU 159.A O no hydrogen 3.052 N/A CYS 162.A SG ARG 158.A O no hydrogen 3.731 N/A CYS 162.A SG LEU 159.A O no hydrogen 3.409 N/A GLY 163.A N HIS 160.A O no hydrogen 2.902 N/A VAL 164.A N LEU 159.A O no hydrogen 2.928 N/A VAL 165.A N ALA 193.A O no hydrogen 2.980 N/A HIS 166.A N ASP 249.A OD2 no hydrogen 2.914 N/A ARG 167.A N ASP 249.A OD1 no hydrogen 2.931 N/A ARG 167.A NH1.B ALA 191.A O no hydrogen 2.871 N/A ARG 167.A NH1.B ASN 203.A O no hydrogen 3.159 N/A ARG 167.A NH2.A LEU 221.A O no hydrogen 3.200 N/A LYS 170.A NZ ASP 168.A OD1 no hydrogen 3.171 N/A LYS 170.A NZ ASP 168.A OD2 no hydrogen 2.763 N/A LYS 170.A NZ ASP 212.A OD2 no hydrogen 2.783 N/A ASN 173.A N LYS 170.A O no hydrogen 2.922 N/A LEU 174.A N PRO 171.A O no hydrogen 3.164 N/A ILE 175.A N LYS 185.A O no hydrogen 2.887 N/A ALA 177.A N VAL 183.A O no hydrogen 2.892 N/A ASP 180.A N ALA 177.A O no hydrogen 2.928 N/A GLY 182.A N ALA 177.A O no hydrogen 2.767 N/A VAL 183.A N ASP 180.A O no hydrogen 3.258 N/A LEU 184.A N GLU 151.A OE2 no hydrogen 2.929 N/A LYS 185.A N ILE 175.A O no hydrogen 2.842 N/A LYS 185.A NZ GLU 114.A OE1 no hydrogen 2.886 N/A LYS 185.A NZ GLU 114.A OE2 no hydrogen 3.393 N/A LYS 185.A NZ ASP 180.A OD2 no hydrogen 2.838 N/A LEU 186.A N THR 80.A O no hydrogen 2.955 N/A ILE 187.A N ASN 173.A O no hydrogen 2.897 N/A GLY 190.A N ASP 188.A OD1 no hydrogen 3.002 N/A ALA 192.A N LEU 189.A O no hydrogen 3.061 N/A ALA 193.A N VAL 165.A O no hydrogen 2.934 N/A LEU 194.A N LEU 202.A O no hydrogen 2.931 N/A CYS 195.A N GLY 163.A O no hydrogen 2.734 N/A CYS 195.A SG ALA 193.A O no hydrogen 3.970 N/A LEU 202.A N LEU 194.A O no hydrogen 2.879 N/A ASN 203.A ND2 ALA 192.A O no hydrogen 3.102 N/A GLY 207.A N LEU 224.A O no hydrogen 2.831 N/A GLY 209.A N LEU 221.A O no hydrogen 3.092 N/A ARG 214.A N ASP 212.A OD1 no hydrogen 2.948 N/A ARG 214.A NE ASP 212.A OD1 no hydrogen 3.074 N/A ARG 214.A NH1 ASP 268.A OD1 no hydrogen 2.891 N/A ARG 214.A NH1 ASP 268.A OD2 no hydrogen 3.526 N/A ARG 214.A NH2 ASP 212.A OD2 no hydrogen 2.729 N/A TYR 215.A N ASP 212.A O no hydrogen 3.030 N/A LYS 217.A NZ ASP 219.A OD1 no hydrogen 2.630 N/A LYS 217.A NZ ASP 219.A OD2 no hydrogen 3.343 N/A LYS 217.A NZ GLU 220.A OE2 no hydrogen 3.026 N/A LYS 217.A NZ ALA 321.A O no hydrogen 3.414 N/A GLU 220.A N LYS 217.A O no hydrogen 2.903 N/A SER 228.A N PRO 225.A O no hydrogen 2.912 N/A SER 228.A OG PRO 229.A O no hydrogen 2.930 N/A ASP 234.A N THR 232.A OG1 no hydrogen 3.068 N/A ASN 235.A N THR 232.A OG1 no hydrogen 3.059 N/A LEU 239.A N ASN 235.A O no hydrogen 2.912 N/A TRP 240.A N ALA 236.A O no hydrogen 2.948 N/A GLU 241.A N ALA 237.A O no hydrogen 3.185 N/A ALA 242.A N LYS 238.A O no hydrogen 2.853 N/A HIS 243.A N LEU 239.A O no hydrogen 2.870 N/A LYS 244.A N TRP 240.A O no hydrogen 3.003 N/A LYS 244.A NZ GLU 241.A O no hydrogen 2.961 N/A LYS 244.A NZ ASP 324.A OD1 no hydrogen 2.762 N/A ARG 247.A N LYS 244.A O no hydrogen 2.874 N/A ARG 247.A NE ARG 326.A O no hydrogen 2.967 N/A ARG 247.A NH1 ASP 246.A OD1 no hydrogen 2.831 N/A PHE 248.A N PRO 245.A O no hydrogen 3.007 N/A SER 250.A N ASP 246.A O no hydrogen 3.258 N/A SER 250.A OG ALA 327.A O no hydrogen 2.803 N/A TRP 251.A N ARG 247.A O no hydrogen 3.173 N/A SER 252.A N PHE 248.A O no hydrogen 3.274 N/A SER 252.A OG TYR 215.A O no hydrogen 2.740 N/A SER 252.A OG PHE 248.A O no hydrogen 3.314 N/A ALA 253.A N ASP 249.A O no hydrogen 2.885 N/A GLY 254.A N SER 250.A O no hydrogen 2.978 N/A CYS 255.A N TRP 251.A O no hydrogen 3.075 N/A CYS 255.A SG ARG 214.A O no hydrogen 4.013 N/A CYS 255.A SG TRP 251.A O no hydrogen 3.639 N/A VAL 256.A N SER 252.A O no hydrogen 3.021 N/A MET 257.A N ALA 253.A O no hydrogen 2.902 N/A LEU 258.A N GLY 254.A O no hydrogen 2.958 N/A GLN 259.A N CYS 255.A O no hydrogen 3.160 N/A GLN 259.A NE2 TYR 215.A OH no hydrogen 2.570 N/A LEU 260.A N VAL 256.A O no hydrogen 2.936 N/A ALA 261.A N MET 257.A O no hydrogen 2.905 N/A VAL 262.A N LEU 258.A O no hydrogen 3.053 N/A LEU 265.A N VAL 262.A O no hydrogen 2.914 N/A ARG 266.A N VAL 263.A O no hydrogen 3.040 N/A ARG 266.A NE GLN 259.A O no hydrogen 2.819 N/A ARG 266.A NH1 MET 123.A O no hydrogen 3.144 N/A ARG 266.A NH1 THR 127.A OG1 no hydrogen 3.011 N/A ARG 266.A NH2 THR 127.A OG1 no hydrogen 2.943 N/A ARG 266.A NH2 LEU 260.A O no hydrogen 2.828 N/A GLY 270.A N THR 267.A OG1 no hydrogen 2.983 N/A LEU 271.A N THR 267.A O no hydrogen 3.133 N/A GLU 272.A N ASP 268.A O no hydrogen 2.902 N/A ARG 273.A N ALA 269.A O no hydrogen 2.931 N/A ARG 273.A NH2 GLU 295.A O no hydrogen 2.716 N/A PHE 274.A N GLY 270.A O no hydrogen 3.090 N/A LEU 275.A N LEU 271.A O no hydrogen 2.858 N/A ALA 276.A N GLU 272.A O no hydrogen 2.966 N/A ASP 277.A N ARG 273.A O no hydrogen 3.053 N/A TYR 278.A N PHE 274.A O no hydrogen 2.757 N/A TYR 278.A OH GLN 316.A OE1 no hydrogen 3.023 N/A TYR 278.A OH MET 319.A O no hydrogen 2.773 N/A LYS 279.A N LEU 275.A O no hydrogen 2.933 N/A ALA 280.A N ALA 276.A O no hydrogen 2.976 N/A VAL 281.A N ASP 277.A O no hydrogen 3.057 N/A VAL 281.A N TYR 278.A O no hydrogen 3.231 N/A GLY 282.A N LYS 279.A O no hydrogen 2.920 N/A TYR 283.A N TYR 278.A O no hydrogen 2.857 N/A ALA 287.A N ASP 284.A OD1 no hydrogen 2.856 N/A PHE 288.A N ASP 284.A O no hydrogen 2.896 N/A ARG 289.A N VAL 285.A O no hydrogen 2.901 N/A GLY 290.A N ASN 286.A O no hydrogen 2.952 N/A GLU 291.A N ALA 287.A O no hydrogen 2.772 N/A LYS 292.A N PHE 288.A O no hydrogen 2.848 N/A LYS 292.A NZ ASP 277.A OD1 no hydrogen 3.150 N/A SER 293.A N PHE 288.A O no hydrogen 2.916 N/A SER 293.A OG ARG 289.A O no hydrogen 2.859 N/A GLU 295.A N LYS 292.A O no hydrogen 2.806 N/A TYR 296.A N SER 293.A O no hydrogen 2.914 N/A TYR 296.A OH ASP 277.A OD2 no hydrogen 2.547 N/A MET 299.A N TYR 296.A O no hydrogen 3.166 N/A ALA 302.A N ASP 300.A OD1 no hydrogen 2.929 N/A LEU 304.A N PHE 301.A O no hydrogen 2.895 N/A ASP 305.A N PHE 301.A O no hydrogen 2.999 N/A ALA 306.A N ALA 302.A O no hydrogen 2.969 N/A GLY 309.A N ASP 305.A O no hydrogen 2.939 N/A ALA 310.A N ALA 306.A O no hydrogen 3.144 N/A TRP 312.A N LEU 304.A O no hydrogen 3.158 N/A TRP 312.A NE1 ASP 305.A OD1 no hydrogen 2.902 N/A ASP 313.A N GLY 309.A O no hydrogen 2.940 N/A LEU 314.A N ALA 310.A O no hydrogen 2.926 N/A CYS 315.A N GLY 311.A O no hydrogen 2.943 N/A CYS 315.A SG.A GLY 311.A O no hydrogen 3.522 N/A GLN 316.A N TRP 312.A O no hydrogen 2.928 N/A GLN 316.A NE2 TYR 283.A O no hydrogen 3.637 N/A ARG 317.A N ASP 313.A O no hydrogen 3.016 N/A ARG 317.A NE ASP 313.A OD1 no hydrogen 2.838 N/A ARG 317.A NH2 ASP 313.A OD1 no hydrogen 3.263 N/A LEU 318.A N LEU 314.A O no hydrogen 2.985 N/A MET 319.A N GLN 316.A O no hydrogen 3.228 N/A ARG 323.A NH1 LEU 223.A O no hydrogen 2.839 N/A ARG 323.A NH1 HIS 243.A O no hydrogen 2.999 N/A ARG 323.A NH2 TYR 222.A O no hydrogen 2.746 N/A ALA 325.A N GLU 322.A O no hydrogen 2.920 N/A ARG 326.A N ARG 323.A O no hydrogen 3.128 N/A ARG 326.A NE GLU 320.A O no hydrogen 2.887 N/A ARG 326.A NH1 GLU 220.A OE1 no hydrogen 3.428 N/A ARG 326.A NH1 ARG 247.A O no hydrogen 2.949 N/A ARG 326.A NH2 GLU 220.A OE1 no hydrogen 2.974 N/A ARG 326.A NH2 GLU 320.A O no hydrogen 2.985 N/A ARG 326.A NH2 ALA 321.A O no hydrogen 3.202 N/A ALA 327.A N ARG 317.A O no hydrogen 2.894 N/A CYS 329.A SG SER 250.A OG no hydrogen 3.671 N/A ALA 331.A N SER 328.A OG no hydrogen 2.917 N/A ALA 332.A N SER 328.A O no hydrogen 2.962 N/A LEU 333.A N CYS 329.A O no hydrogen 3.150 N/A LEU 333.A N GLU 330.A O no hydrogen 3.255 N/A SER 334.A N ALA 331.A O no hydrogen 3.085 N/A SER 334.A OG ALA 331.A O no hydrogen 2.715 N/A HIS 335.A N ALA 332.A O no hydrogen 3.012 N/A PHE 338.A N HIS 335.A O no hydrogen 2.905 N/A ASP 339.A N ALA 336.A O no hydrogen 2.922 N/A HIS 346.A NE2 GLU 344.A OE1 no hydrogen 2.383 N/A