Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wnb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A N ASP 234.A OD1 no hydrogen 2.910 N/A SER 3.A OG ASP 234.A OD1 no hydrogen 3.237 N/A ARG 8.A NH2 VAL 6.A O no hydrogen 3.152 N/A HIS 11.A ND1 GLY 9.A O no hydrogen 3.007 N/A ALA 12.A N ASN 50.A O no hydrogen 3.210 N/A ASN 13.A ND2 GLY 239.A O no hydrogen 2.867 N/A VAL 14.A N VAL 51.A O no hydrogen 2.783 N/A ALA 15.A N ILE 74.A O no hydrogen 2.782 N/A ILE 16.A N VAL 53.A O no hydrogen 2.801 N/A ILE 17.A N VAL 76.A O no hydrogen 2.969 N/A THR 19.A OG1 ASP 85.A OD1 no hydrogen 3.148 N/A THR 19.A OG1 ASP 85.A OD2 no hydrogen 2.691 N/A SER 22.A OG THR 19.A O no hydrogen 2.755 N/A ARG 24.A NE THR 19.A O no hydrogen 3.126 N/A ARG 24.A NH1 TYR 58.A O no hydrogen 2.765 N/A ARG 24.A NH2 TYR 58.A O no hydrogen 3.089 N/A THR 25.A OG1 ASP 54.A OD2 no hydrogen 2.676 N/A LEU 27.A N GLY 23.A O no hydrogen 2.958 N/A ALA 28.A N ARG 24.A O no hydrogen 3.031 N/A ALA 29.A N THR 25.A O no hydrogen 2.783 N/A ASN 30.A N SER 26.A O no hydrogen 3.136 N/A ASN 30.A N LEU 27.A O no hydrogen 3.179 N/A ASN 30.A ND2 SER 26.A O no hydrogen 2.797 N/A LEU 31.A N ALA 28.A O no hydrogen 2.849 N/A LYS 33.A N ASN 43.A O no hydrogen 2.781 N/A SER 37.A OG THR 41.A OG1 no hydrogen 2.896 N/A SER 38.A N ILE 40.A O no hydrogen 2.737 N/A SER 38.A OG ASP 39.A OD1 no hydrogen 3.322 N/A SER 38.A OG HIS 186.A NE2 no hydrogen 2.842 N/A THR 41.A N ASP 54.A O no hydrogen 2.998 N/A THR 41.A OG1 SER 37.A OG no hydrogen 2.896 N/A ASN 43.A N LYS 33.A O no hydrogen 2.825 N/A ASN 44.A ND2 LEU 31.A O no hydrogen 2.928 N/A ASN 44.A ND2 GLU 47.A OE2 no hydrogen 2.858 N/A LYS 46.A N ASN 44.A OD1 no hydrogen 3.029 N/A ARG 49.A NE GLU 169.A OE2 no hydrogen 2.641 N/A ARG 49.A NH2 GLU 169.A OE1 no hydrogen 2.986 N/A ARG 49.A NH2 GLU 169.A OE2 no hydrogen 3.512 N/A ASN 50.A N HIS 11.A O no hydrogen 2.858 N/A PHE 52.A N TYR 42.A O no hydrogen 2.851 N/A VAL 53.A N VAL 14.A O no hydrogen 2.730 N/A ASP 54.A N THR 41.A O no hydrogen 2.817 N/A SER 57.A N SER 64.A OG no hydrogen 3.307 N/A SER 57.A OG ASP 39.A O no hydrogen 2.865 N/A TYR 58.A N ALA 55.A O no hydrogen 3.138 N/A TYR 58.A OH HIS 87.A O no hydrogen 3.387 N/A TYR 58.A OH GLU 90.A OE1 no hydrogen 2.514 N/A THR 61.A N SER 57.A O no hydrogen 2.799 N/A THR 61.A OG1 SER 57.A O no hydrogen 3.467 N/A SER 64.A N THR 61.A OG1 no hydrogen 3.300 N/A SER 64.A OG ASP 39.A O no hydrogen 3.000 N/A ILE 66.A N LEU 62.A O no hydrogen 2.820 N/A THR 67.A N LYS 63.A O no hydrogen 2.850 N/A THR 67.A OG1 LYS 63.A O no hydrogen 2.825 N/A ALA 68.A N SER 64.A O no hydrogen 3.124 N/A LEU 69.A N LEU 65.A O no hydrogen 2.939 N/A ASN 70.A N ILE 66.A O no hydrogen 2.745 N/A ASN 70.A ND2 GLY 293.A O no hydrogen 2.925 N/A ILE 71.A N THR 67.A O no hydrogen 3.122 N/A SER 72.A N LEU 69.A O no hydrogen 3.159 N/A SER 72.A OG ALA 68.A O no hydrogen 2.687 N/A ASP 73.A N ASN 13.A O no hydrogen 2.774 N/A ILE 74.A N ASN 13.A O no hydrogen 3.152 N/A ALA 75.A N HIS 102.A O no hydrogen 3.077 N/A VAL 76.A N ALA 15.A O no hydrogen 2.715 N/A LEU 77.A N ILE 104.A O no hydrogen 2.887 N/A CYS 78.A N ILE 17.A O no hydrogen 2.871 N/A CYS 78.A SG ILE 17.A O no hydrogen 3.792 N/A ILE 79.A N ALA 106.A O no hydrogen 2.874 N/A ASP 85.A N GLY 83.A O no hydrogen 2.885 N/A THR 88.A N ASP 85.A OD1 no hydrogen 2.867 N/A THR 88.A OG1 GLY 83.A O no hydrogen 2.775 N/A THR 88.A OG1 ASP 85.A OD1 no hydrogen 3.013 N/A GLY 89.A N ASP 85.A O no hydrogen 3.087 N/A GLU 90.A N ALA 86.A O no hydrogen 2.891 N/A CYS 91.A N HIS 87.A O no hydrogen 2.879 N/A CYS 91.A SG TYR 58.A OH no hydrogen 3.652 N/A CYS 91.A SG HIS 87.A O no hydrogen 3.475 N/A ILE 92.A N THR 88.A O no hydrogen 2.987 N/A ILE 93.A N GLY 89.A O no hydrogen 2.923 N/A ALA 94.A N GLU 90.A O no hydrogen 2.847 N/A LEU 95.A N CYS 91.A O no hydrogen 2.976 N/A ASP 96.A N ILE 92.A O no hydrogen 2.994 N/A LEU 97.A N ILE 93.A O no hydrogen 2.822 N/A LEU 98.A N ALA 94.A O no hydrogen 2.971 N/A GLY 99.A N ASP 96.A O no hydrogen 3.119 N/A PHE 100.A N LEU 95.A O no hydrogen 2.954 N/A HIS 102.A NE2 GLU 171.A OE1 no hydrogen 2.807 N/A ILE 104.A N ALA 75.A O no hydrogen 2.875 N/A ILE 105.A N GLU 137.A O no hydrogen 2.830 N/A ALA 106.A N LEU 77.A O no hydrogen 2.718 N/A LEU 107.A N ILE 139.A O no hydrogen 2.822 N/A THR 108.A N ILE 79.A O no hydrogen 3.215 N/A THR 108.A OG1 SER 22.A O no hydrogen 2.511 N/A SER 110.A N LEU 141.A O no hydrogen 2.943 N/A SER 110.A OG GLU 152.A OE2 no hydrogen 2.621 N/A SER 112.A N ARG 109.A O no hydrogen 2.899 N/A SER 112.A OG ARG 109.A O no hydrogen 2.681 N/A THR 113.A N SER 110.A O no hydrogen 3.238 N/A HIS 114.A N THR 113.A OG1 no hydrogen 2.714 N/A ILE 117.A N HIS 114.A O no hydrogen 2.880 N/A GLU 119.A N HIS 115.A O no hydrogen 3.279 N/A LEU 120.A N ALA 116.A O no hydrogen 2.898 N/A LYS 121.A N ILE 117.A O no hydrogen 2.915 N/A ALA 122.A N ASP 118.A O no hydrogen 3.031 N/A LYS 123.A N GLU 119.A O no hydrogen 3.029 N/A LEU 124.A N LEU 120.A O no hydrogen 2.947 N/A LYS 125.A N LYS 121.A O no hydrogen 2.879 N/A VAL 126.A N LYS 123.A O no hydrogen 3.001 N/A ILE 127.A N LYS 123.A O no hydrogen 3.146 N/A THR 128.A N LEU 124.A O no hydrogen 3.027 N/A THR 128.A OG1 LEU 124.A O no hydrogen 2.829 N/A SER 129.A N VAL 126.A O no hydrogen 3.370 N/A GLY 130.A N GLN 134.A OE1 no hydrogen 3.258 N/A THR 131.A N THR 128.A O no hydrogen 3.059 N/A THR 131.A OG1 THR 128.A O no hydrogen 2.683 N/A VAL 132.A N ASP 96.A OD1 no hydrogen 2.961 N/A LEU 133.A N THR 131.A OG1 no hydrogen 3.081 N/A GLN 134.A N THR 131.A O no hydrogen 3.115 N/A GLN 134.A NE2 ASP 135.A OD2 no hydrogen 3.149 N/A TRP 136.A N LEU 133.A O no hydrogen 2.928 N/A TRP 136.A NE1 LYS 101.A O no hydrogen 3.220 N/A ILE 139.A N ILE 105.A O no hydrogen 2.910 N/A LEU 141.A N LEU 107.A O no hydrogen 3.014 N/A ASN 142.A N GLU 152.A O no hydrogen 3.134 N/A ASN 142.A ND2 SER 110.A OG no hydrogen 2.967 N/A ASN 142.A ND2 ASN 149.A O no hydrogen 2.988 N/A ASN 144.A N ASN 142.A OD1 no hydrogen 2.927 N/A ASN 144.A ND2 ASP 111.A OD2 no hydrogen 2.937 N/A SER 146.A N ASN 144.A OD1 no hydrogen 3.100 N/A ALA 147.A N ASN 144.A O no hydrogen 3.225 N/A PHE 151.A N ASN 142.A OD1 no hydrogen 2.982 N/A GLU 152.A N ASN 149.A O no hydrogen 3.255 N/A VAL 154.A N PHE 151.A O no hydrogen 3.201 N/A LEU 157.A N GLY 153.A O no hydrogen 2.894 N/A LYS 158.A N VAL 154.A O no hydrogen 2.934 N/A ALA 159.A N ASP 155.A O no hydrogen 2.976 N/A ARG 160.A N GLU 156.A O no hydrogen 2.943 N/A ILE 161.A N LEU 157.A O no hydrogen 2.800 N/A ASN 162.A N LYS 158.A O no hydrogen 2.944 N/A GLU 163.A N ALA 159.A O no hydrogen 2.988 N/A VAL 164.A N ARG 160.A O no hydrogen 2.903 N/A ALA 165.A N ILE 161.A O no hydrogen 2.774 N/A GLU 166.A N ASN 162.A O no hydrogen 3.110 N/A ILE 168.A N VAL 164.A O no hydrogen 3.050 N/A GLU 169.A N ALA 165.A O no hydrogen 2.880 N/A ALA 170.A N GLU 166.A O no hydrogen 3.437 N/A GLU 171.A N LYS 167.A O no hydrogen 3.156 N/A ASN 172.A N ILE 168.A O no hydrogen 2.715 N/A ASN 172.A ND2 ASP 73.A OD2 no hydrogen 3.259 N/A ALA 173.A N GLU 169.A O no hydrogen 2.869 N/A GLU 174.A N ALA 170.A O no hydrogen 3.363 N/A GLU 174.A N GLU 171.A O no hydrogen 3.210 N/A LEU 175.A N ASN 172.A O no hydrogen 2.877 N/A ASN 176.A N ALA 173.A O no hydrogen 3.130 N/A SER 177.A OG GLU 174.A O no hydrogen 3.390 N/A LEU 178.A N LEU 175.A O no hydrogen 3.083 N/A ARG 181.A N GLN 203.A O no hydrogen 3.130 N/A ARG 181.A NE GLU 263.A OE2 no hydrogen 2.782 N/A ARG 181.A NH1 ASP 336.A OD1 no hydrogen 2.927 N/A ARG 181.A NH2 GLU 263.A OE1 no hydrogen 2.818 N/A ARG 181.A NH2 GLU 263.A OE2 no hydrogen 3.444 N/A ARG 181.A NH2 ASP 336.A OD2 no hydrogen 2.832 N/A ILE 182.A N ILE 259.A O no hydrogen 2.870 N/A PHE 183.A N VAL 200.A O no hydrogen 3.012 N/A ILE 184.A N PHE 257.A O no hydrogen 3.021 N/A ASP 185.A N LEU 198.A O no hydrogen 2.790 N/A HIS 186.A N LEU 198.A O no hydrogen 3.269 N/A HIS 186.A ND1 ASP 185.A OD1 no hydrogen 2.774 N/A HIS 186.A NE2 SER 38.A OG no hydrogen 2.842 N/A PHE 188.A N VAL 196.A O no hydrogen 2.959 N/A VAL 190.A N GLY 194.A O no hydrogen 3.114 N/A VAL 196.A N PHE 188.A O no hydrogen 3.012 N/A LEU 198.A N HIS 186.A O no hydrogen 2.870 N/A GLY 199.A N VAL 242.A O no hydrogen 3.018 N/A VAL 200.A N PHE 183.A O no hydrogen 3.044 N/A VAL 201.A N THR 240.A O no hydrogen 3.030 N/A LYS 202.A N ARG 181.A O no hydrogen 2.891 N/A LYS 202.A NZ ASN 70.A O no hydrogen 2.954 N/A GLN 203.A NE2 PRO 179.A O no hydrogen 2.838 N/A GLY 204.A N LEU 175.A O no hydrogen 2.897 N/A SER 206.A N ALA 236.A O no hydrogen 2.961 N/A LYS 207.A N ASP 210.A OD2 no hydrogen 2.938 N/A ASP 208.A N ASP 234.A O no hydrogen 2.807 N/A LYS 209.A N ILE 223.A O no hydrogen 2.795 N/A LYS 209.A NZ ASP 208.A OD1 no hydrogen 2.898 N/A LYS 209.A NZ ASP 208.A OD2 no hydrogen 2.927 N/A LYS 209.A NZ ARG 224.A O no hydrogen 3.056 N/A ASP 210.A N LYS 207.A O no hydrogen 3.082 N/A THR 212.A N ILE 221.A O no hydrogen 2.997 N/A THR 212.A OG1 ASP 261.A OD1 no hydrogen 2.785 N/A LYS 213.A N THR 212.A OG1 no hydrogen 2.722 N/A LYS 213.A N SER 260.A O no hydrogen 3.177 N/A LYS 213.A NZ ASP 218.A OD1 no hydrogen 3.037 N/A ILE 214.A N ARG 219.A O no hydrogen 2.988 N/A PHE 215.A N ILE 258.A O no hydrogen 2.776 N/A ASP 218.A N ILE 214.A O no hydrogen 2.849 N/A ARG 219.A N ILE 214.A O no hydrogen 3.258 N/A ARG 219.A NE ASN 247.A O no hydrogen 2.558 N/A ARG 219.A NH2 ASN 247.A O no hydrogen 3.401 N/A ILE 221.A N THR 212.A O no hydrogen 2.910 N/A GLU 222.A N LYS 246.A O no hydrogen 3.171 N/A ILE 223.A N ASP 210.A O no hydrogen 2.921 N/A ARG 224.A N ARG 244.A O no hydrogen 2.812 N/A GLN 227.A N GLY 243.A O no hydrogen 2.773 N/A GLN 227.A NE2 SER 225.A OG no hydrogen 2.772 N/A GLN 227.A NE2 ASP 232.A OD1 no hydrogen 2.716 N/A SER 228.A N VAL 231.A O no hydrogen 2.890 N/A VAL 231.A N SER 228.A O no hydrogen 3.046 N/A ILE 233.A N ILE 226.A O no hydrogen 2.824 N/A ASP 234.A N SER 3.A OG no hydrogen 3.148 N/A SER 235.A OG ASP 234.A OD2 no hydrogen 3.379 N/A ALA 236.A N SER 206.A O no hydrogen 2.832 N/A ALA 238.A N ASN 176.A OD1 no hydrogen 3.303 N/A GLY 239.A N VAL 201.A O no hydrogen 2.758 N/A THR 240.A N PRO 237.A O no hydrogen 3.041 N/A THR 240.A OG1 PRO 237.A O no hydrogen 2.856 N/A ARG 241.A NH1 ASP 185.A OD1 no hydrogen 2.776 N/A ARG 241.A NH1 ASP 185.A OD2 no hydrogen 3.295 N/A ARG 241.A NH2 ASP 185.A OD2 no hydrogen 2.680 N/A VAL 242.A N GLY 199.A O no hydrogen 2.846 N/A GLY 243.A N GLN 227.A O no hydrogen 2.911 N/A ARG 244.A N SER 225.A O no hydrogen 3.090 N/A LEU 245.A N CYS 195.A O no hydrogen 2.869 N/A LYS 246.A N GLU 222.A O no hydrogen 2.903 N/A ASN 247.A ND2 ASP 220.A O no hydrogen 2.850 N/A LYS 251.A NZ ASP 252.A OD1 no hydrogen 3.063 N/A LYS 251.A NZ ASP 252.A OD2 no hydrogen 3.500 N/A ASP 252.A N GLN 249.A O no hydrogen 2.845 N/A ILE 253.A N ALA 250.A O no hydrogen 3.025 N/A ARG 255.A NE ASP 185.A O no hydrogen 2.908 N/A ARG 255.A NH1 ASP 39.A OD1 no hydrogen 2.626 N/A ARG 255.A NH2 SER 38.A OG no hydrogen 2.974 N/A ARG 255.A NH2 ASP 185.A O no hydrogen 3.291 N/A GLY 256.A N ILE 184.A O no hydrogen 2.871 N/A PHE 257.A N GLU 254.A O no hydrogen 3.136 N/A ILE 258.A N PHE 215.A O no hydrogen 2.846 N/A ILE 259.A N ILE 182.A O no hydrogen 2.822 N/A SER 260.A N LYS 213.A O no hydrogen 3.021 N/A SER 260.A OG LYS 262.A O no hydrogen 3.118 N/A SER 260.A OG GLU 263.A OE2 no hydrogen 2.722 N/A LYS 262.A N SER 260.A OG no hydrogen 3.211 N/A ILE 264.A N TYR 332.A O no hydrogen 2.760 N/A THR 266.A N LEU 330.A O no hydrogen 3.139 N/A THR 266.A OG1 ASP 268.A O no hydrogen 2.873 N/A THR 266.A OG1 TYR 332.A OH no hydrogen 2.527 N/A TYR 269.A N LEU 324.A O no hydrogen 2.943 N/A LEU 271.A N LEU 322.A O no hydrogen 2.974 N/A GLU 272.A N PHE 354.A O no hydrogen 2.873 N/A CYS 273.A N CYS 320.A O no hydrogen 2.730 N/A CYS 273.A SG LEU 271.A O no hydrogen 3.612 N/A THR 274.A N TYR 352.A O no hydrogen 2.939 N/A VAL 275.A N SER 318.A O no hydrogen 2.866 N/A SER 276.A N ALA 350.A O no hydrogen 2.842 N/A PHE 278.A N SER 276.A OG no hydrogen 2.928 N/A LYS 281.A NZ GLU 313.A OE1 no hydrogen 3.342 N/A ILE 282.A N ALA 314.A O no hydrogen 2.973 N/A ALA 285.A N VAL 301.A O no hydrogen 2.696 N/A SER 286.A N GLU 283.A O no hydrogen 3.143 N/A SER 286.A OG GLU 283.A O no hydrogen 2.687 N/A LEU 288.A N VAL 299.A O no hydrogen 2.903 N/A HIS 289.A N ALA 341.A O no hydrogen 2.711 N/A LEU 290.A N GLU 297.A O no hydrogen 2.857 N/A PHE 291.A N LEU 339.A O no hydrogen 2.841 N/A VAL 292.A N GLN 295.A O no hydrogen 3.118 N/A GLN 295.A N VAL 292.A O no hydrogen 2.960 N/A GLU 297.A N LEU 290.A O no hydrogen 2.968 N/A VAL 299.A N LEU 288.A O no hydrogen 2.912 N/A ARG 300.A N SER 325.A O no hydrogen 2.819 N/A ARG 300.A NH1 ALA 285.A O no hydrogen 3.195 N/A VAL 301.A N SER 286.A O no hydrogen 2.891 N/A GLU 302.A N GLU 323.A O no hydrogen 2.765 N/A LYS 303.A N GLU 323.A O no hydrogen 3.389 N/A LEU 305.A N VAL 321.A O no hydrogen 2.885 N/A VAL 306.A N ASN 309.A O no hydrogen 2.758 N/A ASN 309.A N VAL 306.A O no hydrogen 2.877 N/A VAL 311.A N ILE 304.A O no hydrogen 2.955 N/A ALA 314.A N ILE 282.A O no hydrogen 2.881 N/A GLY 317.A N VAL 275.A O no hydrogen 2.997 N/A GLY 317.A N SER 276.A O no hydrogen 3.083 N/A SER 318.A N LYS 315.A O no hydrogen 3.178 N/A SER 318.A OG LYS 315.A O no hydrogen 2.755 N/A CYS 320.A N CYS 273.A O no hydrogen 2.936 N/A VAL 321.A N LEU 305.A O no hydrogen 2.861 N/A LEU 322.A N LEU 271.A O no hydrogen 2.835 N/A GLU 323.A N LYS 303.A O no hydrogen 2.843 N/A LEU 324.A N TYR 269.A O no hydrogen 2.723 N/A SER 325.A N ARG 300.A O no hydrogen 2.973 N/A SER 325.A OG GLU 302.A OE2 no hydrogen 2.630 N/A GLY 326.A N THR 267.A O no hydrogen 2.836 N/A LYS 328.A N GLU 297.A OE2 no hydrogen 3.410 N/A LEU 330.A N THR 266.A O no hydrogen 2.983 N/A TYR 332.A N ILE 264.A O no hydrogen 2.905 N/A TYR 332.A OH THR 266.A OG1 no hydrogen 2.527 N/A SER 333.A N ASP 336.A OD2 no hydrogen 3.049 N/A SER 333.A OG GLU 263.A OE1 no hydrogen 2.512 N/A GLN 335.A N GLN 335.A OE1 no hydrogen 2.847 N/A GLN 335.A NE2 GLN 203.A OE1 no hydrogen 3.188 N/A ASP 336.A N SER 333.A O no hydrogen 2.882 N/A ARG 337.A NH1 LEU 97.A O no hydrogen 2.688 N/A PHE 338.A N GLY 353.A O no hydrogen 2.863 N/A LEU 339.A N PHE 291.A O no hydrogen 2.817 N/A LEU 340.A N ALA 351.A O no hydrogen 2.854 N/A ALA 341.A N HIS 289.A O no hydrogen 2.807 N/A ASN 342.A N ARG 348.A O no hydrogen 2.799 N/A ASP 344.A N ASN 342.A OD1 no hydrogen 3.028 N/A LEU 345.A N ASN 342.A O no hydrogen 3.217 N/A ARG 348.A N GLU 90.A OE2 no hydrogen 2.817 N/A ARG 348.A NE GLU 90.A OE2 no hydrogen 2.800 N/A ARG 348.A NH1 PRO 59.A O no hydrogen 2.987 N/A ARG 348.A NH2 PRO 59.A O no hydrogen 2.875 N/A ARG 348.A NH2 GLU 90.A OE1 no hydrogen 2.831 N/A ARG 348.A NH2 GLU 90.A OE2 no hydrogen 3.546 N/A ALA 350.A N LEU 340.A O no hydrogen 2.706 N/A ALA 351.A N LEU 340.A O no hydrogen 3.230 N/A TYR 352.A N THR 274.A O no hydrogen 3.131 N/A GLY 353.A N PHE 338.A O no hydrogen 2.946 N/A PHE 354.A N GLU 272.A O no hydrogen 3.013 N/A SER 355.A OG LYS 356.A O no hydrogen 3.509 N/A LYS 356.A N THR 270.A O no hydrogen 2.789 N/A LYS 356.A NZ GLU 272.A OE2 no hydrogen 3.273 N/A