Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3p2y_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 4.A N GLY 1.A O no hydrogen 2.934 N/A LEU 5.A N ASP 67.A OD2 no hydrogen 2.920 N/A ILE 6.A N GLU 35.A O no hydrogen 2.819 N/A GLY 7.A N VAL 68.A O no hydrogen 2.796 N/A VAL 8.A N VAL 37.A O no hydrogen 2.859 N/A ARG 10.A N GLU 39.A OE1 no hydrogen 2.887 N/A SER 12.A OG GLU 79.A OE2 no hydrogen 3.026 N/A GLU 16.A N ALA 13.A O no hydrogen 3.094 N/A ARG 17.A N GLU 16.A OE2 no hydrogen 3.086 N/A ARG 17.A NE GLY 45.A O no hydrogen 2.894 N/A ARG 17.A NH2 GLY 45.A O no hydrogen 3.056 N/A ARG 18.A N GLU 16.A OE2 no hydrogen 2.939 N/A ARG 18.A NE GLU 16.A OE2 no hydrogen 2.845 N/A ARG 18.A NH1 GLN 133.A OE1 no hydrogen 2.865 N/A ARG 18.A NH2 GLU 16.A OE1 no hydrogen 2.889 N/A VAL 19.A N SER 308.A OG no hydrogen 3.005 N/A VAL 25.A N VAL 22.A O no hydrogen 2.961 N/A VAL 26.A N VAL 22.A O no hydrogen 3.003 N/A GLU 27.A N PRO 23.A O no hydrogen 2.872 N/A LEU 29.A N VAL 25.A O no hydrogen 3.114 N/A SER 30.A N VAL 26.A O no hydrogen 2.862 N/A SER 30.A OG VAL 26.A O no hydrogen 3.260 N/A SER 30.A OG ALA 56.A O no hydrogen 2.938 N/A ALA 31.A N GLU 27.A O no hydrogen 2.899 N/A ARG 32.A N LYS 28.A O no hydrogen 3.197 N/A ARG 32.A N LEU 29.A O no hydrogen 3.135 N/A ARG 32.A NH1 ASP 320.A OD1 no hydrogen 2.740 N/A ARG 32.A NH2 ASP 320.A OD1 no hydrogen 2.909 N/A GLY 33.A N SER 30.A O no hydrogen 2.869 N/A LEU 34.A N LEU 29.A O no hydrogen 3.219 N/A GLU 35.A N THR 4.A O no hydrogen 3.062 N/A VAL 37.A N ILE 6.A O no hydrogen 2.897 N/A VAL 38.A N THR 59.A O no hydrogen 2.865 N/A GLU 39.A N VAL 8.A O no hydrogen 2.919 N/A SER 40.A OG ASP 50.A OD2 no hydrogen 2.673 N/A ALA 41.A N ASP 50.A OD1 no hydrogen 2.848 N/A ALA 42.A N GLU 39.A O no hydrogen 3.054 N/A ALA 44.A N ALA 41.A O no hydrogen 3.093 N/A ALA 46.A N GLY 43.A O no hydrogen 3.039 N/A LEU 47.A N ALA 44.A O no hydrogen 3.064 N/A PHE 48.A N GLY 43.A O no hydrogen 2.930 N/A SER 49.A N ASP 52.A OD2 no hydrogen 2.841 N/A ASP 52.A N SER 49.A OG no hydrogen 3.134 N/A TYR 53.A N SER 49.A O no hydrogen 3.383 N/A TYR 53.A OH LEU 21.A O no hydrogen 2.737 N/A GLU 54.A N ASP 50.A O no hydrogen 2.943 N/A ARG 55.A N ALA 51.A O no hydrogen 2.859 N/A ARG 55.A NH2 ASP 52.A OD1 no hydrogen 2.756 N/A ALA 56.A N ASP 52.A O no hydrogen 3.179 N/A ALA 56.A N TYR 53.A O no hydrogen 3.044 N/A GLY 57.A N GLU 54.A O no hydrogen 2.943 N/A ALA 58.A N TYR 53.A O no hydrogen 3.003 N/A THR 59.A N VAL 36.A O no hydrogen 2.933 N/A GLY 61.A N VAL 38.A O no hydrogen 3.000 N/A TRP 64.A N ASP 62.A OD1 no hydrogen 3.159 N/A ALA 66.A N PRO 63.A O no hydrogen 3.364 N/A VAL 68.A N LEU 5.A O no hydrogen 3.176 N/A VAL 69.A N VAL 88.A O no hydrogen 2.864 N/A VAL 70.A N GLY 7.A O no hydrogen 2.983 N/A LYS 71.A N ILE 90.A O no hydrogen 3.001 N/A LYS 71.A NZ GLU 11.A OE1 no hydrogen 2.994 N/A LYS 71.A NZ GLU 11.A OE2 no hydrogen 3.019 N/A LYS 71.A NZ ASN 73.A O no hydrogen 2.746 N/A VAL 72.A N GLU 11.A OE2 no hydrogen 2.853 N/A ASN 73.A N GLU 11.A OE1 no hydrogen 2.961 N/A THR 76.A N GLU 79.A OE1 no hydrogen 2.887 N/A GLU 79.A N THR 76.A OG1 no hydrogen 3.083 N/A ILE 80.A N THR 76.A O no hydrogen 2.861 N/A SER 81.A N SER 77.A O no hydrogen 3.031 N/A SER 81.A OG.A ASP 78.A O no hydrogen 2.632 N/A SER 81.A OG.A ASP 78.A OD1.B no hydrogen 3.504 N/A SER 81.A OG.B SER 77.A O no hydrogen 3.215 N/A GLN 82.A N GLU 79.A O no hydrogen 3.003 N/A GLN 82.A NE2 ASP 78.A O no hydrogen 3.249 N/A LEU 83.A N ILE 80.A O no hydrogen 3.059 N/A LYS 84.A NZ PRO 65.A O no hydrogen 3.146 N/A LYS 84.A NZ ASP 67.A OD1 no hydrogen 2.828 N/A GLY 86.A N ASP 109.A O no hydrogen 2.752 N/A SER 87.A N LYS 84.A O no hydrogen 3.154 N/A SER 87.A OG LYS 84.A O no hydrogen 2.699 N/A VAL 88.A N ASP 67.A O no hydrogen 2.935 N/A LEU 89.A N THR 111.A O no hydrogen 2.997 N/A ILE 90.A N VAL 69.A O no hydrogen 2.934 N/A GLY 91.A N PHE 113.A O no hydrogen 3.294 N/A PHE 92.A N VAL 72.A O no hydrogen 2.913 N/A LEU 93.A N GLU 116.A OE1 no hydrogen 2.873 N/A ALA 94.A N GLU 116.A OE2 no hydrogen 2.750 N/A GLN 98.A N ALA 94.A O no hydrogen 2.789 N/A LEU 101.A N GLN 98.A O no hydrogen 3.011 N/A ARG 104.A N GLU 100.A O no hydrogen 2.870 N/A ARG 104.A NH1 SER 77.A OG.A no hydrogen 2.654 N/A ARG 104.A NH1 SER 77.A OG.B no hydrogen 3.025 N/A ARG 104.A NH2 SER 77.A OG.A no hydrogen 3.031 N/A LEU 105.A N LEU 101.A O no hydrogen 2.908 N/A ARG 106.A N ALA 102.A O no hydrogen 2.922 N/A ILE 107.A N SER 103.A O no hydrogen 2.943 N/A ALA 108.A N ARG 104.A O no hydrogen 3.075 N/A ASP 109.A N ARG 106.A O no hydrogen 2.880 N/A VAL 110.A N LEU 105.A O no hydrogen 2.945 N/A THR 111.A N SER 87.A O no hydrogen 2.996 N/A ALA 112.A N THR 343.A OG1 no hydrogen 3.108 N/A PHE 113.A N LEU 89.A O no hydrogen 2.824 N/A ALA 114.A N SER 340.A O no hydrogen 2.870 N/A MET 115.A N GLY 91.A O no hydrogen 2.841 N/A GLU 116.A N GLU 116.A OE1 no hydrogen 2.852 N/A SER 117.A N ALA 114.A O no hydrogen 2.920 N/A ILE 118.A N MET 115.A O no hydrogen 3.326 N/A ARG 123.A NH1 ASP 334.A OD1 no hydrogen 3.087 N/A ARG 123.A NH1 ASP 334.A OD2 no hydrogen 3.552 N/A ARG 123.A NH1 GLU 335.A OE1.A no hydrogen 3.035 N/A ARG 123.A NH2 ASP 334.A OD2 no hydrogen 2.782 N/A ALA 124.A N ILE 121.A O no hydrogen 2.933 N/A GLN 125.A N SER 122.A O no hydrogen 3.116 N/A MET 127.A N ALA 124.A O no hydrogen 2.888 N/A ALA 129.A N MET 127.A O no hydrogen 2.956 N/A SER 131.A N ASP 128.A OD1 no hydrogen 3.013 N/A SER 131.A OG.B ASP 128.A OD2 no hydrogen 2.598 N/A SER 132.A N ASP 128.A O no hydrogen 3.104 N/A SER 132.A OG ALA 129.A O no hydrogen 3.348 N/A SER 132.A OG ASN 314.A OD1 no hydrogen 2.660 N/A GLN 133.A N ALA 129.A O no hydrogen 3.076 N/A GLN 133.A NE2 SER 132.A OG no hydrogen 3.095 N/A GLN 133.A NE2 ALA 307.A O no hydrogen 3.033 N/A ALA 134.A N LEU 130.A O no hydrogen 2.959 N/A ASN 135.A N SER 131.A O no hydrogen 2.869 N/A VAL 136.A N SER 132.A O no hydrogen 3.296 N/A ALA 137.A N GLN 133.A O no hydrogen 2.942 N/A GLY 138.A N ALA 134.A O no hydrogen 2.845 N/A TYR 139.A N ASN 135.A O no hydrogen 3.254 N/A LYS 140.A N VAL 136.A O no hydrogen 2.930 N/A LYS 140.A NZ THR 302.A O no hydrogen 3.146 N/A LYS 140.A NZ THR 302.A OG1 no hydrogen 2.824 N/A ALA 141.A N ALA 137.A O no hydrogen 2.781 N/A VAL 142.A N GLY 138.A O no hydrogen 3.372 N/A LEU 143.A N TYR 139.A O no hydrogen 3.248 N/A LEU 144.A N LYS 140.A O no hydrogen 2.953 N/A GLY 145.A N ALA 141.A O no hydrogen 2.922 N/A ALA 146.A N VAL 142.A O no hydrogen 2.859 N/A SER 147.A N LEU 143.A O no hydrogen 2.851 N/A SER 147.A OG LEU 143.A O no hydrogen 2.689 N/A LEU 148.A N LEU 144.A O no hydrogen 2.954 N/A SER 149.A N GLY 145.A O no hydrogen 2.992 N/A SER 149.A OG ARG 151.A O no hydrogen 3.079 N/A ARG 151.A N SER 149.A OG no hydrogen 3.116 N/A ARG 151.A NH1 PRO 262.A O no hydrogen 2.797 N/A ARG 151.A NH2 ASP 235.A OD1 no hydrogen 2.920 N/A ARG 151.A NH2 SER 264.A OG no hydrogen 3.262 N/A LEU 156.A N VAL 163.A O no hydrogen 3.267 N/A THR 158.A N GLY 161.A O no hydrogen 2.945 N/A THR 158.A OG1 GLY 161.A O no hydrogen 2.590 N/A GLY 161.A N THR 158.A O no hydrogen 3.260 N/A GLY 161.A N THR 158.A OG1 no hydrogen 3.077 N/A VAL 163.A N LEU 156.A O no hydrogen 2.924 N/A ALA 166.A N VAL 153.A O no hydrogen 2.833 N/A SER 167.A N ASP 235.A OD2 no hydrogen 2.848 N/A SER 167.A OG.B LYS 233.A O no hydrogen 3.438 N/A SER 167.A OG.B ASP 235.A OD2 no hydrogen 3.347 N/A ALA 168.A N LYS 190.A O no hydrogen 2.766 N/A LEU 169.A N ILE 236.A O no hydrogen 2.933 N/A VAL 170.A N THR 192.A O no hydrogen 2.922 N/A LEU 171.A N ILE 238.A O no hydrogen 2.800 N/A GLY 172.A N TYR 194.A O no hydrogen 2.860 N/A VAL 173.A N ASP 195.A OD2 no hydrogen 2.745 N/A LEU 178.A N GLY 174.A O no hydrogen 2.909 N/A GLN 179.A N VAL 175.A O no hydrogen 3.089 N/A GLN 179.A NE2 ASN 135.A OD1 no hydrogen 2.942 N/A ALA 180.A N ALA 176.A O no hydrogen 2.803 N/A LEU 181.A N GLY 177.A O no hydrogen 2.933 N/A ALA 182.A N LEU 178.A O no hydrogen 3.023 N/A THR 183.A N GLN 179.A O no hydrogen 2.837 N/A THR 183.A OG1 GLN 179.A O no hydrogen 3.031 N/A THR 183.A OG1 GLN 179.A OE1 no hydrogen 3.344 N/A ALA 184.A N ALA 180.A O no hydrogen 2.886 N/A LYS 185.A N LEU 181.A O no hydrogen 3.029 N/A ARG 186.A N ALA 182.A O no hydrogen 3.004 N/A LEU 187.A N THR 183.A O no hydrogen 3.120 N/A GLY 188.A N LYS 185.A O no hydrogen 2.960 N/A ALA 189.A N ALA 184.A O no hydrogen 2.973 N/A LYS 190.A N ALA 166.A O no hydrogen 2.904 N/A THR 192.A N ALA 168.A O no hydrogen 2.920 N/A GLY 193.A N GLN 210.A O no hydrogen 2.786 N/A TYR 194.A N VAL 170.A O no hydrogen 2.904 N/A ARG 197.A N ASP 195.A OD1 no hydrogen 2.793 N/A ARG 197.A NE ASP 195.A OD1 no hydrogen 2.795 N/A ARG 197.A NH2 ASP 195.A OD2 no hydrogen 2.992 N/A GLU 199.A N GLU 199.A OE1 no hydrogen 2.740 N/A VAL 200.A N ARG 197.A O no hydrogen 3.154 N/A ALA 201.A N PRO 198.A O no hydrogen 3.089 N/A GLU 202.A N GLU 202.A OE1.A no hydrogen 2.859 N/A VAL 204.A N VAL 200.A O no hydrogen 3.019 N/A ARG 205.A N ALA 201.A O no hydrogen 2.916 N/A SER 206.A N GLU 202.A O no hydrogen 2.941 N/A SER 206.A OG GLN 203.A O no hydrogen 2.637 N/A VAL 207.A N VAL 204.A O no hydrogen 3.345 N/A GLY 208.A N ARG 205.A O no hydrogen 2.954 N/A ALA 209.A N VAL 204.A O no hydrogen 3.233 N/A GLN 210.A N THR 191.A O no hydrogen 2.889 N/A LEU 212.A N GLY 193.A O no hydrogen 2.946 N/A ARG 220.A N SER 216.A O no hydrogen 2.877 N/A GLN 222.A N ALA 218.A O no hydrogen 3.286 N/A GLN 223.A N GLU 219.A O no hydrogen 2.963 N/A GLN 224.A N ARG 220.A O no hydrogen 3.042 N/A GLN 225.A N ALA 221.A O no hydrogen 2.947 N/A GLN 225.A NE2 GLU 228.A OE2 no hydrogen 3.351 N/A GLN 225.A NE2 ASP 229.A OD1 no hydrogen 3.018 N/A ALA 226.A N GLN 222.A O no hydrogen 2.799 N/A LEU 227.A N GLN 223.A O no hydrogen 2.775 N/A GLU 228.A N GLN 224.A O no hydrogen 2.885 N/A ASP 229.A N GLN 225.A O no hydrogen 2.941 N/A ALA 230.A N ALA 226.A O no hydrogen 2.940 N/A ILE 231.A N LEU 227.A O no hydrogen 2.996 N/A THR 232.A N ASP 229.A O no hydrogen 3.288 N/A THR 232.A OG1 ASP 229.A O no hydrogen 2.731 N/A LYS 233.A N ALA 230.A O no hydrogen 3.025 N/A PHE 234.A N ILE 231.A O no hydrogen 3.140 N/A ASP 235.A N SER 167.A O no hydrogen 2.942 N/A ILE 236.A N SER 167.A O no hydrogen 3.203 N/A VAL 237.A N VAL 265.A O no hydrogen 2.850 N/A ILE 238.A N LEU 169.A O no hydrogen 2.842 N/A THR 239.A N VAL 267.A O no hydrogen 2.866 N/A THR 239.A OG1 ASP 268.A OD1 no hydrogen 3.218 N/A THR 239.A OG1 ASN 276.A OD1 no hydrogen 2.843 N/A THR 240.A N LEU 171.A O no hydrogen 2.860 N/A THR 240.A OG1 GLY 172.A O no hydrogen 2.624 N/A ARG 246.A N VAL 243.A O no hydrogen 3.022 N/A ALA 248.A N THR 273.A O no hydrogen 2.868 N/A LEU 251.A N ASN 276.A O no hydrogen 2.800 N/A VAL 252.A N ASN 276.A O no hydrogen 3.037 N/A THR 253.A OG1 GLU 228.A OE1 no hydrogen 2.734 N/A ALA 254.A N GLU 278.A OE1 no hydrogen 2.801 N/A ALA 256.A N THR 253.A OG1 no hydrogen 3.037 N/A ALA 257.A N THR 253.A O no hydrogen 3.134 N/A THR 258.A N ALA 254.A O no hydrogen 2.950 N/A THR 258.A OG1 ALA 254.A O no hydrogen 2.710 N/A GLY 259.A N ALA 255.A O no hydrogen 2.925 N/A GLY 259.A N ALA 256.A O no hydrogen 3.253 N/A MET 260.A N ALA 257.A O no hydrogen 3.149 N/A GLY 263.A N GLY 290.A O no hydrogen 2.744 N/A SER 264.A N GLN 261.A O no hydrogen 3.088 N/A SER 264.A OG GLN 261.A O no hydrogen 2.694 N/A VAL 265.A N ASP 235.A O no hydrogen 2.883 N/A VAL 266.A N THR 292.A O no hydrogen 2.802 N/A VAL 267.A N VAL 237.A O no hydrogen 2.683 N/A ASP 268.A N THR 294.A O no hydrogen 2.958 N/A LEU 269.A N THR 239.A O no hydrogen 2.950 N/A ALA 270.A N ASP 268.A OD1 no hydrogen 3.000 N/A THR 273.A N ALA 270.A O no hydrogen 3.014 N/A THR 273.A OG1 ALA 270.A O no hydrogen 3.378 N/A GLY 274.A N GLY 271.A O no hydrogen 3.103 N/A GLY 275.A N ALA 270.A O no hydrogen 2.819 N/A ASN 276.A N ASP 268.A OD1 no hydrogen 2.945 N/A ASN 276.A ND2 ALA 241.A O no hydrogen 2.935 N/A ASN 276.A ND2 PRO 249.A O no hydrogen 2.862 N/A CYS 277.A N ASP 268.A OD2 no hydrogen 2.877 N/A CYS 277.A SG VAL 252.A O no hydrogen 3.731 N/A GLU 278.A N VAL 252.A O no hydrogen 3.041 N/A THR 280.A N CYS 277.A O no hydrogen 3.064 N/A THR 280.A OG1 ASP 268.A OD2 no hydrogen 2.527 N/A THR 280.A OG1 CYS 277.A O no hydrogen 3.422 N/A GLY 283.A N SER 295.A O no hydrogen 2.785 N/A ARG 284.A N GLU 281.A O no hydrogen 2.998 N/A THR 285.A OG1 THR 294.A OG1 no hydrogen 2.691 N/A ILE 286.A N ILE 293.A O no hydrogen 2.945 N/A HIS 288.A N VAL 291.A O no hydrogen 2.804 N/A HIS 289.A ND1.B THR 258.A O no hydrogen 3.139 N/A VAL 291.A N HIS 288.A O no hydrogen 2.918 N/A THR 292.A N SER 264.A O no hydrogen 2.976 N/A ILE 293.A N ILE 286.A O no hydrogen 2.799 N/A THR 294.A N VAL 266.A O no hydrogen 2.868 N/A THR 294.A OG1 THR 285.A OG1 no hydrogen 2.691 N/A SER 295.A N ARG 284.A O no hydrogen 3.046 N/A ASN 298.A ND2 GLU 16.A OE1 no hydrogen 2.987 N/A ALA 301.A N ASN 298.A OD1 no hydrogen 3.229 N/A THR 302.A N LEU 299.A O no hydrogen 2.903 N/A THR 302.A OG1 LEU 299.A O no hydrogen 2.646 N/A MET 303.A N PRO 300.A O no hydrogen 3.110 N/A ALA 307.A N MET 303.A O no hydrogen 3.079 N/A SER 308.A N PRO 304.A O no hydrogen 2.975 N/A SER 308.A OG VAL 19.A O no hydrogen 3.322 N/A SER 308.A OG PRO 304.A O no hydrogen 2.657 N/A GLU 309.A N GLU 305.A O no hydrogen 2.845 N/A LEU 310.A N HIS 306.A O no hydrogen 3.064 N/A TYR 311.A N ALA 307.A O no hydrogen 3.063 N/A TYR 311.A OH LYS 71.A O no hydrogen 2.742 N/A ALA 312.A N SER 308.A O no hydrogen 2.760 N/A LYS 313.A N GLU 309.A O no hydrogen 3.061 N/A ASN 314.A N LEU 310.A O no hydrogen 2.978 N/A ASN 314.A ND2 THR 126.A O no hydrogen 2.939 N/A VAL 315.A N TYR 311.A O no hydrogen 2.857 N/A THR 316.A N ALA 312.A O no hydrogen 2.906 N/A THR 316.A OG1 ALA 312.A O no hydrogen 2.924 N/A THR 316.A OG1 LYS 313.A O no hydrogen 3.300 N/A ALA 317.A N LYS 313.A O no hydrogen 2.950 N/A LEU 318.A N ASN 314.A O no hydrogen 3.226 N/A LEU 319.A N VAL 315.A O no hydrogen 2.818 N/A ASP 320.A N THR 316.A O no hydrogen 2.893 N/A LEU 321.A N LEU 318.A O no hydrogen 2.930 N/A LEU 322.A N LEU 318.A O no hydrogen 3.386 N/A LEU 322.A N LEU 319.A O no hydrogen 2.817 N/A LEU 323.A N LEU 319.A O no hydrogen 2.969 N/A THR 324.A N GLY 327.A O no hydrogen 2.878 N/A THR 324.A OG1 GLY 327.A O no hydrogen 3.521 N/A ASP 326.A N THR 324.A OG1 no hydrogen 3.201 N/A GLY 327.A N THR 324.A O no hydrogen 3.131 N/A ALA 329.A N LEU 322.A O no hydrogen 2.808 N/A THR 333.A N ASP 331.A OD1 no hydrogen 2.949 N/A THR 333.A OG1 ASP 331.A OD1 no hydrogen 2.653 N/A THR 333.A OG1 ASP 331.A OD2 no hydrogen 3.199 N/A ASP 334.A N ASP 331.A O no hydrogen 3.013 N/A GLU 335.A N GLU 335.A OE2.A no hydrogen 2.863 N/A ILE 336.A N ASP 334.A OD1 no hydrogen 2.861 N/A ALA 338.A N ASP 334.A O no hydrogen 2.945 N/A ALA 339.A N GLU 335.A O no hydrogen 2.933 N/A SER 340.A N ILE 336.A O no hydrogen 3.051 N/A SER 340.A OG ILE 336.A O no hydrogen 2.813 N/A CYS 341.A N VAL 337.A O no hydrogen 3.185 N/A CYS 341.A SG ALA 112.A O no hydrogen 3.710 N/A CYS 341.A SG THR 343.A OG1 no hydrogen 3.378 N/A ILE 342.A N ALA 112.A O no hydrogen 2.918 N/A