Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8xoa_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NH1 VAL 112.A O no hydrogen 3.031 N/A LEU 6.A N ARG 2.A O no hydrogen 3.308 N/A PHE 7.A N LYS 3.A O no hydrogen 2.885 N/A ILE 8.A N LEU 4.A O no hydrogen 2.891 N/A VAL 9.A N ILE 5.A O no hydrogen 2.918 N/A PHE 10.A N LEU 6.A O no hydrogen 2.881 N/A LEU 11.A N PHE 7.A O no hydrogen 2.875 N/A ALA 12.A N ILE 8.A O no hydrogen 2.819 N/A LEU 13.A N VAL 9.A O no hydrogen 2.943 N/A LEU 14.A N PHE 10.A O no hydrogen 2.893 N/A LEU 15.A N LEU 11.A O no hydrogen 2.862 N/A ASP 16.A N ALA 12.A O no hydrogen 2.915 N/A ASN 17.A N LEU 13.A O no hydrogen 2.942 N/A ASN 17.A ND2 LEU 13.A O no hydrogen 2.393 N/A MET 18.A N LEU 14.A O no hydrogen 2.852 N/A LEU 19.A N LEU 15.A O no hydrogen 2.939 N/A LEU 20.A N ASP 16.A O no hydrogen 2.910 N/A THR 21.A N ASN 17.A O no hydrogen 2.900 N/A THR 21.A OG1 ASN 17.A O no hydrogen 3.051 N/A THR 21.A OG1 MET 18.A O no hydrogen 3.522 N/A THR 21.A OG1 GLY 133.A O no hydrogen 3.564 N/A VAL 22.A N MET 18.A O no hydrogen 2.848 N/A VAL 22.A N LEU 19.A O no hydrogen 3.285 N/A VAL 23.A N LEU 19.A O no hydrogen 2.997 N/A TYR 30.A N ILE 26.A O no hydrogen 2.595 N/A LEU 31.A N ILE 27.A O no hydrogen 2.456 N/A TYR 32.A N PRO 28.A O no hydrogen 2.811 N/A PHE 37.A N VAL 33.A O no hydrogen 2.938 N/A ALA 38.A N GLY 34.A O no hydrogen 2.915 N/A SER 39.A N LEU 36.A O no hydrogen 3.431 N/A SER 39.A OG LEU 36.A O no hydrogen 2.714 N/A LYS 40.A NZ GLN 44.A OE1 no hydrogen 3.369 N/A THR 42.A N ALA 38.A O no hydrogen 2.898 N/A THR 42.A OG1 ALA 38.A O no hydrogen 2.676 N/A VAL 43.A N SER 39.A O no hydrogen 2.885 N/A GLN 44.A N LYS 40.A O no hydrogen 2.939 N/A GLN 44.A NE2 ASP 328.A OD2 no hydrogen 2.346 N/A LEU 45.A N ALA 41.A O no hydrogen 2.854 N/A ILE 46.A N THR 42.A O no hydrogen 2.927 N/A THR 47.A N VAL 43.A O no hydrogen 2.910 N/A ASN 48.A N GLN 44.A O no hydrogen 2.907 N/A ASN 48.A ND2 ASP 328.A OD2 no hydrogen 3.239 N/A ILE 51.A N THR 47.A O no hydrogen 3.056 N/A GLY 52.A N ASN 48.A O no hydrogen 2.919 N/A LEU 53.A N PRO 49.A O no hydrogen 2.930 N/A LEU 54.A N PHE 50.A O no hydrogen 2.834 N/A THR 55.A N ILE 51.A O no hydrogen 2.927 N/A THR 55.A OG1 ILE 51.A O no hydrogen 2.994 N/A THR 55.A OG1 GLY 52.A O no hydrogen 3.226 N/A ASN 56.A N LEU 53.A O no hydrogen 3.121 N/A ASN 56.A ND2 GLN 182.A O no hydrogen 3.686 N/A ARG 57.A N LEU 54.A O no hydrogen 2.928 N/A ILE 58.A N LEU 54.A O no hydrogen 2.944 N/A GLY 59.A N THR 55.A O no hydrogen 3.095 N/A ILE 64.A N TYR 60.A O no hydrogen 2.975 N/A PHE 65.A N PRO 61.A O no hydrogen 2.844 N/A ALA 66.A N ILE 62.A O no hydrogen 3.131 N/A GLY 67.A N PRO 63.A O no hydrogen 3.072 N/A PHE 68.A N ILE 64.A O no hydrogen 3.311 N/A CYS 69.A N PHE 65.A O no hydrogen 3.112 N/A CYS 69.A SG PHE 65.A O no hydrogen 3.717 N/A ILE 70.A N ALA 66.A O no hydrogen 2.847 N/A MET 71.A N GLY 67.A O no hydrogen 2.861 N/A PHE 72.A N PHE 68.A O no hydrogen 2.676 N/A VAL 73.A N CYS 69.A O no hydrogen 2.987 N/A SER 74.A N ILE 70.A O no hydrogen 2.704 N/A SER 74.A OG ALA 90.A O no hydrogen 3.041 N/A THR 75.A N MET 71.A O no hydrogen 2.718 N/A THR 75.A OG1 MET 71.A O no hydrogen 2.661 N/A ILE 76.A N PHE 72.A O no hydrogen 2.787 N/A MET 77.A N VAL 73.A O no hydrogen 2.753 N/A PHE 78.A N SER 74.A O no hydrogen 2.851 N/A ALA 79.A N THR 75.A O no hydrogen 2.986 N/A PHE 80.A N ILE 76.A O no hydrogen 3.176 N/A SER 81.A N MET 77.A O no hydrogen 2.612 N/A SER 81.A OG MET 77.A O no hydrogen 2.601 N/A SER 82.A OG SER 82.A O no hydrogen 2.452 N/A LEU 87.A N SER 83.A O no hydrogen 2.756 N/A LEU 88.A N TYR 84.A O no hydrogen 2.863 N/A ILE 89.A N ALA 85.A O no hydrogen 2.923 N/A ALA 90.A N PHE 86.A O no hydrogen 2.869 N/A ARG 91.A N LEU 87.A O no hydrogen 2.848 N/A SER 92.A N LEU 88.A O no hydrogen 2.910 N/A SER 92.A OG LEU 88.A O no hydrogen 3.019 N/A LEU 93.A N ILE 89.A O no hydrogen 2.878 N/A GLN 94.A N ALA 90.A O no hydrogen 2.849 N/A GLY 95.A N ARG 91.A O no hydrogen 2.885 N/A ILE 96.A N SER 92.A O no hydrogen 2.929 N/A GLY 97.A N LEU 93.A O no hydrogen 2.884 N/A SER 98.A N GLN 94.A O no hydrogen 2.794 N/A SER 98.A OG GLN 44.A OE1 no hydrogen 3.137 N/A SER 98.A OG GLN 94.A O no hydrogen 2.938 N/A SER 98.A OG GLY 95.A O no hydrogen 2.743 N/A SER 99.A N GLY 95.A O no hydrogen 2.894 N/A CYS 100.A N ILE 96.A O no hydrogen 2.954 N/A CYS 100.A SG ILE 96.A O no hydrogen 3.176 N/A SER 101.A N GLY 97.A O no hydrogen 2.864 N/A SER 101.A OG GLY 97.A O no hydrogen 3.343 N/A SER 102.A N SER 98.A O no hydrogen 2.830 N/A SER 102.A OG SER 98.A O no hydrogen 3.332 N/A VAL 103.A N SER 99.A O no hydrogen 2.942 N/A ALA 104.A N CYS 100.A O no hydrogen 2.910 N/A GLY 105.A N SER 101.A O no hydrogen 2.824 N/A MET 106.A N SER 102.A O no hydrogen 2.929 N/A GLY 107.A N VAL 103.A O no hydrogen 2.906 N/A MET 108.A N ALA 104.A O no hydrogen 2.851 N/A LEU 109.A N GLY 105.A O no hydrogen 2.859 N/A ALA 110.A N MET 106.A O no hydrogen 2.912 N/A SER 111.A N GLY 107.A O no hydrogen 2.865 N/A SER 111.A OG GLY 107.A O no hydrogen 3.011 N/A SER 111.A OG MET 108.A O no hydrogen 3.178 N/A VAL 112.A N MET 108.A O no hydrogen 2.866 N/A TYR 113.A N LEU 109.A O no hydrogen 2.904 N/A ARG 119.A N ASP 115.A O no hydrogen 3.012 N/A ARG 119.A NE TYR 113.A O no hydrogen 3.343 N/A ARG 119.A NH1 ASP 313.A OD2 no hydrogen 3.321 N/A ARG 119.A NH2 ALA 110.A O no hydrogen 2.642 N/A ARG 119.A NH2 TYR 320.A OH no hydrogen 3.314 N/A ASN 121.A N GLU 117.A O no hydrogen 2.921 N/A VAL 122.A N GLU 118.A O no hydrogen 2.874 N/A MET 123.A N ARG 119.A O no hydrogen 2.939 N/A GLY 124.A N GLY 120.A O no hydrogen 2.880 N/A ILE 125.A N ASN 121.A O no hydrogen 3.207 N/A ALA 126.A N VAL 122.A O no hydrogen 2.890 N/A LEU 127.A N MET 123.A O no hydrogen 2.849 N/A GLY 128.A N GLY 124.A O no hydrogen 2.841 N/A GLY 129.A N ILE 125.A O no hydrogen 2.756 N/A LEU 130.A N ALA 126.A O no hydrogen 3.245 N/A ALA 131.A N LEU 127.A O no hydrogen 2.893 N/A MET 132.A N GLY 128.A O no hydrogen 2.839 N/A GLY 133.A N GLY 129.A O no hydrogen 2.894 N/A VAL 134.A N LEU 130.A O no hydrogen 2.933 N/A LEU 135.A N ALA 131.A O no hydrogen 2.893 N/A VAL 136.A N MET 132.A O no hydrogen 2.905 N/A PHE 140.A N VAL 136.A O no hydrogen 3.353 N/A GLY 141.A N GLY 137.A O no hydrogen 2.892 N/A SER 142.A N PRO 138.A O no hydrogen 2.896 N/A VAL 143.A N PRO 139.A O no hydrogen 2.940 N/A LEU 144.A N PHE 140.A O no hydrogen 2.994 N/A TYR 145.A N GLY 141.A O no hydrogen 2.866 N/A GLU 146.A N SER 142.A O no hydrogen 2.937 N/A PHE 147.A N VAL 143.A O no hydrogen 2.960 N/A GLY 149.A N LEU 144.A O no hydrogen 3.342 N/A THR 151.A OG1 ALA 79.A O no hydrogen 3.227 N/A ALA 152.A N GLY 149.A O no hydrogen 3.436 N/A LEU 155.A N THR 151.A O no hydrogen 3.211 N/A VAL 156.A N ALA 152.A O no hydrogen 3.275 N/A LEU 157.A N PRO 153.A O no hydrogen 3.224 N/A ALA 158.A N PHE 154.A O no hydrogen 2.980 N/A ALA 159.A N LEU 155.A O no hydrogen 2.994 N/A LEU 160.A N VAL 156.A O no hydrogen 3.291 N/A VAL 161.A N LEU 157.A O no hydrogen 2.784 N/A LEU 162.A N ALA 158.A O no hydrogen 2.854 N/A LEU 163.A N ALA 159.A O no hydrogen 2.914 N/A ASP 164.A N LEU 160.A O no hydrogen 2.794 N/A GLY 165.A N VAL 161.A O no hydrogen 2.956 N/A ALA 166.A N LEU 162.A O no hydrogen 2.854 N/A ILE 167.A N LEU 163.A O no hydrogen 3.190 N/A GLN 168.A N ASP 164.A O no hydrogen 2.840 N/A LEU 169.A N GLY 165.A O no hydrogen 2.669 N/A PHE 170.A N ALA 166.A O no hydrogen 2.771 N/A VAL 171.A N ILE 167.A O no hydrogen 2.865 N/A GLN 173.A N GLN 168.A O no hydrogen 2.743 N/A SER 175.A N GLN 173.A O no hydrogen 2.851 N/A LEU 190.A N PRO 186.A O no hydrogen 3.282 N/A LEU 191.A N LEU 187.A O no hydrogen 2.929 N/A ASP 193.A N LEU 190.A O no hydrogen 3.279 N/A LEU 197.A N ASP 193.A O no hydrogen 3.089 N/A ILE 198.A N PRO 194.A O no hydrogen 2.859 N/A ALA 199.A N TYR 195.A O no hydrogen 2.914 N/A ALA 200.A N ILE 196.A O no hydrogen 2.921 N/A GLY 201.A N LEU 197.A O no hydrogen 2.819 N/A SER 202.A N ILE 198.A O no hydrogen 2.862 N/A SER 202.A OG ALA 199.A O no hydrogen 2.665 N/A ILE 203.A N ALA 199.A O no hydrogen 2.999 N/A CYS 204.A N ALA 200.A O no hydrogen 2.831 N/A PHE 205.A N GLY 201.A O no hydrogen 2.863 N/A ALA 206.A N SER 202.A O no hydrogen 2.939 N/A ASN 207.A N ILE 203.A O no hydrogen 2.904 N/A ASN 207.A ND2 ILE 203.A O no hydrogen 2.760 N/A ASN 207.A ND2 ASP 301.A OD2 no hydrogen 3.086 N/A MET 208.A N CYS 204.A O no hydrogen 2.830 N/A GLY 209.A N PHE 205.A O no hydrogen 2.941 N/A ALA 211.A N ASN 207.A O no hydrogen 2.868 N/A MET 212.A N MET 208.A O no hydrogen 2.901 N/A LEU 213.A N GLY 209.A O no hydrogen 2.902 N/A GLU 214.A N ILE 210.A O no hydrogen 2.907 N/A ALA 216.A N LEU 213.A O no hydrogen 3.235 N/A LEU 217.A N LEU 213.A O no hydrogen 2.881 N/A TRP 220.A N ALA 216.A O no hydrogen 3.220 N/A MET 221.A N LEU 217.A O no hydrogen 2.951 N/A MET 222.A N PRO 218.A O no hydrogen 2.919 N/A GLU 223.A N TRP 220.A O no hydrogen 3.341 N/A THR 224.A N TRP 220.A O no hydrogen 2.954 N/A THR 224.A OG1 TRP 220.A O no hydrogen 2.788 N/A MET 225.A N MET 221.A O no hydrogen 2.882 N/A CYS 226.A N MET 221.A O no hydrogen 2.961 N/A CYS 226.A SG MET 222.A O no hydrogen 3.914 N/A ARG 228.A N GLN 231.A OE1 no hydrogen 3.080 N/A GLN 231.A N ARG 228.A O no hydrogen 3.113 N/A VAL 234.A N TRP 230.A O no hydrogen 2.927 N/A ALA 235.A N GLN 231.A O no hydrogen 2.735 N/A LEU 237.A N VAL 234.A O no hydrogen 3.366 N/A SER 240.A N PHE 236.A O no hydrogen 3.298 N/A ILE 241.A N LEU 237.A O no hydrogen 2.953 N/A SER 242.A N PRO 238.A O no hydrogen 2.856 N/A SER 242.A OG PHE 291.A O no hydrogen 3.062 N/A TYR 243.A N ALA 239.A O no hydrogen 2.861 N/A LEU 244.A N SER 240.A O no hydrogen 2.972 N/A ILE 245.A N ILE 241.A O no hydrogen 2.960 N/A GLY 246.A N SER 242.A O no hydrogen 2.787 N/A THR 247.A N TYR 243.A O no hydrogen 2.878 N/A THR 247.A OG1 TYR 243.A O no hydrogen 2.629 N/A ASN 248.A N LEU 244.A O no hydrogen 3.025 N/A ILE 249.A N ILE 245.A O no hydrogen 2.893 N/A PHE 250.A N GLY 246.A O no hydrogen 2.825 N/A GLY 251.A N THR 247.A O no hydrogen 2.969 N/A ILE 252.A N ILE 249.A O no hydrogen 3.146 N/A LEU 253.A N ILE 249.A O no hydrogen 2.892 N/A ALA 254.A N PHE 250.A O no hydrogen 2.865 N/A MET 257.A N LEU 253.A O no hydrogen 3.157 N/A GLY 258.A N ALA 254.A O no hydrogen 2.812 N/A ARG 259.A NH1 ASP 116.A OD1 no hydrogen 3.191 N/A ARG 259.A NH2 ASP 116.A O no hydrogen 3.122 N/A CYS 262.A N GLY 258.A O no hydrogen 2.632 N/A CYS 262.A SG MET 299.A O no hydrogen 3.893 N/A ALA 263.A N ARG 259.A O no hydrogen 2.900 N/A LEU 264.A N TRP 260.A O no hydrogen 2.909 N/A LEU 265.A N LEU 261.A O no hydrogen 2.878 N/A GLY 266.A N CYS 262.A O no hydrogen 2.873 N/A MET 267.A N ALA 263.A O no hydrogen 2.892 N/A ILE 268.A N LEU 264.A O no hydrogen 2.953 N/A ILE 269.A N LEU 265.A O no hydrogen 2.849 N/A VAL 270.A N GLY 266.A O no hydrogen 2.895 N/A GLY 271.A N MET 267.A O no hydrogen 2.913 N/A VAL 272.A N ILE 268.A O no hydrogen 2.870 N/A SER 273.A N ILE 269.A O no hydrogen 2.863 N/A SER 273.A OG ILE 269.A O no hydrogen 2.746 N/A ILE 274.A N VAL 270.A O no hydrogen 2.910 N/A LEU 275.A N GLY 271.A O no hydrogen 2.901 N/A CYS 276.A N VAL 272.A O no hydrogen 2.873 N/A CYS 276.A SG VAL 272.A O no hydrogen 3.118 N/A ILE 277.A N SER 273.A O no hydrogen 2.927 N/A PHE 279.A N CYS 276.A O no hydrogen 3.012 N/A ALA 280.A N ILE 277.A O no hydrogen 3.190 N/A GLY 285.A N ASN 282.A O no hydrogen 2.903 N/A GLY 285.A N ASN 282.A OD1 no hydrogen 3.233 N/A LEU 286.A N ASN 282.A O no hydrogen 3.138 N/A LEU 286.A N ILE 283.A O no hydrogen 2.871 N/A ASN 290.A N LEU 286.A O no hydrogen 3.166 N/A PHE 291.A N ILE 287.A O no hydrogen 3.089 N/A GLY 292.A N ALA 288.A O no hydrogen 2.898 N/A VAL 293.A N PRO 289.A O no hydrogen 2.881 N/A GLY 294.A N ASN 290.A O no hydrogen 2.975 N/A PHE 295.A N PHE 291.A O no hydrogen 2.881 N/A ALA 296.A N GLY 292.A O no hydrogen 2.870 N/A ILE 297.A N VAL 293.A O no hydrogen 2.948 N/A GLY 298.A N GLY 294.A O no hydrogen 2.925 N/A MET 299.A N PHE 295.A O no hydrogen 2.985 N/A VAL 300.A N ALA 296.A O no hydrogen 2.909 N/A ASP 301.A N ILE 297.A O no hydrogen 2.874 N/A SER 302.A N GLY 298.A O no hydrogen 2.959 N/A SER 302.A OG GLY 298.A O no hydrogen 2.596 N/A SER 302.A OG MET 299.A O no hydrogen 3.329 N/A SER 303.A N MET 299.A O no hydrogen 2.946 N/A SER 303.A OG MET 299.A O no hydrogen 2.787 N/A SER 303.A OG VAL 300.A O no hydrogen 2.885 N/A MET 304.A N VAL 300.A O no hydrogen 2.863 N/A MET 305.A N ASP 301.A O no hydrogen 2.954 N/A MET 308.A N MET 304.A O no hydrogen 3.359 N/A MET 308.A N MET 305.A O no hydrogen 3.330 N/A TYR 310.A N PRO 306.A O no hydrogen 2.974 N/A LEU 311.A N ILE 307.A O no hydrogen 2.846 N/A VAL 312.A N MET 308.A O no hydrogen 3.401 N/A ASP 313.A N GLY 309.A O no hydrogen 2.947 N/A LEU 314.A N TYR 310.A O no hydrogen 2.926 N/A LEU 314.A N LEU 311.A O no hydrogen 3.198 N/A ARG 315.A N LEU 311.A O no hydrogen 2.880 N/A HIS 316.A N VAL 312.A O no hydrogen 2.929 N/A VAL 319.A N VAL 317.A O no hydrogen 2.804 N/A TYR 320.A OH ASP 313.A OD1 no hydrogen 2.868 N/A TYR 320.A OH ASP 313.A OD2 no hydrogen 3.301 N/A TYR 324.A N TYR 320.A O no hydrogen 2.936 N/A TYR 324.A OH MET 305.A O no hydrogen 3.369 N/A ALA 325.A N GLY 321.A O no hydrogen 2.906 N/A ILE 326.A N SER 322.A O no hydrogen 3.400 N/A ALA 327.A N VAL 323.A O no hydrogen 2.937 N/A ASP 328.A N TYR 324.A O no hydrogen 2.882 N/A VAL 329.A N ALA 325.A O no hydrogen 2.879 N/A ALA 330.A N ILE 326.A O no hydrogen 2.919 N/A PHE 331.A N ALA 327.A O no hydrogen 3.422 N/A CYS 332.A N ASP 328.A O no hydrogen 2.895 N/A CYS 332.A SG ASN 48.A OD1 no hydrogen 4.018 N/A CYS 332.A SG ASP 328.A O no hydrogen 3.013 N/A CYS 332.A SG ASP 328.A OD1 no hydrogen 3.876 N/A MET 333.A N VAL 329.A O no hydrogen 2.880 N/A TYR 335.A N PHE 331.A O no hydrogen 2.950 N/A TYR 335.A OH ASN 207.A OD1 no hydrogen 3.414 N/A ALA 341.A N ILE 337.A O no hydrogen 3.125 N/A GLY 342.A N GLY 338.A O no hydrogen 2.903 N/A GLY 343.A N PRO 339.A O no hydrogen 2.914 N/A ALA 344.A N SER 340.A O no hydrogen 2.944 N/A ILE 345.A N ALA 341.A O no hydrogen 2.927 N/A ALA 346.A N GLY 342.A O no hydrogen 2.907 N/A LYS 347.A N GLY 343.A O no hydrogen 2.934 N/A ALA 348.A N ALA 344.A O no hydrogen 2.927 N/A ILE 349.A N ILE 345.A O no hydrogen 3.057 N/A LEU 354.A N GLY 350.A O no hydrogen 2.985 N/A MET 355.A N PHE 351.A O no hydrogen 2.924 N/A THR 356.A N PRO 352.A O no hydrogen 2.881 N/A THR 356.A OG1 PRO 352.A O no hydrogen 3.081 N/A ILE 357.A N TRP 353.A O no hydrogen 2.884 N/A ILE 358.A N LEU 354.A O no hydrogen 2.935 N/A GLY 359.A N MET 355.A O no hydrogen 2.888 N/A ILE 360.A N THR 356.A O no hydrogen 2.896 N/A ILE 361.A N ILE 357.A O no hydrogen 2.928 N/A ASP 362.A N ILE 358.A O no hydrogen 2.902 N/A ILE 363.A N GLY 359.A O no hydrogen 2.887 N/A LEU 364.A N ILE 360.A O no hydrogen 2.886 N/A PHE 365.A N ILE 361.A O no hydrogen 2.899 N/A ALA 366.A N ASP 362.A O no hydrogen 2.935 N/A LEU 368.A N PHE 365.A O no hydrogen 2.922 N/A CYS 369.A N ALA 366.A O no hydrogen 3.055 N/A PHE 370.A N PRO 367.A O no hydrogen 3.018 N/A PHE 371.A N LEU 368.A O no hydrogen 3.351 N/A LEU 372.A N CYS 369.A O no hydrogen 3.143 N/A