Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8a1f_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 6.A N ILE 155.A O no hydrogen 2.754 N/A CYS 6.A SG GLY 11.A O no hydrogen 4.034 N/A THR 7.A OG1 ASP 9.A OD2 no hydrogen 2.766 N/A GLY 11.A N PHE 8.A O no hydrogen 3.227 N/A CYS 15.A N PRO 12.A O no hydrogen 2.929 N/A CYS 15.A SG GLY 5.A O no hydrogen 3.684 N/A CYS 15.A SG GLY 11.A O no hydrogen 4.003 N/A ASP 16.A N GLY 13.A O no hydrogen 3.047 N/A TYR 17.A N PRO 12.A O no hydrogen 3.147 N/A TYR 17.A OH GLY 4.A O no hydrogen 2.730 N/A HIS 18.A N GLN 64.A O no hydrogen 2.978 N/A HIS 18.A NE2 ASP 16.A OD1 no hydrogen 2.875 N/A GLN 19.A NE2 TRP 27.A O no hydrogen 2.997 N/A ASP 23.A N ASP 20.A O no hydrogen 3.135 N/A TRP 27.A N GLN 19.A OE1 no hydrogen 2.726 N/A TRP 27.A NE1 ALA 61.A O no hydrogen 3.160 N/A VAL 28.A N ILE 49.A O no hydrogen 2.855 N/A HIS 29.A NE2 PHE 8.A O no hydrogen 2.762 N/A VAL 30.A N TYR 47.A O no hydrogen 2.645 N/A SER 31.A N GLU 34.A OE1 no hydrogen 3.071 N/A SER 31.A OG ALA 32.A O no hydrogen 2.786 N/A SER 31.A OG SER 46.A OG no hydrogen 2.991 N/A ALA 32.A N SER 46.A OG no hydrogen 2.956 N/A MET 42.A N PRO 39.A O no hydrogen 3.050 N/A SER 46.A OG SER 31.A OG no hydrogen 2.991 N/A TYR 47.A N VAL 30.A O no hydrogen 2.747 N/A TYR 47.A OH PRO 43.A O no hydrogen 2.558 N/A MET 48.A N ILE 152.A O no hydrogen 3.113 N/A ILE 49.A N VAL 28.A O no hydrogen 2.843 N/A VAL 50.A N ILE 150.A O no hydrogen 2.645 N/A SER 52.A N GLY 148.A O no hydrogen 2.904 N/A SER 52.A OG PRO 90.A O no hydrogen 2.706 N/A SER 52.A OG GLY 148.A O no hydrogen 3.413 N/A SER 53.A N ASP 51.A OD1 no hydrogen 2.828 N/A SER 53.A OG ASP 51.A OD1 no hydrogen 2.736 N/A SER 53.A OG ASP 51.A OD2 no hydrogen 2.857 N/A HIS 55.A N SER 52.A O no hydrogen 3.373 N/A ASP 56.A N GLU 59.A OE1 no hydrogen 2.788 N/A GLY 58.A N VAL 142.A O no hydrogen 2.777 N/A GLU 59.A N ASP 56.A O no hydrogen 3.345 N/A LYS 60.A N ASP 24.A OD2 no hydrogen 2.914 N/A ALA 61.A N ALA 140.A O no hydrogen 2.969 N/A ARG 62.A NE ASP 23.A OD1 no hydrogen 3.441 N/A ARG 62.A NH1 GLU 139.A OE1 no hydrogen 2.753 N/A ARG 62.A NH2 ASP 23.A OD1 no hydrogen 3.236 N/A LEU 63.A N PHE 138.A O no hydrogen 2.944 N/A GLN 64.A N HIS 18.A O no hydrogen 2.816 N/A GLN 64.A NE2 ASP 20.A OD2 no hydrogen 2.973 N/A LEU 65.A N VAL 136.A O no hydrogen 2.883 N/A MET 68.A N TYR 134.A O no hydrogen 2.859 N/A LYS 69.A NZ GLU 133.A OE1 no hydrogen 2.938 N/A HIS 74.A ND1 ASP 72.A O no hydrogen 2.903 N/A HIS 74.A NE2 TYR 134.A OH no hydrogen 2.820 N/A CYS 75.A N LEU 158.A O no hydrogen 2.864 N/A CYS 75.A SG LEU 158.A O no hydrogen 3.773 N/A ILE 76.A N LEU 124.A O no hydrogen 2.787 N/A ASP 77.A N GLN 156.A O no hydrogen 2.794 N/A PHE 78.A N ALA 122.A O no hydrogen 2.977 N/A SER 79.A N ASP 153.A O no hydrogen 2.852 N/A TYR 80.A N LEU 120.A O no hydrogen 2.855 N/A LEU 81.A N ALA 151.A O no hydrogen 3.001 N/A LEU 82.A N THR 115.A OG1 no hydrogen 2.795 N/A TYR 83.A N TYR 149.A O no hydrogen 2.933 N/A TYR 83.A OH GLU 41.A OE1 no hydrogen 2.647 N/A GLN 85.A N GLN 85.A OE1 no hydrogen 2.725 N/A LYS 86.A N SER 84.A OG no hydrogen 3.362 N/A GLY 87.A N SER 84.A O no hydrogen 3.233 N/A LEU 88.A N SER 84.A OG no hydrogen 3.209 N/A GLY 91.A N ASN 89.A OD1 no hydrogen 2.865 N/A THR 92.A N GLU 141.A O no hydrogen 2.863 N/A THR 92.A OG1 THR 112.A OG1 no hydrogen 2.792 N/A LEU 93.A N VAL 111.A O no hydrogen 2.968 N/A ASN 94.A N GLU 139.A O no hydrogen 2.573 N/A ASN 94.A ND2 GLU 139.A OE2 no hydrogen 3.117 N/A ILE 95.A N TRP 109.A O no hydrogen 2.895 N/A LEU 96.A N ILE 137.A O no hydrogen 2.964 N/A ARG 98.A N GLN 135.A O no hydrogen 2.793 N/A ARG 98.A NE GLY 102.A O no hydrogen 2.866 N/A ARG 98.A NH2 LYS 101.A O no hydrogen 3.034 N/A ASN 100.A N GLU 133.A O no hydrogen 2.872 N/A ASN 100.A ND2 ASN 132.A OD1 no hydrogen 3.207 N/A LYS 101.A NZ GLN 135.A OE1 no hydrogen 3.015 N/A GLY 102.A N VAL 99.A O no hydrogen 3.002 N/A ASN 106.A ND2 ASP 202.A OD1 no hydrogen 3.485 N/A ASN 106.A ND2 ASP 202.A OD2 no hydrogen 3.322 N/A ILE 108.A N ILE 95.A O no hydrogen 2.875 N/A TRP 109.A NE1 SER 239.A O no hydrogen 3.211 N/A ASN 110.A N GLN 238.A OE1 no hydrogen 2.914 N/A ASN 110.A ND2 ASN 94.A OD1 no hydrogen 3.063 N/A VAL 111.A N LEU 93.A O no hydrogen 3.218 N/A THR 112.A OG1 THR 92.A OG1 no hydrogen 2.792 N/A GLY 113.A N GLY 91.A O no hydrogen 3.296 N/A THR 115.A N LEU 82.A O no hydrogen 2.785 N/A THR 115.A OG1 LEU 82.A O no hydrogen 3.178 N/A GLY 116.A N LEU 82.A O no hydrogen 3.326 N/A ARG 117.A NE GLU 41.A O no hydrogen 2.894 N/A ARG 117.A NH2 GLU 41.A O no hydrogen 3.482 N/A LEU 120.A N TYR 80.A O no hydrogen 2.865 N/A ARG 121.A NH1 SER 79.A OG no hydrogen 2.631 N/A ARG 121.A NH1 ASP 154.A O no hydrogen 2.715 N/A ARG 121.A NH2 ASP 154.A O no hydrogen 3.107 N/A ALA 122.A N PHE 78.A O no hydrogen 2.996 N/A GLU 123.A N ARG 241.A O no hydrogen 3.095 N/A LEU 124.A N ILE 76.A O no hydrogen 2.684 N/A ALA 125.A N SER 243.A O no hydrogen 3.067 N/A SER 127.A N VAL 245.A O no hydrogen 2.808 N/A SER 127.A OG PHE 168.A O no hydrogen 3.153 N/A SER 127.A OG VAL 245.A O no hydrogen 3.343 N/A TRP 130.A N GLU 70.A O no hydrogen 2.803 N/A ASN 132.A N PHE 129.A O no hydrogen 2.758 N/A GLU 133.A N ASN 100.A OD1 no hydrogen 3.095 N/A TYR 134.A N MET 68.A O no hydrogen 3.109 N/A TYR 134.A OH HIS 74.A NE2 no hydrogen 2.820 N/A GLN 135.A N ARG 98.A O no hydrogen 2.773 N/A GLN 135.A NE2 LEU 65.A O no hydrogen 2.851 N/A ILE 137.A N LEU 96.A O no hydrogen 2.802 N/A PHE 138.A N LEU 63.A O no hydrogen 2.884 N/A GLU 139.A N ASN 94.A O no hydrogen 2.674 N/A ALA 140.A N ALA 61.A O no hydrogen 2.847 N/A GLU 141.A N THR 92.A O no hydrogen 2.803 N/A VAL 142.A N GLU 59.A O no hydrogen 2.989 N/A SER 143.A N PRO 90.A O no hydrogen 2.935 N/A SER 143.A OG ASN 89.A O no hydrogen 2.618 N/A SER 143.A OG GLY 144.A O no hydrogen 3.433 N/A SER 147.A OG ASN 89.A O no hydrogen 3.299 N/A SER 147.A OG SER 143.A OG no hydrogen 2.475 N/A SER 147.A OG GLY 144.A O no hydrogen 2.772 N/A TYR 149.A N TYR 83.A O no hydrogen 2.750 N/A ILE 150.A N VAL 50.A O no hydrogen 2.854 N/A ALA 151.A N LEU 81.A O no hydrogen 3.000 N/A ILE 152.A N MET 48.A O no hydrogen 3.031 N/A ASP 153.A N SER 79.A O no hydrogen 2.931 N/A ILE 155.A N CYS 6.A O no hydrogen 2.732 N/A GLN 156.A N ASP 77.A O no hydrogen 2.846 N/A GLN 156.A NE2 ASP 154.A OD1 no hydrogen 2.848 N/A LEU 158.A N CYS 75.A O no hydrogen 2.761 N/A CYS 162.A SG LEU 158.A O no hydrogen 3.305 N/A LYS 164.A N GLU 123.A OE2 no hydrogen 3.176 N/A SER 165.A N GLU 123.A OE2 no hydrogen 3.106 N/A SER 165.A OG GLU 123.A OE2 no hydrogen 2.819 N/A HIS 167.A N THR 189.A O no hydrogen 3.082 N/A HIS 167.A NE2 CYS 162.A O no hydrogen 2.589 N/A LEU 169.A N ILE 187.A O no hydrogen 2.877 N/A LEU 171.A N ASN 247.A OD1 no hydrogen 2.932 N/A VAL 174.A N GLN 250.A O no hydrogen 2.863 N/A VAL 176.A N ILE 252.A O no hydrogen 3.040 N/A ASN 177.A ND2 PRO 333.A O no hydrogen 2.766 N/A ASN 177.A ND2 GLU 335.A O no hydrogen 2.922 N/A ALA 178.A N ARG 254.A O no hydrogen 2.738 N/A GLY 179.A N VAL 225.A O no hydrogen 2.781 N/A GLN 180.A N ASN 177.A O no hydrogen 3.122 N/A ALA 182.A N LEU 222.A O no hydrogen 2.758 N/A PHE 184.A N PHE 220.A O no hydrogen 2.847 N/A CYS 186.A N ALA 218.A O no hydrogen 2.880 N/A ALA 188.A N PHE 216.A O no hydrogen 2.967 N/A THR 189.A N HIS 167.A O no hydrogen 2.782 N/A GLY 190.A N ARG 214.A O no hydrogen 2.916 N/A ASN 191.A N GLN 238.A O no hydrogen 3.205 N/A LYS 192.A N GLN 238.A O no hydrogen 3.195 N/A TRP 194.A N VAL 236.A O no hydrogen 2.922 N/A LEU 195.A N ILE 203.A O no hydrogen 3.176 N/A GLN 196.A N ARG 234.A O no hydrogen 2.620 N/A GLN 196.A NE2 ASN 106.A O no hydrogen 3.025 N/A ARG 197.A NE ASP 231.A OD2 no hydrogen 2.986 N/A ARG 197.A NH2 THR 228.A O no hydrogen 2.921 N/A ARG 198.A N LEU 232.A O no hydrogen 2.905 N/A ARG 198.A NH1 ASP 231.A OD1 no hydrogen 2.729 N/A ASN 199.A N ASP 231.A OD2 no hydrogen 3.290 N/A ILE 203.A N LEU 195.A O no hydrogen 2.812 N/A ALA 206.A N SER 219.A O no hydrogen 2.926 N/A GLN 207.A N SER 219.A O no hydrogen 3.341 N/A LYS 209.A N ALA 217.A O no hydrogen 2.761 N/A ILE 211.A N ARG 215.A O no hydrogen 3.279 N/A ASN 212.A N ARG 215.A O no hydrogen 3.012 N/A HIS 213.A N ASN 212.A OD1 no hydrogen 2.441 N/A HIS 213.A ND1 ASN 212.A OD1 no hydrogen 2.793 N/A ARG 214.A NE HIS 213.A NE2 no hydrogen 3.330 N/A PHE 216.A N ALA 188.A O no hydrogen 2.932 N/A ALA 217.A N LYS 209.A O no hydrogen 2.735 N/A ALA 218.A N CYS 186.A O no hydrogen 2.950 N/A SER 219.A N GLN 207.A O no hydrogen 2.821 N/A SER 219.A OG GLN 185.A OE1 no hydrogen 2.470 N/A PHE 220.A N PHE 184.A O no hydrogen 2.830 N/A ARG 221.A NH2 GLN 207.A OE1 no hydrogen 2.929 N/A LEU 222.A N ALA 182.A O no hydrogen 2.724 N/A GLU 224.A N ASN 181.A OD1 no hydrogen 2.731 N/A VAL 225.A N GLN 180.A O no hydrogen 3.079 N/A THR 226.A N ASP 229.A OD2 no hydrogen 3.113 N/A THR 226.A OG1 GLU 224.A O no hydrogen 3.527 N/A LYS 227.A NZ GLN 230.A OE1 no hydrogen 3.279 N/A ASP 229.A N THR 226.A O no hydrogen 2.700 N/A GLN 230.A N LYS 227.A O no hydrogen 3.435 N/A LEU 232.A N ASP 231.A OD1 no hydrogen 2.561 N/A TYR 233.A N ALA 249.A O no hydrogen 2.676 N/A TYR 233.A OH ASP 229.A O no hydrogen 2.701 N/A ARG 234.A N GLN 196.A O no hydrogen 2.869 N/A ARG 234.A NE GLN 196.A OE1 no hydrogen 2.768 N/A ARG 234.A NH1 VAL 97.A O no hydrogen 3.180 N/A ARG 234.A NH2 VAL 97.A O no hydrogen 2.985 N/A ARG 234.A NH2 GLN 196.A OE1 no hydrogen 2.793 N/A CYS 235.A N SER 246.A OG no hydrogen 2.819 N/A VAL 236.A N TRP 194.A O no hydrogen 2.879 N/A THR 237.A N GLY 244.A O no hydrogen 2.979 N/A THR 237.A OG1 LYS 192.A O no hydrogen 2.969 N/A GLN 238.A N LYS 192.A O no hydrogen 2.834 N/A GLN 238.A NE2 ASN 110.A OD1 no hydrogen 3.605 N/A SER 239.A N GLY 242.A O no hydrogen 2.780 N/A SER 239.A OG GLY 242.A O no hydrogen 3.085 N/A GLY 242.A N SER 239.A O no hydrogen 3.094 N/A SER 243.A N GLU 123.A O no hydrogen 2.924 N/A SER 243.A OG ILE 108.A O no hydrogen 2.730 N/A SER 243.A OG THR 237.A O no hydrogen 3.471 N/A GLY 244.A N THR 237.A O no hydrogen 2.933 N/A VAL 245.A N ALA 125.A O no hydrogen 2.759 N/A SER 246.A N CYS 235.A O no hydrogen 2.897 N/A SER 246.A OG ASN 247.A O no hydrogen 3.103 N/A ASN 247.A ND2 LEU 171.A O no hydrogen 2.712 N/A ALA 249.A N TYR 233.A O no hydrogen 2.740 N/A GLN 250.A N ASP 173.A OD1 no hydrogen 2.852 N/A LEU 251.A N ASP 231.A O no hydrogen 2.988 N/A ILE 252.A N VAL 174.A O no hydrogen 2.808 N/A VAL 253.A N GLN 230.A OE1 no hydrogen 3.071 N/A ARG 254.A N VAL 176.A O no hydrogen 2.833 N/A ARG 254.A NE GLU 175.A OE2 no hydrogen 2.789 N/A ARG 254.A NH2 GLU 175.A OE2 no hydrogen 2.857 N/A GLU 255.A N ASP 285.A OD2 no hydrogen 2.827 N/A ARG 258.A N ILE 283.A O no hydrogen 2.997 N/A ARG 258.A NE PRO 341.A O no hydrogen 3.399 N/A ARG 258.A NH2 PRO 341.A O no hydrogen 2.783 N/A ILE 260.A N SER 281.A O no hydrogen 3.000 N/A GLN 264.A N GLN 276.A O no hydrogen 2.789 N/A LEU 266.A N LEU 274.A O no hydrogen 2.783 N/A GLY 267.A N LEU 274.A O no hydrogen 3.246 N/A GLY 269.A N TYR 272.A O no hydrogen 2.975 N/A LEU 273.A N LEU 315.A O no hydrogen 3.022 N/A LEU 274.A N GLY 267.A O no hydrogen 2.778 N/A ILE 275.A N TYR 313.A O no hydrogen 2.850 N/A GLN 276.A N GLN 264.A O no hydrogen 2.673 N/A GLN 276.A NE2 ASN 278.A OD1 no hydrogen 2.798 N/A LEU 277.A N PRO 311.A O no hydrogen 2.986 N/A ASN 278.A ND2 PRO 262.A O no hydrogen 2.741 N/A ILE 283.A N ARG 258.A O no hydrogen 2.905 N/A ASP 285.A N GLU 255.A O no hydrogen 2.884 N/A ILE 289.A N THR 331.A O no hydrogen 2.866 N/A GLU 292.A N LEU 329.A O no hydrogen 2.818 N/A VAL 293.A N HIS 306.A O no hydrogen 2.726 N/A GLU 294.A N ARG 327.A O no hydrogen 2.907 N/A TYR 295.A N GLU 304.A O no hydrogen 2.885 N/A ARG 296.A N GLU 325.A O no hydrogen 2.923 N/A ARG 296.A NH2 GLU 294.A OE2 no hydrogen 2.837 N/A THR 298.A N GLU 323.A O no hydrogen 3.019 N/A THR 298.A OG1 GLU 323.A O no hydrogen 2.977 N/A GLY 300.A N MET 297.A O no hydrogen 2.702 N/A GLU 304.A N TYR 295.A O no hydrogen 3.028 N/A HIS 306.A N VAL 293.A O no hydrogen 2.745 N/A HIS 306.A NE2 GLU 304.A OE2 no hydrogen 3.044 N/A VAL 308.A N LYS 291.A O no hydrogen 2.786 N/A THR 312.A OG1 ILE 275.A O no hydrogen 2.827 N/A TYR 313.A N ILE 275.A O no hydrogen 2.912 N/A TYR 313.A OH HIS 306.A ND1 no hydrogen 2.802 N/A LEU 315.A N LEU 273.A O no hydrogen 2.902 N/A LEU 318.A N THR 271.A O no hydrogen 2.915 N/A ASP 319.A N TYR 324.A OH no hydrogen 3.196 N/A ASP 321.A N LYS 350.A O no hydrogen 2.717 N/A THR 322.A N THR 349.A OG1 no hydrogen 3.015 N/A THR 322.A OG1 ASP 319.A O no hydrogen 3.191 N/A THR 322.A OG1 PRO 320.A O no hydrogen 3.089 N/A TYR 324.A N THR 347.A O no hydrogen 2.591 N/A GLU 325.A N ARG 296.A O no hydrogen 2.865 N/A ILE 326.A N LEU 345.A O no hydrogen 2.834 N/A ARG 327.A N GLU 294.A O no hydrogen 2.871 N/A ARG 327.A NE GLU 325.A OE2 no hydrogen 2.671 N/A ARG 327.A NH1 GLY 342.A O no hydrogen 2.862 N/A ARG 327.A NH2 GLU 325.A OE2 no hydrogen 2.923 N/A LEU 329.A N GLU 292.A O no hydrogen 2.710 N/A THR 331.A N LEU 290.A O no hydrogen 2.983 N/A ARG 332.A N GLY 337.A O no hydrogen 2.756 N/A ARG 332.A NE ASP 285.A O no hydrogen 3.107 N/A ARG 332.A NE GLY 286.A O no hydrogen 3.183 N/A ARG 332.A NH1 ASN 177.A OD1 no hydrogen 2.754 N/A ARG 332.A NH2 GLY 286.A O no hydrogen 2.690 N/A GLY 337.A N GLY 334.A O no hydrogen 2.940 N/A GLY 339.A N LEU 330.A O no hydrogen 2.925 N/A GLY 342.A N VAL 328.A O no hydrogen 2.945 N/A LEU 345.A N ILE 326.A O no hydrogen 2.994 N/A THR 347.A N TYR 324.A O no hydrogen 2.998 N/A ARG 348.A NH1 ASP 321.A OD1 no hydrogen 2.786 N/A ARG 348.A NH2 GLU 323.A OE1 no hydrogen 2.971 N/A THR 349.A N THR 322.A O no hydrogen 2.973 N/A THR 349.A OG1 ASP 319.A O no hydrogen 2.634 N/A THR 349.A OG1 THR 322.A O no hydrogen 3.297 N/A LYS 350.A N GLY 269.A O no hydrogen 3.067 N/A