Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3psh_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 1.A N ASP 16.A OD1 no hydrogen 2.972 N/A ARG 2.A N ILE 14.A O no hydrogen 2.855 N/A ARG 2.A NE PRO 15.A O no hydrogen 2.940 N/A ARG 2.A NH1 GLU 149.A O no hydrogen 2.819 N/A ARG 2.A NH2 PRO 15.A O no hydrogen 3.167 N/A ARG 2.A NH2 VAL 150.A O no hydrogen 2.921 N/A ILE 4.A N VAL 12.A O no hydrogen 2.810 N/A ASP 6.A N ARG 10.A O no hydrogen 2.902 N/A GLN 7.A N ALA 111.A O no hydrogen 3.011 N/A GLN 7.A NE2 GLY 139.A O no hydrogen 3.134 N/A GLN 7.A NE2 GLN 142.A OE1 no hydrogen 2.915 N/A LEU 8.A N ASP 6.A OD1 no hydrogen 2.766 N/A ASP 9.A N ASP 6.A O no hydrogen 2.763 N/A ARG 10.A N ASP 6.A OD1 no hydrogen 2.954 N/A ARG 10.A NH1 ASP 6.A OD2 no hydrogen 2.868 N/A ARG 10.A NH1 VAL 109.A O no hydrogen 2.818 N/A LYS 11.A NZ THR 5.A OG1 no hydrogen 2.696 N/A VAL 12.A N ILE 4.A O no hydrogen 2.869 N/A ILE 14.A N ARG 2.A O no hydrogen 2.755 N/A HIS 17.A ND1 GLU 152.A OE1 no hydrogen 2.719 N/A ASN 19.A N ASP 86.A OD2 no hydrogen 2.782 N/A ARG 20.A N ASP 86.A OD1 no hydrogen 2.972 N/A ARG 20.A N ASP 86.A OD2 no hydrogen 3.181 N/A ARG 20.A NE LEU 83.A O no hydrogen 2.827 N/A ARG 20.A NE LYS 84.A O no hydrogen 3.261 N/A ARG 20.A NH2 LEU 83.A O no hydrogen 2.683 N/A ALA 21.A N GLN 40.A O no hydrogen 2.976 N/A VAL 22.A N VAL 87.A O no hydrogen 2.850 N/A VAL 23.A N GLY 43.A O no hydrogen 2.824 N/A LEU 24.A N PHE 89.A O no hydrogen 2.883 N/A GLN 27.A N GLN 27.A OE1 no hydrogen 2.902 N/A LEU 29.A N GLN 25.A O no hydrogen 3.097 N/A ASN 30.A N HIS 26.A O no hydrogen 2.905 N/A ASN 30.A ND2 GLU 284.A OE1 no hydrogen 3.487 N/A ASN 30.A ND2 GLU 284.A OE2 no hydrogen 2.695 N/A ILE 31.A N GLN 27.A O no hydrogen 3.049 N/A ALA 32.A N THR 28.A O no hydrogen 2.827 N/A VAL 33.A N LEU 29.A O no hydrogen 2.920 N/A GLN 34.A N ASN 30.A O no hydrogen 3.087 N/A GLN 34.A NE2 ASN 30.A O no hydrogen 3.478 N/A GLN 34.A NE2 ASN 30.A OD1 no hydrogen 3.162 N/A GLN 34.A NE2 GLU 284.A OE1 no hydrogen 2.904 N/A LEU 35.A N ILE 31.A O no hydrogen 2.837 N/A LEU 35.A N ALA 32.A O no hydrogen 3.175 N/A ASP 36.A N VAL 33.A O no hydrogen 3.017 N/A ALA 37.A N ALA 32.A O no hydrogen 2.907 N/A THR 38.A OG1 GLU 62.A OE2 no hydrogen 2.746 N/A GLN 40.A N ALA 37.A O no hydrogen 2.919 N/A ILE 41.A N THR 38.A O no hydrogen 3.134 N/A VAL 42.A N ALA 21.A O no hydrogen 2.833 N/A GLY 43.A N ALA 21.A O no hydrogen 3.471 N/A VAL 44.A N ALA 67.A O no hydrogen 2.903 N/A LEU 45.A N VAL 23.A O no hydrogen 2.987 N/A SER 46.A N GLY 70.A O no hydrogen 2.815 N/A SER 46.A OG GLY 70.A O no hydrogen 3.506 N/A ASN 47.A N ASN 47.A OD1 no hydrogen 2.622 N/A TRP 48.A N LEU 45.A O no hydrogen 3.174 N/A LYS 49.A NZ GLU 64.A OE2 no hydrogen 2.995 N/A GLN 51.A N ASN 47.A O no hydrogen 2.974 N/A LEU 52.A N TRP 48.A O no hydrogen 2.825 N/A LYS 54.A NZ ASN 55.A OD1 no hydrogen 3.004 N/A TYR 56.A N GLY 53.A O no hydrogen 3.035 N/A TYR 56.A OH ASN 30.A OD1 no hydrogen 2.701 N/A ARG 58.A N ASN 55.A O no hydrogen 2.873 N/A ARG 58.A NH1 SER 322.A O no hydrogen 3.533 N/A ARG 58.A NH2 SER 322.A O no hydrogen 2.837 N/A LEU 59.A N TYR 56.A O no hydrogen 2.837 N/A ALA 60.A N TYR 56.A O no hydrogen 3.235 N/A GLU 62.A N GLU 62.A OE1 no hydrogen 2.632 N/A LEU 63.A N ALA 60.A O no hydrogen 2.941 N/A GLU 64.A N PRO 61.A O no hydrogen 3.112 N/A MET 66.A N LEU 63.A O no hydrogen 3.171 N/A ASP 71.A N SER 74.A O no hydrogen 2.923 N/A ASN 73.A N ASP 71.A OD1 no hydrogen 3.358 N/A SER 74.A OG ASP 71.A OD1 no hydrogen 2.597 N/A ASN 76.A N PRO 69.A O no hydrogen 2.881 N/A SER 79.A N ASN 76.A OD1 no hydrogen 3.134 N/A LEU 80.A N ASN 76.A O no hydrogen 2.816 N/A LEU 81.A N ILE 77.A O no hydrogen 2.799 N/A LEU 83.A N LEU 80.A O no hydrogen 2.982 N/A LYS 84.A N LEU 81.A O no hydrogen 3.044 N/A ASP 86.A N ARG 20.A O no hydrogen 3.025 N/A VAL 88.A N PRO 108.A O no hydrogen 3.010 N/A PHE 89.A N VAL 22.A O no hydrogen 2.923 N/A VAL 90.A N VAL 110.A O no hydrogen 2.889 N/A THR 91.A OG1 GLN 25.A OE1 no hydrogen 3.047 N/A THR 91.A OG1 ASN 92.A OD1 no hydrogen 3.475 N/A ASN 92.A N ILE 112.A O no hydrogen 3.060 N/A ASN 92.A ND2 LYS 122.A O no hydrogen 2.954 N/A ASN 92.A ND2 LYS 124.A O no hydrogen 3.679 N/A ALA 94.A N THR 91.A O no hydrogen 2.855 N/A MET 98.A N PRO 95.A O no hydrogen 2.964 N/A ILE 99.A N PRO 95.A O no hydrogen 3.087 N/A LYS 100.A N SER 96.A O no hydrogen 2.878 N/A LYS 100.A NZ ASP 104.A OD2 no hydrogen 3.033 N/A GLN 101.A N GLU 97.A O no hydrogen 2.928 N/A ILE 102.A N MET 98.A O no hydrogen 3.265 N/A SER 103.A N ILE 99.A O no hydrogen 2.851 N/A SER 103.A OG ILE 99.A O no hydrogen 3.047 N/A ASP 104.A N LYS 100.A O no hydrogen 2.836 N/A VAL 105.A N ILE 102.A O no hydrogen 3.100 N/A ASN 106.A N SER 103.A O no hydrogen 3.013 N/A ILE 107.A N ILE 102.A O no hydrogen 3.381 N/A VAL 110.A N VAL 88.A O no hydrogen 2.845 N/A ALA 111.A N ASP 6.A OD2 no hydrogen 2.925 N/A ILE 112.A N VAL 90.A O no hydrogen 2.878 N/A SER 113.A N GLN 7.A OE1 no hydrogen 2.904 N/A SER 113.A OG ARG 115.A O no hydrogen 2.880 N/A LEU 114.A N GLN 7.A OE1 no hydrogen 2.748 N/A ARG 115.A N SER 113.A OG no hydrogen 2.994 N/A ARG 115.A NH2 GLU 121.A O no hydrogen 2.734 N/A ARG 115.A NH2 LYS 124.A O no hydrogen 2.960 N/A THR 116.A N ALA 135.A O no hydrogen 2.922 N/A THR 116.A OG1 ALA 135.A O no hydrogen 3.395 N/A GLU 118.A N GLU 118.A OE1 no hydrogen 3.006 N/A GLU 121.A N GLU 118.A O no hydrogen 3.125 N/A LYS 122.A N VAL 119.A O no hydrogen 3.325 N/A LYS 122.A NZ ASP 9.A OD1 no hydrogen 2.999 N/A LYS 124.A N GLU 121.A O no hydrogen 3.039 N/A LYS 124.A NZ GLU 121.A OE2 no hydrogen 2.586 N/A THR 128.A N GLU 121.A OE1 no hydrogen 2.821 N/A THR 130.A N GLU 118.A OE1 no hydrogen 3.240 N/A THR 130.A OG1 GLU 118.A OE2 no hydrogen 2.595 N/A LYS 134.A N ASP 131.A OD1 no hydrogen 3.134 N/A LYS 134.A NZ ASP 138.A OD2 no hydrogen 2.992 N/A ALA 135.A N ASP 131.A O no hydrogen 2.937 N/A TYR 136.A N GLU 132.A O no hydrogen 2.819 N/A TYR 136.A OH GLY 199.A O no hydrogen 2.572 N/A ASN 137.A N ASP 133.A O no hydrogen 2.859 N/A ASN 137.A ND2 ASP 133.A OD1 no hydrogen 3.434 N/A ASP 138.A N LYS 134.A O no hydrogen 2.801 N/A LEU 140.A N TYR 136.A O no hydrogen 2.940 N/A LYS 141.A N ASN 137.A O no hydrogen 3.223 N/A LYS 141.A NZ GLU 145.A OE2 no hydrogen 2.399 N/A GLN 142.A N ASP 138.A O no hydrogen 2.853 N/A GLY 143.A N GLY 139.A O no hydrogen 2.710 N/A ILE 144.A N LEU 140.A O no hydrogen 2.876 N/A GLU 145.A N LYS 141.A O no hydrogen 2.914 N/A LEU 146.A N GLN 142.A O no hydrogen 2.842 N/A ILE 147.A N GLY 143.A O no hydrogen 2.945 N/A ALA 148.A N ILE 144.A O no hydrogen 2.858 N/A GLU 149.A N GLU 145.A O no hydrogen 2.896 N/A VAL 150.A N LEU 146.A O no hydrogen 2.934 N/A PHE 151.A N ILE 147.A O no hydrogen 3.062 N/A GLU 152.A N GLU 149.A O no hydrogen 3.106 N/A LYS 153.A N ALA 148.A O no hydrogen 2.730 N/A LYS 154.A NZ ASP 158.A OD2 no hydrogen 2.878 N/A GLN 155.A NE2 GLU 159.A OE2 no hydrogen 3.457 N/A GLY 157.A N LYS 153.A O no hydrogen 2.868 N/A ASP 158.A N LYS 154.A O no hydrogen 2.903 N/A GLU 159.A N GLN 155.A O no hydrogen 3.009 N/A LEU 160.A N GLN 156.A O no hydrogen 2.799 N/A VAL 161.A N GLY 157.A O no hydrogen 2.928 N/A LYS 162.A N ASP 158.A O no hydrogen 3.089 N/A ALA 163.A N GLU 159.A O no hydrogen 2.821 N/A ALA 164.A N LEU 160.A O no hydrogen 2.797 N/A PHE 165.A N VAL 161.A O no hydrogen 3.387 N/A ALA 166.A N ALA 163.A O no hydrogen 3.276 N/A ASN 167.A ND2 ALA 287.A O no hydrogen 2.733 N/A ARG 168.A N PHE 165.A O no hydrogen 3.266 N/A ARG 168.A NE GLU 290.A OE1 no hydrogen 2.712 N/A ARG 168.A NH1 ASN 137.A OD1 no hydrogen 2.917 N/A ARG 168.A NH2 GLU 290.A OE2 no hydrogen 2.885 N/A LYS 169.A NZ ASP 173.A OD1 no hydrogen 3.555 N/A LYS 169.A NZ ASP 173.A OD2 no hydrogen 2.632 N/A LEU 171.A N ASN 167.A O no hydrogen 3.256 N/A ALA 172.A N ARG 168.A O no hydrogen 2.882 N/A ASP 173.A N LYS 169.A O no hydrogen 2.882 N/A ARG 174.A N LEU 170.A O no hydrogen 2.845 N/A ARG 174.A NH1 ARG 301.A O no hydrogen 2.907 N/A ARG 174.A NH1 ASP 304.A OD1 no hydrogen 3.008 N/A ARG 174.A NH1 ASP 304.A OD2 no hydrogen 3.482 N/A ARG 174.A NH2 ASP 304.A OD2 no hydrogen 2.762 N/A LEU 175.A N LEU 171.A O no hydrogen 3.094 N/A VAL 178.A N LEU 175.A O no hydrogen 3.055 N/A SER 179.A OG ASP 181.A OD1.B no hydrogen 1.965 N/A LYS 182.A N SER 179.A O no hydrogen 2.956 N/A ARG 183.A N SER 179.A O no hydrogen 2.918 N/A ARG 183.A NH1 GLU 207.A O no hydrogen 2.900 N/A ARG 183.A NH1 ALA 211.A O no hydrogen 2.929 N/A VAL 184.A N GLY 210.A O no hydrogen 3.125 N/A ARG 185.A NH2 TRP 233.A O no hydrogen 2.985 N/A THR 186.A N TYR 212.A O no hydrogen 2.935 N/A THR 186.A OG1 VAL 184.A O no hydrogen 3.111 N/A TYR 187.A N VAL 237.A O no hydrogen 2.927 N/A ALA 189.A N LEU 239.A O no hydrogen 2.878 N/A ASN 190.A N GLY 194.A O no hydrogen 2.963 N/A ASN 190.A ND2 GLN 241.A OE1 no hydrogen 3.095 N/A GLY 194.A N PRO 191.A O no hydrogen 3.068 N/A THR 195.A N LYS 223.A O no hydrogen 2.818 N/A THR 195.A OG1 MET 188.A O no hydrogen 2.701 N/A GLY 197.A N GLY 221.A O no hydrogen 2.665 N/A SER 198.A N ILE 219.A O no hydrogen 2.761 N/A SER 198.A OG ILE 219.A O no hydrogen 3.321 N/A LYS 200.A NZ LEU 125.A O no hydrogen 2.761 N/A TYR 201.A N GLY 279.A O no hydrogen 2.977 N/A TYR 201.A OH GLU 290.A OE2 no hydrogen 2.545 N/A THR 202.A OG1 ALA 277.A O no hydrogen 2.882 N/A THR 202.A OG1 TRP 278.A O no hydrogen 3.140 N/A GLY 203.A N LYS 200.A O no hydrogen 3.364 N/A MET 205.A N TYR 201.A O no hydrogen 2.784 N/A MET 206.A N THR 202.A O no hydrogen 3.154 N/A GLU 207.A N GLY 203.A O no hydrogen 2.877 N/A HIS 208.A N LEU 204.A O no hydrogen 2.985 N/A HIS 208.A NE2 ASP 133.A OD1 no hydrogen 2.821 N/A ALA 209.A N MET 205.A O no hydrogen 3.303 N/A ALA 209.A N MET 206.A O no hydrogen 3.050 N/A GLY 210.A N GLU 207.A O no hydrogen 3.095 N/A ALA 211.A N MET 206.A O no hydrogen 2.907 N/A TYR 212.A N VAL 184.A O no hydrogen 2.818 N/A ASN 213.A ND2 TYR 196.A O no hydrogen 2.780 N/A VAL 214.A N THR 186.A O no hydrogen 2.935 N/A ALA 215.A N ASN 213.A OD1 no hydrogen 3.128 N/A ALA 216.A N ASN 213.A O no hydrogen 3.047 N/A THR 218.A N ALA 215.A O no hydrogen 3.278 N/A ILE 219.A N ALA 215.A O no hydrogen 2.946 N/A GLY 221.A N SER 198.A O no hydrogen 2.756 N/A LYS 223.A N THR 195.A O no hydrogen 2.942 N/A LYS 223.A NZ LYS 220.A O no hydrogen 2.857 N/A GLN 224.A NE2 ASP 192.A O no hydrogen 2.871 N/A VAL 225.A N LEU 193.A O no hydrogen 2.847 N/A ASN 229.A N SER 226.A OG no hydrogen 3.222 N/A ASN 229.A ND2 SER 226.A O no hydrogen 3.646 N/A VAL 230.A N SER 226.A O no hydrogen 3.390 N/A LEU 231.A N LEU 227.A O no hydrogen 2.968 N/A GLU 232.A N GLU 228.A O no hydrogen 2.903 N/A TRP 233.A N ASN 229.A O no hydrogen 2.954 N/A ASN 234.A N VAL 230.A O no hydrogen 2.756 N/A ALA 236.A N ARG 185.A O no hydrogen 2.775 N/A VAL 237.A N ARG 185.A O no hydrogen 3.259 N/A ILE 238.A N LYS 267.A O no hydrogen 2.945 N/A LEU 239.A N TYR 187.A O no hydrogen 2.783 N/A VAL 240.A N PHE 269.A O no hydrogen 2.964 N/A GLN 241.A NE2 TYR 196.A OH no hydrogen 3.140 N/A GLN 241.A NE2 ALA 277.A O no hydrogen 3.102 N/A ARG 243.A NE GLN 241.A OE1 no hydrogen 2.931 N/A ARG 243.A NH1 GLN 51.A O no hydrogen 2.837 N/A ARG 243.A NH2 GLN 241.A OE1 no hydrogen 2.905 N/A TYR 244.A N GLN 241.A O no hydrogen 2.909 N/A VAL 247.A N TYR 244.A O no hydrogen 3.034 N/A VAL 248.A N PRO 245.A O no hydrogen 3.172 N/A GLN 250.A N ASP 246.A O no hydrogen 3.256 N/A ILE 251.A N VAL 247.A O no hydrogen 3.008 N/A LEU 252.A N VAL 248.A O no hydrogen 2.903 N/A ASN 253.A N PRO 249.A O no hydrogen 2.884 N/A ASP 254.A N ILE 251.A O no hydrogen 3.187 N/A GLY 256.A N ASP 254.A OD1 no hydrogen 2.845 N/A TRP 257.A N ASP 254.A O no hydrogen 3.073 N/A ALA 258.A N GLN 255.A O no hydrogen 3.084 N/A ILE 260.A N TRP 257.A O no hydrogen 3.125 N/A GLN 261.A N ASN 234.A OD1 no hydrogen 2.771 N/A ALA 262.A N PRO 235.A O no hydrogen 2.926 N/A LYS 264.A N ILE 260.A O no hydrogen 3.029 N/A LYS 264.A NZ ASN 259.A O no hydrogen 3.319 N/A ASP 265.A N GLN 261.A O no hydrogen 3.037 N/A LYS 266.A N LEU 263.A O no hydrogen 3.011 N/A LYS 267.A N ALA 262.A O no hydrogen 2.782 N/A PHE 269.A N ILE 238.A O no hydrogen 2.972 N/A MET 271.A N VAL 240.A O no hydrogen 2.797 N/A ALA 275.A N PRO 272.A O no hydrogen 2.806 N/A LYS 276.A NZ GLU 273.A O no hydrogen 3.046 N/A LYS 276.A NZ GLU 284.A OE2 no hydrogen 2.642 N/A TYR 280.A OH ASN 92.A OD1 no hydrogen 2.672 N/A GLU 284.A N GLU 284.A OE1 no hydrogen 2.699 N/A ALA 285.A N MET 282.A O no hydrogen 2.906 N/A LEU 286.A N MET 282.A O no hydrogen 3.215 N/A ALA 287.A N PRO 283.A O no hydrogen 3.077 N/A LEU 288.A N GLU 284.A O no hydrogen 2.911 N/A GLY 289.A N GLU 284.A O no hydrogen 3.093 N/A GLU 290.A N ALA 285.A O no hydrogen 2.910 N/A TRP 292.A N LEU 288.A O no hydrogen 2.805 N/A LEU 293.A N GLY 289.A O no hydrogen 3.002 N/A ALA 294.A N GLU 290.A O no hydrogen 2.863 N/A LYS 295.A N VAL 291.A O no hydrogen 2.840 N/A LYS 295.A NZ PHE 302.A O no hydrogen 2.834 N/A LYS 295.A NZ VAL 305.A O no hydrogen 2.948 N/A ALA 296.A N TRP 292.A O no hydrogen 2.849 N/A LEU 297.A N LEU 293.A O no hydrogen 3.001 N/A LEU 297.A N ALA 294.A O no hydrogen 3.273 N/A TYR 298.A N ALA 294.A O no hydrogen 2.692 N/A TYR 298.A OH GLY 210.A O no hydrogen 2.631 N/A ARG 301.A N TYR 298.A O no hydrogen 2.918 N/A ARG 301.A NH1 ARG 174.A O no hydrogen 2.803 N/A ARG 301.A NH1 ASP 177.A OD1 no hydrogen 2.581 N/A ARG 301.A NH1 ASP 177.A OD2 no hydrogen 3.497 N/A ARG 301.A NH2 ASP 177.A OD2 no hydrogen 3.021 N/A PHE 302.A N PRO 299.A O no hydrogen 3.151 N/A GLN 303.A NE2 PRO 299.A O no hydrogen 3.149 N/A GLN 303.A NE2 GLN 300.A OE1 no hydrogen 3.605 N/A ASP 304.A N ASP 304.A OD1 no hydrogen 2.674 N/A VAL 305.A N PHE 302.A O no hydrogen 2.925 N/A LYS 309.A N ASP 306.A OD1 no hydrogen 3.073 N/A LYS 309.A NZ ASP 313.A OD2 no hydrogen 3.282 N/A MET 310.A N ASP 306.A O no hydrogen 3.154 N/A VAL 311.A N LEU 307.A O no hydrogen 2.784 N/A ASN 312.A N ASP 308.A O no hydrogen 2.905 N/A ASP 313.A N LYS 309.A O no hydrogen 2.896 N/A TYR 314.A N MET 310.A O no hydrogen 3.145 N/A TYR 314.A OH GLN 34.A OE1 no hydrogen 2.682 N/A TYR 315.A N VAL 311.A O no hydrogen 2.802 N/A TYR 315.A OH GLU 273.A OE1 no hydrogen 2.482 N/A GLN 316.A N ASN 312.A O no hydrogen 2.803 N/A GLN 316.A NE2 ASN 312.A OD1 no hydrogen 3.363 N/A LYS 317.A N ASP 313.A O no hydrogen 3.075 N/A LYS 317.A NZ GLU 159.A OE1 no hydrogen 3.176 N/A PHE 318.A N TYR 314.A O no hydrogen 2.861 N/A TYR 319.A N TYR 315.A O no hydrogen 2.852 N/A TYR 319.A OH ASN 30.A OD1 no hydrogen 2.826 N/A ARG 320.A NH1 VAL 33.A O no hydrogen 2.961 N/A ARG 320.A NH2 VAL 33.A O no hydrogen 2.881 N/A THR 321.A N TYR 315.A O no hydrogen 3.503 N/A