Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1q0r_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N ASP 16.A OD1 no hydrogen 2.767 N/A SER 1.A OG ASP 16.A OD1 no hydrogen 3.408 N/A ARG 3.A N SER 14.A O no hydrogen 2.920 N/A ARG 3.A NH1 GLY 89.A O no hydrogen 2.856 N/A VAL 5.A N LEU 12.A O no hydrogen 2.861 N/A SER 7.A N VAL 10.A O no hydrogen 2.920 N/A SER 7.A OG ASP 82.A OD1 no hydrogen 2.675 N/A VAL 10.A N SER 7.A O no hydrogen 3.141 N/A GLU 11.A N THR 65.A OG1 no hydrogen 2.862 N/A LEU 12.A N VAL 5.A O no hydrogen 2.869 N/A TRP 13.A N SER 64.A OG no hydrogen 3.044 N/A TRP 13.A NE1 GLU 2.A OE2 no hydrogen 3.024 N/A SER 14.A N ARG 3.A O no hydrogen 2.966 N/A SER 14.A OG.A ARG 55.A O no hydrogen 2.720 N/A SER 14.A OG.B ARG 3.A O no hydrogen 2.824 N/A ASP 15.A N ARG 55.A O no hydrogen 3.104 N/A ASP 16.A N SER 1.A O no hydrogen 3.119 N/A PHE 17.A N VAL 53.A O no hydrogen 2.866 N/A ALA 21.A N ASP 19.A OD1 no hydrogen 2.958 N/A ASP 22.A N ASP 19.A O no hydrogen 3.005 N/A LEU 25.A N HIS 52.A O no hydrogen 2.875 N/A LEU 26.A N HIS 96.A O no hydrogen 2.762 N/A LEU 27.A N ILE 54.A O no hydrogen 2.890 N/A VAL 28.A N VAL 98.A O no hydrogen 2.808 N/A ALA 35.A N ASP 57.A OD1 no hydrogen 2.795 N/A LEU 36.A N SER 34.A OG no hydrogen 3.216 N/A GLY 37.A N SER 34.A O no hydrogen 2.957 N/A TRP 38.A N ALA 35.A O no hydrogen 2.981 N/A GLU 41.A N GLU 41.A OE1 no hydrogen 2.846 N/A PHE 42.A N PRO 39.A O no hydrogen 2.962 N/A ALA 43.A N PRO 39.A O no hydrogen 3.133 N/A ARG 44.A N ASP 40.A O no hydrogen 2.910 N/A ARG 45.A N GLU 41.A O no hydrogen 3.135 N/A LEU 46.A N PHE 42.A O no hydrogen 3.059 N/A ALA 47.A N ALA 43.A O no hydrogen 2.905 N/A ASP 48.A N ARG 44.A O no hydrogen 2.862 N/A GLY 49.A N LEU 46.A O no hydrogen 3.040 N/A GLY 50.A N ALA 47.A O no hydrogen 2.933 N/A LEU 51.A N ALA 47.A O no hydrogen 3.085 N/A HIS 52.A N PRO 23.A O no hydrogen 2.858 N/A HIS 52.A NE2 ASP 16.A OD2 no hydrogen 2.672 N/A VAL 53.A N PHE 17.A O no hydrogen 3.012 N/A ILE 54.A N LEU 25.A O no hydrogen 2.796 N/A ARG 55.A N ASP 15.A O no hydrogen 3.035 N/A ARG 55.A NE ASP 15.A OD1 no hydrogen 2.747 N/A ARG 55.A NE ASP 15.A OD2 no hydrogen 3.459 N/A ARG 55.A NH1 ASP 40.A OD1 no hydrogen 2.920 N/A ARG 55.A NH2 ASP 15.A OD2 no hydrogen 2.986 N/A ARG 55.A NH2 ASP 40.A OD1 no hydrogen 2.961 N/A ASP 57.A N TRP 13.A O no hydrogen 2.921 N/A ARG 59.A NE ASP 82.A OD2 no hydrogen 2.743 N/A ARG 59.A NH2 ASP 82.A OD1 no hydrogen 3.047 N/A ARG 59.A NH2 ASP 82.A OD2 no hydrogen 3.303 N/A ASP 60.A N THR 65.A O no hydrogen 2.863 N/A THR 61.A N HIS 58.A O no hydrogen 3.039 N/A THR 61.A OG1 HIS 58.A O no hydrogen 2.808 N/A ARG 63.A N ASP 57.A OD2 no hydrogen 2.830 N/A ARG 63.A NH1 HIS 207.A O no hydrogen 2.759 N/A SER 64.A N THR 61.A O no hydrogen 3.123 N/A SER 64.A OG ASP 57.A O no hydrogen 2.637 N/A THR 65.A N GLU 11.A O no hydrogen 3.036 N/A THR 65.A OG1 GLU 11.A O no hydrogen 3.463 N/A THR 66.A OG1 SER 64.A O no hydrogen 2.964 N/A ARG 67.A N ASP 60.A OD1 no hydrogen 2.941 N/A ALA 71.A N ASP 68.A O no hydrogen 3.287 N/A HIS 72.A N PHE 69.A O no hydrogen 2.971 N/A TYR 74.A OH ASP 60.A OD2 no hydrogen 2.659 N/A GLY 75.A N GLU 78.A OE1 no hydrogen 2.883 N/A GLU 78.A N GLU 78.A OE1 no hydrogen 2.913 N/A LEU 79.A N GLY 75.A O no hydrogen 3.158 N/A ALA 80.A N PHE 76.A O no hydrogen 2.887 N/A ALA 81.A N GLY 77.A O no hydrogen 3.000 N/A ASP 82.A N GLU 78.A O no hydrogen 2.865 N/A ALA 83.A N LEU 79.A O no hydrogen 3.264 N/A VAL 84.A N ALA 80.A O no hydrogen 3.181 N/A ALA 85.A N ALA 81.A O no hydrogen 2.822 N/A VAL 86.A N ASP 82.A O no hydrogen 3.012 N/A LEU 87.A N ALA 83.A O no hydrogen 3.276 N/A ASP 88.A N VAL 84.A O no hydrogen 2.918 N/A GLY 89.A N ALA 85.A O no hydrogen 2.872 N/A TRP 90.A N VAL 86.A O no hydrogen 3.133 N/A TRP 90.A N LEU 87.A O no hydrogen 3.153 N/A TRP 90.A NE1 SER 14.A OG.A no hydrogen 3.003 N/A TRP 90.A NE1 SER 14.A OG.B no hydrogen 3.051 N/A GLY 91.A N ASP 88.A O no hydrogen 3.023 N/A VAL 92.A N LEU 87.A O no hydrogen 2.927 N/A ARG 94.A NE ASP 116.A O no hydrogen 2.963 N/A ALA 95.A N ARG 117.A O no hydrogen 3.018 N/A HIS 96.A N ALA 24.A O no hydrogen 2.903 N/A HIS 96.A ND1 ALA 24.A O no hydrogen 3.243 N/A VAL 97.A N SER 120.A O no hydrogen 3.020 N/A VAL 98.A N LEU 26.A O no hydrogen 2.895 N/A GLY 99.A N THR 122.A O no hydrogen 2.805 N/A LEU 100.A N VAL 28.A O no hydrogen 3.084 N/A SER 101.A N LEU 124.A O no hydrogen 2.878 N/A SER 101.A OG HIS 275.A NE2 no hydrogen 2.800 N/A GLY 103.A N LEU 100.A O no hydrogen 2.750 N/A ALA 104.A N SER 101.A O no hydrogen 2.916 N/A ILE 106.A N MET 102.A O no hydrogen 3.161 N/A THR 107.A N GLY 103.A O no hydrogen 2.888 N/A THR 107.A OG1 GLY 103.A O no hydrogen 3.271 N/A THR 107.A OG1 ALA 104.A O no hydrogen 2.917 N/A GLN 108.A N ALA 104.A O no hydrogen 2.994 N/A GLN 108.A NE2 ALA 104.A O no hydrogen 3.119 N/A GLN 108.A NE2 GLY 127.A O no hydrogen 2.921 N/A VAL 109.A N THR 105.A O no hydrogen 3.206 N/A ILE 110.A N ILE 106.A O no hydrogen 2.969 N/A ALA 111.A N THR 107.A O no hydrogen 2.901 N/A LEU 112.A N GLN 108.A O no hydrogen 3.078 N/A LEU 112.A N VAL 109.A O no hydrogen 3.206 N/A ASP 113.A N VAL 109.A O no hydrogen 2.931 N/A HIS 114.A N ILE 110.A O no hydrogen 2.753 N/A ARG 117.A N HIS 114.A O no hydrogen 2.998 N/A ARG 117.A NE ASP 93.A O no hydrogen 2.853 N/A ARG 117.A NH1 ASP 88.A OD1 no hydrogen 2.941 N/A ARG 117.A NH2 ASP 88.A OD1 no hydrogen 2.914 N/A ARG 117.A NH2 VAL 92.A O no hydrogen 2.868 N/A LEU 118.A N HIS 115.A O no hydrogen 3.165 N/A SER 119.A N ALA 95.A O no hydrogen 2.835 N/A LEU 121.A N PRO 238.A O no hydrogen 2.894 N/A THR 122.A N VAL 97.A O no hydrogen 2.813 N/A THR 122.A OG1 HIS 292.A ND1 no hydrogen 3.401 N/A MET 123.A N LEU 240.A O no hydrogen 2.868 N/A LEU 124.A N GLY 99.A O no hydrogen 3.019 N/A LEU 129.A N GLN 108.A OE1 no hydrogen 3.079 N/A ILE 131.A N GLY 128.A O no hydrogen 2.976 N/A ASN 136.A N ASP 132.A O no hydrogen 2.877 N/A ASN 136.A ND2 ASP 148.A OD2 no hydrogen 2.960 N/A ILE 137.A N PHE 133.A O no hydrogen 3.052 N/A GLU 138.A N ASP 134.A O no hydrogen 3.382 N/A ARG 139.A N ALA 135.A O no hydrogen 2.929 N/A ARG 139.A NH1 PRO 145.A O no hydrogen 3.187 N/A VAL 140.A N ASN 136.A O no hydrogen 2.887 N/A MET 141.A N ILE 137.A O no hydrogen 3.198 N/A ARG 142.A N GLU 138.A O no hydrogen 3.256 N/A ARG 142.A N ARG 139.A O no hydrogen 3.143 N/A GLY 143.A N VAL 140.A O no hydrogen 3.302 N/A GLU 144.A N ARG 139.A O no hydrogen 2.822 N/A THR 146.A OG1 ASP 148.A OD1 no hydrogen 3.292 N/A THR 146.A OG1 LEU 150.A O no hydrogen 2.729 N/A GLY 149.A N THR 146.A O no hydrogen 3.417 N/A GLY 149.A N THR 146.A OG1 no hydrogen 3.188 N/A LEU 150.A N ASP 148.A OD1 no hydrogen 2.957 N/A GLN 154.A N PRO 248.A O no hydrogen 2.783 N/A GLN 154.A NE2.B GLY 152.A O no hydrogen 2.699 N/A PHE 157.A N GLN 154.A O no hydrogen 2.995 N/A LEU 158.A N GLN 154.A O no hydrogen 3.428 N/A ASP 159.A N GLN 155.A O no hydrogen 2.841 N/A ALA 160.A N PRO 156.A O no hydrogen 2.976 N/A LEU 161.A N PHE 157.A O no hydrogen 3.082 N/A ALA 162.A N LEU 158.A O no hydrogen 3.043 N/A LEU 163.A N ASP 159.A O no hydrogen 3.040 N/A MET 164.A N ALA 160.A O no hydrogen 3.029 N/A ASN 165.A N LEU 161.A O no hydrogen 3.265 N/A ASN 165.A N ALA 162.A O no hydrogen 3.294 N/A GLN 166.A N LEU 163.A O no hydrogen 3.080 N/A ARG 171.A NH1 ASP 206.A OD1 no hydrogen 2.935 N/A ARG 171.A NH2 ASP 206.A OD1 no hydrogen 3.061 N/A GLU 174.A N GLY 170.A O no hydrogen 2.988 N/A VAL 175.A N ARG 171.A O no hydrogen 2.931 N/A ALA 176.A N ALA 172.A O no hydrogen 3.025 N/A LYS 177.A N ALA 173.A O no hydrogen 2.952 N/A LYS 177.A NZ MET 164.A O no hydrogen 2.995 N/A LYS 177.A NZ GLN 166.A O no hydrogen 2.623 N/A ARG 178.A N GLU 174.A O no hydrogen 2.952 N/A ARG 178.A NE GLU 174.A OE2 no hydrogen 2.831 N/A ARG 178.A NH1 GLU 201.A OE1 no hydrogen 2.966 N/A ARG 178.A NH2 LEU 212.A O no hydrogen 2.860 N/A VAL 179.A N VAL 175.A O no hydrogen 2.917 N/A SER 180.A N ALA 176.A O no hydrogen 2.922 N/A SER 180.A OG LYS 177.A O no hydrogen 2.634 N/A LYS 181.A N LYS 177.A O no hydrogen 3.056 N/A LYS 181.A NZ GLU 214.A OE2 no hydrogen 3.016 N/A TRP 182.A N ARG 178.A O no hydrogen 3.047 N/A TRP 182.A NE1 GLU 201.A OE2 no hydrogen 2.727 N/A ARG 183.A N VAL 179.A O no hydrogen 2.921 N/A ARG 183.A NH1 ASP 194.A OD1 no hydrogen 3.002 N/A ILE 184.A N SER 180.A O no hydrogen 3.140 N/A LEU 185.A N LYS 181.A O no hydrogen 3.065 N/A SER 186.A N TRP 182.A O no hydrogen 2.779 N/A GLY 187.A N ARG 183.A O no hydrogen 3.191 N/A GLU 196.A N ASP 193.A OD1 no hydrogen 2.964 N/A TYR 197.A N ASP 193.A O no hydrogen 3.298 N/A ALA 198.A N ASP 194.A O no hydrogen 2.865 N/A ARG 199.A N ALA 195.A O no hydrogen 3.036 N/A TRP 200.A N GLU 196.A O no hydrogen 2.979 N/A TRP 200.A NE1 GLU 41.A OE1 no hydrogen 2.979 N/A GLU 201.A N TYR 197.A O no hydrogen 2.967 N/A GLU 202.A N ALA 198.A O no hydrogen 2.858 N/A ARG 203.A N ARG 199.A O no hydrogen 2.990 N/A ARG 203.A NH1 GLU 41.A OE1 no hydrogen 2.867 N/A ARG 203.A NH1 GLU 41.A OE2 no hydrogen 3.388 N/A ARG 203.A NH2 GLU 41.A OE2 no hydrogen 2.985 N/A ALA 204.A N TRP 200.A O no hydrogen 3.036 N/A ILE 205.A N GLU 201.A O no hydrogen 2.890 N/A ASP 206.A N GLU 202.A O no hydrogen 2.932 N/A HIS 207.A N ARG 203.A O no hydrogen 2.883 N/A ALA 208.A N ALA 204.A O no hydrogen 3.160 N/A GLY 209.A N ASP 206.A O no hydrogen 2.978 N/A GLY 210.A N ILE 205.A O no hydrogen 2.828 N/A VAL 211.A N ALA 208.A O no hydrogen 3.424 N/A TYR 219.A N TYR 216.A O no hydrogen 3.287 N/A SER 220.A N ALA 217.A O no hydrogen 2.967 N/A LEU 221.A N HIS 218.A O no hydrogen 3.265 N/A ARG 228.A N PRO 225.A O no hydrogen 3.227 N/A ARG 228.A NE GLU 231.A OE2 no hydrogen 2.979 N/A ARG 228.A NH1 ASP 113.A OD1 no hydrogen 2.896 N/A ARG 228.A NH1 ASP 113.A OD2 no hydrogen 3.552 N/A ARG 228.A NH1 GLU 231.A OE1 no hydrogen 2.835 N/A ARG 228.A NH1 GLU 231.A OE2 no hydrogen 3.542 N/A ARG 228.A NH2 ASP 113.A OD2 no hydrogen 2.836 N/A ALA 229.A N PRO 226.A O no hydrogen 3.118 N/A GLU 231.A N ARG 228.A O no hydrogen 3.087 N/A LEU 232.A N ALA 229.A O no hydrogen 3.126 N/A ARG 233.A N ALA 230.A O no hydrogen 3.367 N/A GLU 234.A N GLU 231.A O no hydrogen 3.122 N/A VAL 235.A N LEU 232.A O no hydrogen 3.112 N/A THR 236.A N HIS 115.A NE2 no hydrogen 3.380 N/A THR 239.A N THR 264.A O no hydrogen 3.185 N/A THR 239.A OG1 VAL 237.A O no hydrogen 3.115 N/A LEU 240.A N LEU 121.A O no hydrogen 2.817 N/A VAL 241.A N ARG 266.A O no hydrogen 2.867 N/A ILE 242.A N MET 123.A O no hydrogen 2.817 N/A GLN 243.A N ALA 268.A O no hydrogen 2.871 N/A GLU 245.A N ILE 270.A O no hydrogen 3.135 N/A HIS 246.A N MET 273.A O no hydrogen 2.814 N/A ASP 247.A N ALA 244.A O no hydrogen 3.253 N/A ILE 249.A N ASP 247.A OD1 no hydrogen 2.970 N/A ALA 250.A N ASP 247.A OD1 no hydrogen 3.124 N/A HIS 254.A N PRO 251.A O no hydrogen 2.911 N/A HIS 254.A NE2 PRO 151.A O no hydrogen 2.878 N/A HIS 257.A N PRO 253.A O no hydrogen 2.920 N/A LEU 258.A N HIS 254.A O no hydrogen 2.926 N/A ALA 259.A N GLY 255.A O no hydrogen 2.936 N/A GLY 260.A N LYS 256.A O no hydrogen 2.983 N/A LEU 261.A N LEU 258.A O no hydrogen 3.072 N/A ILE 262.A N ALA 259.A O no hydrogen 3.181 N/A THR 264.A OG1 VAL 237.A O no hydrogen 2.596 N/A ALA 265.A N ILE 262.A O no hydrogen 3.084 N/A ARG 266.A N THR 239.A O no hydrogen 2.888 N/A ARG 266.A NH2 SER 295.A OG no hydrogen 3.073 N/A ALA 268.A N VAL 241.A O no hydrogen 2.887 N/A ILE 270.A N GLN 243.A O no hydrogen 2.992 N/A GLY 272.A N GLU 245.A OE1 no hydrogen 2.801 N/A MET 273.A N ILE 270.A O no hydrogen 3.451 N/A HIS 275.A N LEU 185.A O no hydrogen 2.908 N/A HIS 275.A ND1 ASP 247.A OD1 no hydrogen 2.941 N/A HIS 275.A NE2 SER 101.A OG no hydrogen 2.800 N/A LEU 277.A N TYR 197.A OH no hydrogen 2.934 N/A SER 279.A N GLU 196.A OE2 no hydrogen 2.862 N/A SER 279.A OG GLU 196.A OE1 no hydrogen 2.644 N/A SER 279.A OG GLU 196.A OE2 no hydrogen 3.176 N/A SER 280.A OG PRO 191.A O no hydrogen 2.739 N/A VAL 281.A N PRO 278.A O no hydrogen 3.100 N/A HIS 282.A N SER 279.A O no hydrogen 3.052 N/A HIS 282.A NE2 LEU 277.A O no hydrogen 2.824 N/A LEU 285.A N VAL 281.A O no hydrogen 2.969 N/A ALA 286.A N HIS 282.A O no hydrogen 2.871 N/A GLU 287.A N GLY 283.A O no hydrogen 2.883 N/A VAL 288.A N PRO 284.A O no hydrogen 3.258 N/A ILE 289.A N LEU 285.A O no hydrogen 3.048 N/A LEU 290.A N ALA 286.A O no hydrogen 2.847 N/A ALA 291.A N GLU 287.A O no hydrogen 3.052 N/A HIS 292.A N VAL 288.A O no hydrogen 3.108 N/A THR 293.A N ILE 289.A O no hydrogen 2.914 N/A THR 293.A OG1 ILE 289.A O no hydrogen 3.304 N/A THR 293.A OG1 LEU 290.A O no hydrogen 3.153 N/A ARG 294.A N LEU 290.A O no hydrogen 3.037 N/A SER 295.A N ALA 291.A O no hydrogen 3.261 N/A SER 295.A OG HIS 292.A O no hydrogen 2.735 N/A ALA 296.A N HIS 292.A O no hydrogen 3.211 N/A ALA 296.A N THR 293.A O no hydrogen 3.198 N/A ALA 297.A N ARG 294.A O no hydrogen 3.360 N/A