Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2bpq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 5.A N SER 2.A OG no hydrogen 3.155 N/A ILE 6.A N SER 2.A O no hydrogen 2.997 N/A LEU 7.A N TRP 3.A O no hydrogen 2.802 N/A GLY 8.A N PRO 4.A O no hydrogen 2.925 N/A ARG 9.A N GLN 5.A O no hydrogen 3.071 N/A ARG 9.A NH1 ASP 15.A O no hydrogen 3.042 N/A LEU 10.A N ILE 6.A O no hydrogen 3.099 N/A THR 11.A N LEU 7.A O no hydrogen 3.017 N/A THR 11.A OG1 LEU 7.A O no hydrogen 3.534 N/A THR 11.A OG1 GLY 8.A O no hydrogen 3.000 N/A ASP 12.A N GLY 8.A O no hydrogen 2.985 N/A ASP 12.A N ARG 9.A O no hydrogen 3.197 N/A ASN 13.A N LEU 10.A O no hydrogen 2.992 N/A ARG 14.A N ARG 9.A O no hydrogen 3.130 N/A LEU 16.A N GLU 54.A OE2 no hydrogen 2.748 N/A ALA 17.A N GLN 20.A OE1 no hydrogen 2.941 N/A GLY 19.A N GLU 57.A OE2 no hydrogen 2.714 N/A GLN 20.A N ALA 17.A O no hydrogen 3.066 N/A GLN 20.A NE2 GLN 5.A OE1 no hydrogen 2.899 N/A ALA 22.A N GLU 57.A OE1 no hydrogen 2.917 N/A TRP 23.A N GLY 19.A O no hydrogen 3.024 N/A ALA 24.A N GLN 20.A O no hydrogen 3.030 N/A MET 25.A N ALA 21.A O no hydrogen 2.903 N/A ASP 26.A N ALA 22.A O no hydrogen 2.829 N/A GLN 27.A N TRP 23.A O no hydrogen 2.824 N/A ILE 28.A N ALA 24.A O no hydrogen 3.114 N/A MET 29.A N MET 25.A O no hydrogen 2.921 N/A THR 30.A N ASP 26.A O no hydrogen 2.909 N/A THR 30.A OG1 ASP 26.A O no hydrogen 2.764 N/A THR 30.A OG1 GLN 27.A O no hydrogen 3.498 N/A THR 30.A OG1 ASN 32.A OD1 no hydrogen 2.916 N/A GLY 31.A N ILE 28.A O no hydrogen 3.249 N/A ASN 32.A N GLN 27.A O no hydrogen 2.785 N/A ARG 34.A N GLN 37.A OE1 no hydrogen 2.883 N/A ILE 38.A N ARG 34.A O no hydrogen 3.047 N/A ALA 39.A N PRO 35.A O no hydrogen 3.051 N/A ALA 40.A N ALA 36.A O no hydrogen 2.925 N/A PHE 41.A N GLN 37.A O no hydrogen 2.970 N/A ALA 42.A N ILE 38.A O no hydrogen 2.880 N/A VAL 43.A N ALA 39.A O no hydrogen 2.908 N/A ALA 44.A N ALA 40.A O no hydrogen 2.963 N/A MET 45.A N PHE 41.A O no hydrogen 2.919 N/A THR 46.A N VAL 43.A O no hydrogen 2.956 N/A THR 46.A OG1 ALA 42.A O no hydrogen 2.650 N/A MET 47.A N VAL 43.A O no hydrogen 2.927 N/A MET 47.A N ALA 44.A O no hydrogen 3.119 N/A LYS 48.A N ALA 44.A O no hydrogen 2.986 N/A LYS 48.A NZ ASP 15.A OD1 no hydrogen 2.820 N/A LYS 48.A NZ ALA 49.A O no hydrogen 3.086 N/A LYS 48.A NZ GLU 54.A OE1 no hydrogen 2.609 N/A LYS 48.A NZ GLU 54.A OE2 no hydrogen 3.366 N/A GLU 54.A N THR 51.A OG1 no hydrogen 3.202 N/A VAL 55.A N THR 51.A O no hydrogen 2.940 N/A GLY 56.A N ALA 52.A O no hydrogen 2.829 N/A GLU 57.A N ASP 53.A O no hydrogen 3.154 N/A LEU 58.A N GLU 54.A O no hydrogen 2.905 N/A ALA 59.A N VAL 55.A O no hydrogen 2.902 N/A GLY 60.A N GLY 56.A O no hydrogen 2.888 N/A VAL 61.A N GLU 57.A O no hydrogen 3.118 N/A MET 62.A N LEU 58.A O no hydrogen 3.016 N/A LEU 63.A N ALA 59.A O no hydrogen 2.740 N/A SER 64.A N GLY 60.A O no hydrogen 2.911 N/A SER 64.A OG VAL 61.A O no hydrogen 2.709 N/A HIS 65.A N VAL 61.A O no hydrogen 3.332 N/A HIS 65.A N MET 62.A O no hydrogen 3.180 N/A HIS 65.A NE2 ASP 26.A OD1 no hydrogen 2.686 N/A ALA 66.A N LEU 63.A O no hydrogen 3.087 N/A HIS 67.A N PHE 158.A O no hydrogen 2.866 N/A THR 73.A OG1 PRO 70.A O no hydrogen 2.714 N/A ALA 78.A N PRO 75.A O no hydrogen 3.055 N/A VAL 79.A N PRO 108.A O no hydrogen 2.919 N/A ASP 80.A N ALA 192.A O no hydrogen 3.015 N/A VAL 82.A N LEU 194.A O no hydrogen 3.035 N/A THR 84.A N GLY 196.A O no hydrogen 2.769 N/A THR 84.A OG1 GLY 85.A O no hydrogen 2.864 N/A GLY 85.A N ASP 227.A OD2 no hydrogen 2.699 N/A VAL 89.A N GLY 86.A O no hydrogen 3.098 N/A ASN 90.A ND2 LEU 120.A O no hydrogen 3.426 N/A THR 91.A OG1 ASP 227.A OD1 no hydrogen 2.615 N/A THR 91.A OG1 ASP 227.A OD2 no hydrogen 3.557 N/A THR 91.A OG1 GLU 228.A OE2 no hydrogen 2.479 N/A VAL 92.A N ASN 90.A OD1 no hydrogen 3.080 N/A ASN 93.A ND2 LEU 265.A O no hydrogen 3.021 N/A SER 95.A N THR 91.A O no hydrogen 2.985 N/A THR 96.A N VAL 92.A O no hydrogen 3.031 N/A THR 96.A OG1 VAL 92.A O no hydrogen 2.672 N/A MET 97.A N ASN 93.A O no hydrogen 3.214 N/A ALA 98.A N LEU 94.A O no hydrogen 2.826 N/A ALA 99.A N SER 95.A O no hydrogen 3.029 N/A ILE 100.A N THR 96.A O no hydrogen 3.213 N/A VAL 101.A N MET 97.A O no hydrogen 3.030 N/A VAL 102.A N ALA 98.A O no hydrogen 2.861 N/A ALA 103.A N ALA 99.A O no hydrogen 2.941 N/A ALA 104.A N ILE 100.A O no hydrogen 2.819 N/A ALA 105.A N VAL 101.A O no hydrogen 2.908 N/A ALA 105.A N VAL 102.A O no hydrogen 3.170 N/A GLY 106.A N ALA 103.A O no hydrogen 2.937 N/A VAL 107.A N VAL 102.A O no hydrogen 3.268 N/A VAL 109.A N GLY 149.A O no hydrogen 3.244 N/A VAL 110.A N VAL 79.A O no hydrogen 2.946 N/A LYS 111.A N GLY 151.A O no hydrogen 3.020 N/A LYS 111.A NZ VAL 81.A O no hydrogen 2.693 N/A GLY 113.A N CYS 153.A O no hydrogen 3.138 N/A ARG 115.A N ASN 114.A OD1 no hydrogen 2.793 N/A ARG 115.A NE GLU 128.A OE1 no hydrogen 3.126 N/A ARG 115.A NH2 GLU 128.A OE1 no hydrogen 3.259 N/A ARG 115.A NH2 GLU 128.A OE2 no hydrogen 2.870 N/A ALA 116.A N ASP 125.A OD2 no hydrogen 2.730 N/A SER 118.A N ARG 115.A O no hydrogen 3.003 N/A SER 119.A OG ARG 115.A O no hydrogen 2.864 N/A ALA 124.A N ASN 114.A O no hydrogen 3.286 N/A LEU 127.A N GLY 123.A O no hydrogen 3.059 N/A GLU 128.A N ALA 124.A O no hydrogen 2.978 N/A ALA 129.A N ASP 125.A O no hydrogen 2.936 N/A LEU 130.A N THR 126.A O no hydrogen 3.056 N/A LEU 130.A N LEU 127.A O no hydrogen 3.068 N/A GLY 131.A N GLU 128.A O no hydrogen 2.858 N/A VAL 132.A N LEU 127.A O no hydrogen 3.035 N/A ARG 133.A NH1 GLY 343.A O no hydrogen 2.809 N/A VAL 141.A N GLY 137.A O no hydrogen 2.863 N/A ALA 142.A N PRO 138.A O no hydrogen 3.020 N/A ARG 143.A N ASP 139.A O no hydrogen 3.052 N/A ARG 143.A NE GLU 147.A OE2 no hydrogen 2.764 N/A ARG 143.A NH2 GLU 147.A OE1 no hydrogen 3.320 N/A ARG 143.A NH2 GLU 147.A OE2 no hydrogen 3.014 N/A SER 144.A N LEU 140.A O no hydrogen 2.895 N/A SER 144.A OG ILE 150.A O no hydrogen 2.611 N/A LEU 145.A N VAL 141.A O no hydrogen 2.943 N/A ALA 146.A N ALA 142.A O no hydrogen 3.158 N/A GLU 147.A N ARG 143.A O no hydrogen 2.882 N/A VAL 148.A N SER 144.A O no hydrogen 2.766 N/A GLY 149.A N SER 144.A O no hydrogen 3.256 N/A GLY 149.A N LEU 145.A O no hydrogen 3.002 N/A GLY 151.A N VAL 109.A O no hydrogen 2.955 N/A CYS 153.A N LYS 111.A O no hydrogen 2.746 N/A CYS 153.A SG LYS 111.A O no hydrogen 3.799 N/A ALA 155.A N GLY 113.A O no hydrogen 2.769 N/A ARG 157.A NH1 ASP 135.A OD1 no hydrogen 3.335 N/A PHE 158.A N PHE 154.A O no hydrogen 3.145 N/A PHE 158.A N ALA 155.A O no hydrogen 2.984 N/A HIS 159.A N ALA 155.A O no hydrogen 2.816 N/A ALA 165.A N TYR 162.A O no hydrogen 3.018 N/A VAL 168.A N HIS 164.A O no hydrogen 2.924 N/A ARG 169.A N ALA 165.A O no hydrogen 2.880 N/A ARG 170.A N ALA 166.A O no hydrogen 3.031 N/A GLU 171.A N ALA 167.A O no hydrogen 2.954 N/A GLU 171.A N VAL 168.A O no hydrogen 3.122 N/A ILE 172.A N VAL 168.A O no hydrogen 2.935 N/A GLY 173.A N ARG 169.A O no hydrogen 2.893 N/A VAL 177.A N THR 46.A OG1 no hydrogen 2.878 N/A PHE 178.A N THR 176.A OG1 no hydrogen 3.211 N/A ASN 179.A N THR 176.A O no hydrogen 2.876 N/A ASN 179.A ND2 THR 176.A O no hydrogen 3.539 N/A LEU 180.A N VAL 177.A O no hydrogen 3.018 N/A LEU 184.A N LEU 181.A O no hydrogen 2.906 N/A THR 185.A N GLY 182.A O no hydrogen 2.918 N/A THR 185.A OG1 GLY 182.A O no hydrogen 3.368 N/A ASN 186.A ND2 ASP 80.A OD2 no hydrogen 3.026 N/A ASN 186.A ND2 VAL 110.A O no hydrogen 2.913 N/A ALA 188.A N ASN 186.A OD1 no hydrogen 2.954 N/A ARG 189.A N ASN 186.A O no hydrogen 2.895 N/A ARG 191.A NH1 ASP 76.A O no hydrogen 2.834 N/A GLY 193.A N SER 216.A O no hydrogen 3.186 N/A LEU 194.A N ASP 80.A O no hydrogen 3.024 N/A ILE 195.A N LEU 218.A O no hydrogen 2.887 N/A GLY 196.A N VAL 82.A O no hydrogen 2.736 N/A CYS 197.A N VAL 220.A O no hydrogen 2.977 N/A CYS 197.A SG THR 84.A OG1 no hydrogen 3.679 N/A CYS 197.A SG PHE 199.A O no hydrogen 3.306 N/A ALA 198.A N THR 84.A OG1 no hydrogen 3.418 N/A LEU 202.A N ASP 201.A OD1 no hydrogen 2.886 N/A ALA 203.A N PHE 199.A O no hydrogen 2.923 N/A GLU 204.A N ALA 200.A O no hydrogen 3.083 N/A VAL 205.A N ASP 201.A O no hydrogen 3.254 N/A MET 206.A N LEU 202.A O no hydrogen 2.723 N/A ALA 207.A N ALA 203.A O no hydrogen 2.908 N/A GLY 208.A N GLU 204.A O no hydrogen 3.248 N/A VAL 209.A N VAL 205.A O no hydrogen 3.151 N/A PHE 210.A N MET 206.A O no hydrogen 2.933 N/A ALA 211.A N ALA 207.A O no hydrogen 2.864 N/A ALA 212.A N GLY 208.A O no hydrogen 3.252 N/A ARG 213.A N VAL 209.A O no hydrogen 3.137 N/A ARG 213.A NH1 LEU 184.A O no hydrogen 3.205 N/A ARG 213.A NH2 LEU 184.A O no hydrogen 2.769 N/A ARG 214.A N ALA 211.A O no hydrogen 3.019 N/A SER 215.A N PHE 210.A O no hydrogen 3.119 N/A SER 216.A N ARG 191.A O no hydrogen 2.843 N/A SER 216.A OG ALA 302.A O no hydrogen 2.641 N/A VAL 217.A N VAL 240.A O no hydrogen 3.081 N/A LEU 218.A N GLY 193.A O no hydrogen 2.980 N/A VAL 219.A N TRP 238.A O no hydrogen 3.027 N/A VAL 220.A N ILE 195.A O no hydrogen 2.781 N/A HIS 221.A N THR 236.A O no hydrogen 2.966 N/A HIS 221.A ND1 CYS 197.A O no hydrogen 2.830 N/A GLY 222.A N LEU 226.A O no hydrogen 2.863 N/A ASP 223.A N THR 234.A O no hydrogen 2.966 N/A GLY 225.A N GLY 222.A O no hydrogen 2.771 N/A LEU 226.A N ASP 224.A OD1 no hydrogen 3.205 N/A LEU 229.A N ASN 295.A OD1 no hydrogen 2.877 N/A THR 230.A N SER 235.A OG no hydrogen 3.070 N/A THR 230.A OG1 ASP 224.A OD2 no hydrogen 2.702 N/A THR 232.A N THR 230.A OG1 no hydrogen 3.147 N/A THR 232.A OG1 ALA 260.A O no hydrogen 3.354 N/A THR 234.A N THR 233.A OG1 no hydrogen 2.742 N/A THR 234.A OG1 ASP 223.A OD2 no hydrogen 2.541 N/A SER 235.A N PHE 250.A O no hydrogen 2.878 N/A THR 236.A N HIS 221.A O no hydrogen 2.767 N/A THR 236.A OG1 ASP 223.A OD1 no hydrogen 3.309 N/A ILE 237.A N LEU 248.A O no hydrogen 2.997 N/A TRP 238.A N VAL 219.A O no hydrogen 2.811 N/A TRP 238.A NE1 GLU 204.A OE1 no hydrogen 2.798 N/A ARG 239.A N ASP 246.A O no hydrogen 2.831 N/A ARG 239.A NE ASP 246.A OD2 no hydrogen 2.775 N/A ARG 239.A NH2 ASP 246.A OD2 no hydrogen 2.979 N/A VAL 240.A N VAL 217.A O no hydrogen 2.847 N/A ALA 241.A N SER 244.A O no hydrogen 3.219 N/A SER 244.A N ALA 241.A O no hydrogen 3.169 N/A SER 244.A OG ALA 241.A O no hydrogen 3.569 N/A ASP 246.A N ARG 239.A O no hydrogen 2.849 N/A LYS 247.A NZ GLU 204.A OE1 no hydrogen 2.895 N/A LEU 248.A N ILE 237.A O no hydrogen 2.899 N/A PHE 250.A N SER 235.A O no hydrogen 2.865 N/A ALA 253.A N ASP 251.A OD1 no hydrogen 3.079 N/A GLY 254.A N ASP 251.A O no hydrogen 3.029 N/A PHE 255.A N PRO 252.A O no hydrogen 2.896 N/A GLY 256.A N ALA 253.A O no hydrogen 2.993 N/A PHE 257.A N PRO 252.A O no hydrogen 3.154 N/A ARG 259.A NH1 ASP 251.A OD1 no hydrogen 2.794 N/A ARG 259.A NH2 ASP 251.A OD1 no hydrogen 3.350 N/A ARG 259.A NH2 ASP 251.A OD2 no hydrogen 3.206 N/A ALA 260.A N THR 231.A O no hydrogen 3.009 N/A GLN 261.A N GLN 264.A OE1 no hydrogen 2.771 N/A GLN 264.A N GLN 261.A O no hydrogen 2.983 N/A LEU 265.A N LEU 262.A O no hydrogen 3.022 N/A ALA 266.A N ASP 263.A O no hydrogen 3.136 N/A GLY 268.A N ASN 273.A OD1 no hydrogen 3.060 N/A ALA 272.A N ASP 269.A OD1 no hydrogen 2.912 N/A ASN 273.A N ASP 269.A O no hydrogen 2.861 N/A ASN 273.A ND2 THR 126.A OG1 no hydrogen 2.984 N/A ALA 274.A N ALA 270.A O no hydrogen 2.887 N/A ALA 275.A N GLN 271.A O no hydrogen 2.975 N/A ALA 276.A N ALA 272.A O no hydrogen 2.992 N/A VAL 277.A N ASN 273.A O no hydrogen 2.876 N/A ARG 278.A N ALA 274.A O no hydrogen 3.205 N/A ALA 279.A N ALA 275.A O no hydrogen 3.163 N/A VAL 280.A N ALA 276.A O no hydrogen 2.916 N/A LEU 281.A N VAL 277.A O no hydrogen 2.884 N/A GLY 282.A N ARG 278.A O no hydrogen 2.915 N/A GLY 283.A N VAL 280.A O no hydrogen 2.992 N/A ALA 284.A N ALA 279.A O no hydrogen 3.087 N/A ARG 289.A NH1 ASP 328.A OD1 no hydrogen 3.119 N/A ARG 289.A NH2 ASP 328.A OD1 no hydrogen 3.030 N/A ARG 289.A NH2 ASP 328.A OD2 no hydrogen 3.454 N/A ASP 290.A N GLY 286.A O no hydrogen 3.077 N/A ALA 291.A N PRO 287.A O no hydrogen 3.047 N/A VAL 292.A N VAL 288.A O no hydrogen 2.970 N/A VAL 293.A N ARG 289.A O no hydrogen 2.857 N/A LEU 294.A N ASP 290.A O no hydrogen 2.911 N/A ASN 295.A N ALA 291.A O no hydrogen 3.051 N/A ASN 295.A ND2 LEU 229.A O no hydrogen 2.957 N/A ASN 295.A ND2 ALA 291.A O no hydrogen 2.867 N/A ALA 296.A N VAL 292.A O no hydrogen 2.808 N/A ALA 297.A N VAL 293.A O no hydrogen 2.845 N/A GLY 298.A N LEU 294.A O no hydrogen 3.037 N/A ALA 299.A N ASN 295.A O no hydrogen 3.046 N/A ILE 300.A N ALA 296.A O no hydrogen 3.059 N/A VAL 301.A N ALA 297.A O no hydrogen 2.829 N/A ALA 302.A N GLY 298.A O no hydrogen 2.963 N/A HIS 303.A N ALA 299.A O no hydrogen 2.866 N/A HIS 303.A NE2 ASP 77.A OD2 no hydrogen 2.753 N/A ALA 304.A N ILE 300.A O no hydrogen 2.826 N/A GLY 305.A N VAL 301.A O no hydrogen 3.068 N/A LEU 306.A N HIS 303.A O no hydrogen 3.150 N/A SER 307.A N ALA 304.A O no hydrogen 3.013 N/A ARG 309.A N SER 307.A OG no hydrogen 3.347 N/A ALA 310.A N SER 307.A O no hydrogen 3.127 N/A ALA 315.A N GLU 311.A O no hydrogen 2.887 N/A TRP 316.A N TRP 312.A O no hydrogen 2.962 N/A GLU 317.A N LEU 313.A O no hydrogen 2.950 N/A GLU 318.A N PRO 314.A O no hydrogen 2.913 N/A GLY 319.A N ALA 315.A O no hydrogen 2.775 N/A LEU 320.A N TRP 316.A O no hydrogen 2.784 N/A ARG 321.A N GLU 317.A O no hydrogen 2.909 N/A ARG 321.A NE GLU 318.A OE1 no hydrogen 3.108 N/A ARG 321.A NH2 GLU 318.A OE1 no hydrogen 2.915 N/A ARG 322.A N GLU 318.A O no hydrogen 2.834 N/A ARG 322.A NH2 ALA 105.A O no hydrogen 2.721 N/A ALA 323.A N GLY 319.A O no hydrogen 2.965 N/A SER 324.A N LEU 320.A O no hydrogen 3.034 N/A SER 324.A OG LEU 320.A O no hydrogen 3.252 N/A ALA 325.A N ARG 321.A O no hydrogen 2.881 N/A ALA 326.A N ARG 322.A O no hydrogen 2.935 N/A ILE 327.A N ALA 323.A O no hydrogen 3.375 N/A ASP 328.A N SER 324.A O no hydrogen 2.868 N/A THR 329.A N ALA 325.A O no hydrogen 2.869 N/A THR 329.A OG1 ALA 325.A O no hydrogen 2.689 N/A GLY 330.A N ILE 327.A O no hydrogen 2.927 N/A ALA 332.A N ALA 326.A O no hydrogen 2.936 N/A GLN 334.A N GLY 330.A O no hydrogen 2.871 N/A GLN 334.A NE2 THR 329.A O no hydrogen 3.564 N/A LEU 335.A N ALA 331.A O no hydrogen 2.887 N/A LEU 336.A N ALA 332.A O no hydrogen 3.034 N/A ALA 337.A N GLU 333.A O no hydrogen 3.167 N/A ARG 338.A N GLN 334.A O no hydrogen 2.994 N/A TRP 339.A N LEU 335.A O no hydrogen 2.767 N/A VAL 340.A N LEU 336.A O no hydrogen 2.842 N/A ARG 341.A N ALA 337.A O no hydrogen 2.911 N/A PHE 342.A N ARG 338.A O no hydrogen 2.795 N/A ARG 344.A N ARG 341.A O no hydrogen 2.995 N/A GLN 345.A N ARG 341.A O no hydrogen 3.442 N/A GLN 345.A N PHE 342.A O no hydrogen 3.549 N/A