Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2b5v_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N LYS 16.A O no hydrogen 2.693 N/A LYS 2.A N GLU 124.A OE1 no hydrogen 2.859 N/A ALA 3.A N ILE 14.A O no hydrogen 2.914 N/A ILE 4.A N MET 122.A O no hydrogen 2.820 N/A ALA 5.A N VAL 12.A O no hydrogen 2.921 N/A VAL 6.A N LEU 57.A O no hydrogen 3.128 N/A ARG 8.A N ASP 55.A O no hydrogen 3.003 N/A VAL 12.A N ALA 5.A O no hydrogen 2.867 N/A ILE 14.A N ALA 3.A O no hydrogen 2.777 N/A LYS 16.A N MET 1.A O no hydrogen 2.819 N/A LYS 16.A NZ HIS 56.A NE2 no hydrogen 3.106 N/A GLU 22.A N GLU 25.A OE1 no hydrogen 2.840 N/A SER 23.A OG ASP 72.A OD2 no hydrogen 2.651 N/A GLY 24.A N ASP 72.A OD1 no hydrogen 2.834 N/A GLU 25.A N GLU 22.A O no hydrogen 3.030 N/A ALA 26.A N SER 128.A O no hydrogen 3.047 N/A LEU 27.A N ASP 69.A O no hydrogen 2.893 N/A VAL 28.A N PHE 126.A O no hydrogen 2.728 N/A ARG 29.A N VAL 66.A O no hydrogen 2.813 N/A ARG 29.A NE SER 353.A OG no hydrogen 3.159 N/A ARG 29.A NH1 THR 354.A O no hydrogen 3.015 N/A THR 30.A N GLU 124.A O no hydrogen 2.974 N/A THR 30.A OG1 TYR 121.A O no hydrogen 3.560 N/A THR 30.A OG1 SER 123.A O no hydrogen 2.646 N/A LEU 31.A N VAL 64.A O no hydrogen 2.968 N/A ARG 32.A N VAL 64.A O no hydrogen 3.400 N/A ARG 32.A NE GLU 351.A OE1 no hydrogen 2.949 N/A ARG 32.A NH1 GLU 142.A O no hydrogen 2.802 N/A ARG 32.A NH2 GLU 351.A OE1 no hydrogen 2.806 N/A VAL 33.A N ILE 350.A O no hydrogen 3.010 N/A GLY 34.A N GLU 62.A O no hydrogen 2.721 N/A VAL 35.A N THR 348.A O no hydrogen 3.005 N/A ASP 36.A N ASP 39.A OD2 no hydrogen 2.867 N/A THR 38.A OG1 HIS 61.A NE2 no hydrogen 3.224 N/A HIS 40.A N ASP 36.A O no hydrogen 3.277 N/A HIS 40.A NE2 PHE 339.A O no hydrogen 2.974 N/A GLU 41.A N GLY 37.A O no hydrogen 2.856 N/A VAL 42.A N THR 38.A O no hydrogen 2.958 N/A ILE 43.A N ASP 39.A O no hydrogen 3.036 N/A ALA 44.A N GLU 41.A O no hydrogen 2.866 N/A GLY 45.A N GLU 41.A O no hydrogen 2.974 N/A GLY 46.A N GLU 41.A O no hydrogen 3.137 N/A HIS 47.A N GLY 45.A O no hydrogen 2.409 N/A GLU 54.A N PRO 51.A O no hydrogen 2.989 N/A LEU 57.A N VAL 6.A O no hydrogen 2.978 N/A VAL 58.A N HIS 119.A ND1 no hydrogen 3.127 N/A LEU 59.A N ILE 4.A O no hydrogen 3.104 N/A GLY 60.A N ASP 39.A OD1 no hydrogen 2.961 N/A VAL 64.A N ARG 32.A O no hydrogen 3.146 N/A GLY 65.A N VAL 81.A O no hydrogen 2.931 N/A VAL 66.A N ARG 29.A O no hydrogen 2.947 N/A VAL 67.A N ASP 79.A O no hydrogen 2.950 N/A VAL 68.A N LEU 27.A O no hydrogen 2.907 N/A ASP 69.A N LEU 27.A O no hydrogen 3.289 N/A ASN 71.A N ASP 69.A OD2 no hydrogen 2.896 N/A ASN 71.A ND2 GLU 25.A O no hydrogen 3.195 N/A THR 73.A N PRO 70.A O no hydrogen 2.894 N/A THR 73.A OG1 PRO 70.A O no hydrogen 2.688 N/A GLU 74.A N GLU 130.A OE1 no hydrogen 3.433 N/A GLU 74.A N GLU 130.A OE2 no hydrogen 2.708 N/A LEU 75.A N THR 73.A OG1 no hydrogen 3.273 N/A GLU 76.A N ASP 79.A OD2 no hydrogen 2.726 N/A GLY 78.A N VAL 67.A O no hydrogen 2.835 N/A ASP 79.A N GLU 76.A O no hydrogen 2.966 N/A VAL 81.A N GLY 65.A O no hydrogen 2.858 N/A VAL 82.A N VAL 134.A O no hydrogen 2.883 N/A THR 84.A N TYR 132.A O no hydrogen 2.984 N/A ARG 86.A NE GLU 112.A OE2 no hydrogen 2.873 N/A ARG 86.A NH1 PRO 102.A O no hydrogen 2.903 N/A ARG 86.A NH1 ALA 105.A O no hydrogen 3.208 N/A ARG 86.A NH2 GLU 112.A OE2 no hydrogen 2.963 N/A ARG 87.A N PHE 111.A O no hydrogen 2.946 N/A ARG 87.A NH1 THR 84.A O no hydrogen 3.002 N/A ARG 87.A NH1 THR 84.A OG1 no hydrogen 2.935 N/A ARG 87.A NH1 ARG 86.A O no hydrogen 2.752 N/A ARG 87.A NH2 THR 84.A O no hydrogen 2.980 N/A ARG 87.A NH2 SER 128.A OG no hydrogen 2.964 N/A GLY 92.A N PRO 89.A O no hydrogen 2.878 N/A THR 93.A OG1 ASN 94.A O no hydrogen 3.365 N/A THR 93.A OG1 GLU 98.A OE2 no hydrogen 3.085 N/A ASN 94.A ND2 MET 109.A O no hydrogen 3.070 N/A PHE 97.A N ASN 94.A OD1 no hydrogen 3.240 N/A GLU 98.A N ASN 94.A O no hydrogen 2.780 N/A ARG 99.A N GLU 95.A O no hydrogen 2.933 N/A ASP 100.A N PHE 97.A O no hydrogen 3.032 N/A GLN 101.A N TYR 96.A O no hydrogen 2.696 N/A MET 104.A N GLN 101.A O no hydrogen 2.947 N/A ALA 105.A N PRO 102.A O no hydrogen 3.023 N/A MET 109.A N PRO 106.A O no hydrogen 2.939 N/A PHE 111.A N ARG 87.A O no hydrogen 2.870 N/A GLU 112.A N VAL 116.A O no hydrogen 2.917 N/A ARG 113.A N VAL 85.A O no hydrogen 2.991 N/A ARG 113.A NE HIS 119.A O no hydrogen 2.748 N/A ARG 113.A NH1 THR 127.A O no hydrogen 3.017 N/A ARG 113.A NH2 HIS 119.A O no hydrogen 3.448 N/A ARG 113.A NH2 GLY 120.A O no hydrogen 3.043 N/A GLY 114.A N ALA 118.A O no hydrogen 2.831 N/A ILE 115.A N GLU 112.A O no hydrogen 2.874 N/A VAL 116.A N GLU 112.A O no hydrogen 2.750 N/A GLY 117.A N GLY 49.A O no hydrogen 2.580 N/A GLY 120.A N VAL 58.A O no hydrogen 2.702 N/A TYR 121.A N GLY 60.A O no hydrogen 2.882 N/A TYR 121.A OH THR 84.A O no hydrogen 2.835 N/A MET 122.A N LEU 59.A O no hydrogen 2.901 N/A SER 123.A N TYR 121.A O no hydrogen 2.755 N/A SER 123.A OG PHE 125.A O no hydrogen 2.661 N/A GLU 124.A N LYS 2.A O no hydrogen 2.988 N/A PHE 126.A N VAL 28.A O no hydrogen 2.965 N/A SER 128.A N ALA 26.A O no hydrogen 3.383 N/A SER 128.A OG THR 127.A O no hydrogen 2.680 N/A GLU 130.A N GLY 24.A O no hydrogen 2.847 N/A TYR 132.A N PRO 129.A O no hydrogen 2.931 N/A LEU 133.A N GLU 130.A O no hydrogen 3.038 N/A VAL 134.A N VAL 82.A O no hydrogen 2.905 N/A ILE 136.A N ILE 80.A O no hydrogen 3.028 N/A ARG 138.A NH1 ARG 138.A O no hydrogen 3.481 N/A GLN 140.A N PRO 137.A O no hydrogen 2.777 N/A GLN 140.A NE2 THR 311.A O no hydrogen 3.025 N/A ALA 141.A N ARG 138.A O no hydrogen 3.082 N/A GLU 142.A N GLU 142.A OE2 no hydrogen 2.631 N/A LEU 143.A N GLN 140.A O no hydrogen 3.309 N/A GLY 144.A N ALA 141.A O no hydrogen 3.228 N/A LEU 146.A N LEU 143.A O no hydrogen 2.901 N/A ILE 147.A N GLY 144.A O no hydrogen 3.099 N/A ILE 150.A N LEU 146.A O no hydrogen 3.043 N/A SER 151.A N ILE 147.A O no hydrogen 2.796 N/A SER 151.A OG ILE 147.A O no hydrogen 3.310 N/A ILE 152.A N GLU 148.A O no hydrogen 3.117 N/A THR 153.A N PRO 149.A O no hydrogen 3.467 N/A THR 153.A OG1 THR 186.A OG1 no hydrogen 2.748 N/A THR 153.A OG1 TYR 245.A OH no hydrogen 2.705 N/A GLU 154.A N ILE 150.A O no hydrogen 2.991 N/A LYS 155.A N SER 151.A O no hydrogen 3.056 N/A LYS 155.A NZ ASP 103.A OD2 no hydrogen 2.858 N/A LYS 155.A NZ VAL 300.A O no hydrogen 2.875 N/A ALA 156.A N ILE 152.A O no hydrogen 3.090 N/A LEU 157.A N THR 153.A O no hydrogen 2.887 N/A GLU 158.A N GLU 154.A O no hydrogen 3.069 N/A HIS 159.A N LYS 155.A O no hydrogen 3.037 N/A ALA 160.A N ALA 156.A O no hydrogen 2.951 N/A TYR 161.A N LEU 157.A O no hydrogen 2.801 N/A TYR 161.A OH ASP 193.A OD2 no hydrogen 2.723 N/A TYR 161.A OH TYR 197.A OH no hydrogen 2.671 N/A ALA 162.A N GLU 158.A O no hydrogen 2.991 N/A SER 163.A N HIS 159.A O no hydrogen 3.136 N/A SER 163.A N ALA 160.A O no hydrogen 3.206 N/A SER 163.A OG ALA 160.A O no hydrogen 2.700 N/A ARG 164.A N TYR 161.A O no hydrogen 3.030 N/A ARG 164.A NE SER 163.A OG no hydrogen 3.234 N/A ARG 164.A NH1 SER 163.A O no hydrogen 3.174 N/A ARG 164.A NH2 ASN 264.A O no hydrogen 3.059 N/A ARG 164.A NH2 ASN 293.A O no hydrogen 2.960 N/A SER 165.A N ALA 162.A O no hydrogen 3.186 N/A SER 165.A OG ALA 162.A O no hydrogen 2.638 N/A SER 172.A N ASP 242.A OD2 no hydrogen 2.759 N/A SER 172.A OG ASP 242.A OD2 no hydrogen 3.280 N/A SER 173.A N ASP 242.A OD2 no hydrogen 3.129 N/A SER 173.A OG GLN 240.A O no hydrogen 3.176 N/A ALA 174.A N ASN 199.A O no hydrogen 2.993 N/A PHE 175.A N PHE 243.A O no hydrogen 2.835 N/A VAL 176.A N TYR 201.A O no hydrogen 2.855 N/A LEU 177.A N TYR 245.A O no hydrogen 2.808 N/A GLY 178.A N LEU 203.A O no hydrogen 2.896 N/A ASN 179.A ND2 THR 212.A OG1 no hydrogen 2.869 N/A LEU 184.A N GLY 180.A O no hydrogen 2.950 N/A LEU 185.A N SER 181.A O no hydrogen 3.028 N/A THR 186.A N LEU 182.A O no hydrogen 2.921 N/A THR 186.A OG1 THR 153.A OG1 no hydrogen 2.748 N/A THR 186.A OG1 LEU 182.A O no hydrogen 2.797 N/A LEU 187.A N GLY 183.A O no hydrogen 2.849 N/A ALA 188.A N LEU 184.A O no hydrogen 3.155 N/A MET 189.A N LEU 185.A O no hydrogen 3.003 N/A LEU 190.A N THR 186.A O no hydrogen 2.899 N/A LYS 191.A N LEU 187.A O no hydrogen 3.124 N/A VAL 192.A N MET 189.A O no hydrogen 3.141 N/A ASP 193.A N LEU 190.A O no hydrogen 3.235 N/A LYS 195.A N ASP 193.A OD1 no hydrogen 2.546 N/A GLY 196.A N ASP 193.A O no hydrogen 3.134 N/A TYR 197.A OH TYR 161.A OH no hydrogen 2.671 N/A GLU 198.A N SER 172.A O no hydrogen 2.601 N/A ASN 199.A N SER 172.A O no hydrogen 3.109 N/A TYR 201.A N ALA 174.A O no hydrogen 2.932 N/A TYR 201.A OH GLU 239.A OE2 no hydrogen 2.541 N/A CYS 202.A N THR 222.A O no hydrogen 2.914 N/A CYS 202.A SG VAL 176.A O no hydrogen 3.768 N/A CYS 202.A SG GLY 178.A O no hydrogen 3.549 N/A LEU 203.A N VAL 176.A O no hydrogen 2.832 N/A GLY 204.A N VAL 224.A O no hydrogen 2.924 N/A ARG 206.A N TYR 223.A OH no hydrogen 2.892 N/A ARG 206.A NH1 ASP 210.A OD2 no hydrogen 2.733 N/A ARG 206.A NH1 ASP 343.A O no hydrogen 3.130 N/A ARG 208.A NH1 GLU 217.A OE1 no hydrogen 2.861 N/A ARG 208.A NH1 GLU 217.A OE2 no hydrogen 3.392 N/A ARG 208.A NH2 GLU 217.A OE2 no hydrogen 2.625 N/A THR 212.A N ASP 210.A OD1 no hydrogen 2.639 N/A THR 212.A OG1 ASP 210.A OD1 no hydrogen 2.501 N/A ILE 213.A N ASP 210.A OD1 no hydrogen 3.204 N/A ASP 214.A N ASP 210.A O no hydrogen 3.094 N/A ILE 215.A N PRO 211.A O no hydrogen 3.081 N/A ILE 216.A N THR 212.A O no hydrogen 3.122 N/A GLU 217.A N ILE 213.A O no hydrogen 3.060 N/A GLU 218.A N ASP 214.A O no hydrogen 2.952 N/A LEU 219.A N ILE 215.A O no hydrogen 3.001 N/A ASP 220.A N GLU 217.A O no hydrogen 2.861 N/A ALA 221.A N ILE 216.A O no hydrogen 3.043 N/A THR 222.A N LEU 200.A O no hydrogen 2.964 N/A TYR 223.A OH ARG 206.A O no hydrogen 2.836 N/A VAL 224.A N CYS 202.A O no hydrogen 2.801 N/A SER 226.A N GLY 204.A O no hydrogen 2.851 N/A SER 226.A OG GLY 204.A O no hydrogen 3.496 N/A ARG 227.A N ASP 225.A OD1 no hydrogen 2.902 N/A ARG 227.A NE ASP 225.A OD1 no hydrogen 2.831 N/A ARG 227.A NE ASP 225.A OD2 no hydrogen 3.181 N/A ARG 227.A NH1 ASP 207.A OD1 no hydrogen 3.102 N/A ARG 227.A NH2 ASP 207.A OD1 no hydrogen 2.908 N/A ARG 227.A NH2 ASP 225.A OD2 no hydrogen 2.526 N/A GLN 228.A N ASP 225.A O no hydrogen 2.890 N/A THR 229.A N ASP 225.A O no hydrogen 2.852 N/A GLU 232.A N GLU 232.A OE1 no hydrogen 2.757 N/A ASP 233.A N PRO 230.A O no hydrogen 2.932 N/A VAL 234.A N VAL 231.A O no hydrogen 3.138 N/A ASP 236.A N ASP 233.A O no hydrogen 2.982 N/A VAL 237.A N ASP 233.A O no hydrogen 3.337 N/A TYR 238.A N VAL 234.A O no hydrogen 2.692 N/A MET 241.A N ALA 260.A O no hydrogen 2.952 N/A ASP 242.A N SER 173.A OG no hydrogen 3.153 N/A PHE 243.A N SER 173.A O no hydrogen 3.173 N/A ILE 244.A N VAL 266.A O no hydrogen 3.183 N/A TYR 245.A N PHE 175.A O no hydrogen 2.892 N/A TYR 245.A OH THR 153.A OG1 no hydrogen 2.705 N/A GLU 246.A N ALA 268.A O no hydrogen 2.927 N/A ALA 247.A N LEU 177.A O no hydrogen 2.850 N/A THR 248.A N GLU 246.A OE2 no hydrogen 2.954 N/A THR 248.A OG1 GLU 246.A OE2 no hydrogen 3.469 N/A GLY 249.A N GLU 246.A OE2 no hydrogen 2.793 N/A PHE 250.A N THR 248.A OG1 no hydrogen 3.191 N/A HIS 253.A N PHE 250.A O no hydrogen 2.873 N/A ALA 254.A N PRO 251.A O no hydrogen 3.020 N/A ILE 255.A N PRO 251.A O no hydrogen 3.455 N/A GLN 256.A N LYS 252.A O no hydrogen 2.804 N/A SER 257.A N HIS 253.A O no hydrogen 2.900 N/A SER 257.A OG HIS 253.A O no hydrogen 2.808 N/A VAL 258.A N ILE 255.A O no hydrogen 3.358 N/A GLN 259.A N GLN 256.A O no hydrogen 3.013 N/A ALA 260.A N SER 257.A O no hydrogen 2.967 N/A LEU 261.A N SER 257.A O no hydrogen 2.964 N/A ALA 262.A N MET 241.A O no hydrogen 2.829 N/A ASN 264.A N HIS 292.A O no hydrogen 2.745 N/A GLY 265.A N ALA 262.A O no hydrogen 2.983 N/A VAL 266.A N ASP 242.A O no hydrogen 3.222 N/A GLY 267.A N ALA 295.A O no hydrogen 2.843 N/A ALA 268.A N ILE 244.A O no hydrogen 2.819 N/A LEU 269.A N VAL 297.A O no hydrogen 2.770 N/A LEU 270.A N GLU 246.A O no hydrogen 3.037 N/A LEU 270.A N GLU 246.A OE1 no hydrogen 3.135 N/A GLY 271.A N GLU 246.A OE1 no hydrogen 2.818 N/A ALA 284.A N ASP 281.A OD1 no hydrogen 2.763 N/A PHE 285.A N ASP 281.A O no hydrogen 3.228 N/A HIS 286.A N ALA 282.A O no hydrogen 2.816 N/A ARG 287.A N GLY 283.A O no hydrogen 2.941 N/A GLU 288.A N ALA 284.A O no hydrogen 3.138 N/A MET 289.A N PHE 285.A O no hydrogen 3.081 N/A VAL 290.A N HIS 286.A O no hydrogen 3.147 N/A LEU 291.A N ARG 287.A O no hydrogen 2.861 N/A HIS 292.A N GLU 288.A O no hydrogen 3.137 N/A ASN 293.A N VAL 290.A O no hydrogen 3.224 N/A ASN 293.A ND2 ASN 264.A OD1 no hydrogen 3.538 N/A LYS 294.A N MET 289.A O no hydrogen 2.990 N/A LYS 294.A NZ VAL 258.A O no hydrogen 2.780 N/A LYS 294.A NZ LEU 261.A O no hydrogen 2.805 N/A LYS 294.A NZ GLU 288.A OE1 no hydrogen 2.596 N/A ALA 295.A N GLY 265.A O no hydrogen 3.225 N/A VAL 297.A N GLY 267.A O no hydrogen 2.844 N/A SER 299.A N LEU 269.A O no hydrogen 3.184 N/A HIS 303.A N HIS 306.A ND1 no hydrogen 3.004 N/A HIS 306.A N HIS 303.A O no hydrogen 2.899 N/A HIS 306.A NE2 GLU 158.A OE1 no hydrogen 2.941 N/A PHE 307.A N HIS 303.A O no hydrogen 3.258 N/A GLU 308.A N VAL 304.A O no hydrogen 2.903 N/A ALA 309.A N GLU 305.A O no hydrogen 3.028 N/A ALA 310.A N HIS 306.A O no hydrogen 2.846 N/A THR 311.A N PHE 307.A O no hydrogen 3.314 N/A THR 311.A N GLU 308.A O no hydrogen 3.209 N/A THR 311.A OG1 GLU 308.A O no hydrogen 2.697 N/A VAL 312.A N ALA 309.A O no hydrogen 3.054 N/A THR 313.A N ALA 309.A O no hydrogen 3.103 N/A THR 313.A OG1 GLU 154.A OE2 no hydrogen 2.439 N/A THR 313.A OG1 ALA 309.A O no hydrogen 3.398 N/A PHE 314.A N ALA 310.A O no hydrogen 2.817 N/A THR 315.A OG1 VAL 312.A O no hydrogen 2.897 N/A LYS 316.A N THR 313.A O no hydrogen 2.889 N/A LEU 317.A N PHE 314.A O no hydrogen 3.111 N/A LEU 322.A N PRO 318.A O no hydrogen 3.336 N/A GLU 323.A N LYS 319.A O no hydrogen 3.204 N/A ASP 324.A N TRP 320.A O no hydrogen 2.975 N/A LEU 325.A N PHE 321.A O no hydrogen 2.828 N/A VAL 326.A N LEU 322.A O no hydrogen 3.371 N/A THR 327.A N LYS 347.A O no hydrogen 2.833 N/A THR 327.A OG1 LYS 347.A O no hydrogen 3.221 N/A HIS 330.A N ALA 349.A O no hydrogen 2.945 N/A LEU 332.A N GLU 351.A O no hydrogen 3.008 N/A GLU 334.A N PRO 331.A O no hydrogen 2.861 N/A PHE 335.A N LEU 332.A O no hydrogen 3.057 N/A ALA 337.A N GLU 334.A O no hydrogen 3.095 N/A ALA 338.A N PHE 335.A O no hydrogen 2.832 N/A PHE 339.A N GLU 336.A O no hydrogen 3.073 N/A ASP 340.A N ALA 337.A O no hydrogen 3.257 N/A ASP 342.A N THR 345.A OG1 no hydrogen 3.217 N/A THR 344.A N ASP 342.A OD1 no hydrogen 2.779 N/A THR 344.A OG1 ASP 342.A OD1 no hydrogen 2.736 N/A THR 345.A N ASP 342.A O no hydrogen 2.989 N/A THR 345.A OG1 ASP 342.A O no hydrogen 3.109 N/A ILE 346.A N THR 327.A OG1 no hydrogen 2.926 N/A LYS 347.A N LEU 325.A O no hydrogen 3.237 N/A LYS 347.A NZ VAL 35.A O no hydrogen 2.803 N/A LYS 347.A NZ GLU 62.A OE1 no hydrogen 3.385 N/A LYS 347.A NZ GLU 62.A OE2 no hydrogen 2.883 N/A THR 348.A OG1 ALA 338.A O no hydrogen 2.660 N/A ALA 349.A N GLY 328.A O no hydrogen 3.050 N/A ILE 350.A N VAL 33.A O no hydrogen 2.822 N/A GLU 351.A N HIS 330.A O no hydrogen 2.736 N/A PHE 352.A N LEU 31.A O no hydrogen 2.770 N/A SER 353.A N LEU 31.A O no hydrogen 3.279 N/A SER 353.A OG THR 30.A O no hydrogen 2.952 N/A