Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3qbe_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N ILE 17.A O no hydrogen 3.093 N/A VAL 5.A N VAL 15.A O no hydrogen 2.904 N/A VAL 7.A N TYR 13.A O no hydrogen 2.827 N/A VAL 9.A N VAL 7.A O no hydrogen 2.870 N/A TYR 13.A N VAL 7.A O no hydrogen 3.250 N/A TYR 13.A OH GLN 156.A OE1 no hydrogen 2.765 N/A VAL 15.A N VAL 5.A O no hydrogen 2.827 N/A VAL 16.A N VAL 160.A O no hydrogen 2.697 N/A ILE 17.A N VAL 3.A O no hydrogen 2.782 N/A GLY 18.A N VAL 162.A O no hydrogen 3.129 N/A GLY 20.A N ASP 163.A OD1 no hydrogen 2.904 N/A LEU 21.A N ASP 163.A OD2 no hydrogen 3.149 N/A GLU 24.A N GLU 24.A OE1 no hydrogen 2.824 N/A LEU 25.A N LEU 21.A O no hydrogen 2.957 N/A GLU 26.A N LEU 22.A O no hydrogen 2.872 N/A ASP 27.A N ASP 23.A O no hydrogen 3.076 N/A LEU 28.A N GLU 24.A O no hydrogen 3.143 N/A LEU 28.A N LEU 25.A O no hydrogen 2.982 N/A LEU 29.A N LEU 25.A O no hydrogen 2.946 N/A ARG 32.A N LEU 29.A O no hydrogen 3.045 N/A ARG 32.A NH1 LYS 93.A O no hydrogen 3.019 N/A ARG 32.A NH1 ASP 94.A O no hydrogen 3.336 N/A ARG 32.A NH1 SER 120.A OG no hydrogen 3.188 N/A LYS 34.A N ASP 94.A OD1 no hydrogen 3.022 N/A LYS 34.A NZ ASP 60.A OD2 no hydrogen 2.807 N/A LYS 34.A NZ ILE 88.A O no hydrogen 3.536 N/A VAL 35.A N ASP 60.A O no hydrogen 3.199 N/A ALA 36.A N ALA 95.A O no hydrogen 3.004 N/A VAL 37.A N HIS 62.A O no hydrogen 2.729 N/A VAL 38.A N VAL 97.A O no hydrogen 2.802 N/A HIS 39.A N ILE 64.A O no hydrogen 2.811 N/A GLN 40.A N LEU 99.A O no hydrogen 3.340 N/A LEU 43.A N GLN 40.A O no hydrogen 3.042 N/A ALA 44.A N PRO 41.A O no hydrogen 3.173 N/A ALA 47.A N LEU 43.A O no hydrogen 3.090 N/A GLU 48.A N ALA 44.A O no hydrogen 2.902 N/A GLU 49.A N GLU 45.A O no hydrogen 2.957 N/A ILE 50.A N THR 46.A O no hydrogen 2.856 N/A ARG 51.A N ALA 47.A O no hydrogen 2.883 N/A LYS 52.A N GLU 48.A O no hydrogen 2.965 N/A ARG 53.A N GLU 49.A O no hydrogen 3.002 N/A ARG 53.A NH1 GLU 49.A OE2 no hydrogen 3.289 N/A LEU 54.A N ILE 50.A O no hydrogen 2.923 N/A ALA 55.A N ARG 51.A O no hydrogen 2.848 N/A GLY 56.A N LYS 52.A O no hydrogen 2.921 N/A LYS 57.A N LEU 54.A O no hydrogen 2.845 N/A GLY 58.A N ALA 55.A O no hydrogen 2.929 N/A VAL 59.A N LEU 54.A O no hydrogen 3.195 N/A ASP 60.A N HIS 33.A O no hydrogen 2.797 N/A HIS 62.A N VAL 35.A O no hydrogen 2.866 N/A ARG 63.A NE GLU 48.A OE2 no hydrogen 2.482 N/A ARG 63.A NH2 GLU 48.A OE2 no hydrogen 3.130 N/A ILE 64.A N VAL 37.A O no hydrogen 2.646 N/A ILE 66.A N HIS 39.A O no hydrogen 2.859 N/A GLY 72.A N ALA 69.A O no hydrogen 3.120 N/A LYS 73.A N GLU 70.A O no hydrogen 3.201 N/A LYS 73.A NZ ASP 106.A OD2 no hydrogen 2.620 N/A LEU 75.A N ASN 143.A O no hydrogen 3.096 N/A VAL 77.A N ASP 74.A O no hydrogen 2.817 N/A VAL 78.A N ASP 74.A O no hydrogen 3.281 N/A GLY 79.A N LEU 75.A O no hydrogen 2.961 N/A PHE 80.A N PRO 76.A O no hydrogen 2.999 N/A ILE 81.A N VAL 77.A O no hydrogen 2.886 N/A TRP 82.A N VAL 78.A O no hydrogen 2.870 N/A TRP 82.A NE1 THR 114.A OG1 no hydrogen 3.000 N/A GLU 83.A N GLY 79.A O no hydrogen 3.053 N/A VAL 84.A N PHE 80.A O no hydrogen 2.943 N/A LEU 85.A N ILE 81.A O no hydrogen 2.870 N/A GLY 86.A N TRP 82.A O no hydrogen 2.936 N/A ARG 87.A N GLU 83.A O no hydrogen 2.965 N/A ILE 88.A N VAL 84.A O no hydrogen 2.858 N/A GLY 89.A N LEU 85.A O no hydrogen 2.815 N/A ILE 90.A N LEU 85.A O no hydrogen 2.914 N/A GLY 91.A N ASP 94.A OD2 no hydrogen 2.616 N/A ASP 94.A N GLY 91.A O no hydrogen 3.045 N/A ALA 95.A N LYS 34.A O no hydrogen 3.289 N/A LEU 96.A N SER 120.A O no hydrogen 2.983 N/A VAL 97.A N ALA 36.A O no hydrogen 2.906 N/A SER 98.A N VAL 122.A O no hydrogen 2.809 N/A SER 98.A OG HIS 123.A ND1 no hydrogen 2.810 N/A LEU 99.A N VAL 38.A O no hydrogen 2.898 N/A GLY 100.A N LEU 124.A O no hydrogen 3.306 N/A GLY 101.A N GLN 40.A OE1 no hydrogen 3.035 N/A ALA 104.A N GLY 101.A O no hydrogen 2.998 N/A THR 105.A N GLY 101.A O no hydrogen 3.233 N/A THR 105.A OG1 GLY 102.A O no hydrogen 3.023 N/A ASP 106.A N GLY 102.A O no hydrogen 2.928 N/A VAL 107.A N ALA 103.A O no hydrogen 2.976 N/A ALA 108.A N ALA 104.A O no hydrogen 2.919 N/A GLY 109.A N THR 105.A O no hydrogen 2.824 N/A PHE 110.A N ASP 106.A O no hydrogen 2.883 N/A ALA 111.A N VAL 107.A O no hydrogen 2.907 N/A ALA 112.A N ALA 108.A O no hydrogen 2.886 N/A ALA 113.A N GLY 109.A O no hydrogen 2.869 N/A THR 114.A N PHE 110.A O no hydrogen 3.072 N/A THR 114.A N ALA 111.A O no hydrogen 3.246 N/A THR 114.A OG1 PHE 110.A O no hydrogen 2.750 N/A THR 114.A OG1 ALA 111.A O no hydrogen 3.434 N/A TRP 115.A N ALA 111.A O no hydrogen 2.907 N/A TRP 115.A NE1 ILE 90.A O no hydrogen 2.878 N/A ARG 117.A N THR 114.A O no hydrogen 3.186 N/A GLY 118.A N TRP 115.A O no hydrogen 2.802 N/A VAL 119.A N ALA 112.A O no hydrogen 2.842 N/A VAL 122.A N LEU 96.A O no hydrogen 2.909 N/A HIS 123.A N ALA 159.A O no hydrogen 3.057 N/A HIS 123.A ND1 SER 98.A OG no hydrogen 2.810 N/A LEU 124.A N SER 98.A O no hydrogen 2.820 N/A THR 126.A N GLY 100.A O no hydrogen 2.880 N/A GLY 130.A N THR 127.A OG1 no hydrogen 2.969 N/A MET 131.A N THR 127.A O no hydrogen 2.968 N/A VAL 132.A N LEU 128.A O no hydrogen 2.930 N/A ASP 133.A N LEU 129.A O no hydrogen 2.841 N/A ALA 134.A N LEU 129.A O no hydrogen 3.226 N/A ALA 135.A N GLY 130.A O no hydrogen 2.964 N/A VAL 136.A N ASP 133.A O no hydrogen 3.300 N/A GLY 137.A N TYR 13.A OH no hydrogen 2.836 N/A THR 140.A N ALA 153.A O no hydrogen 2.922 N/A THR 140.A OG1 ALA 153.A O no hydrogen 2.679 N/A ILE 142.A N VAL 151.A O no hydrogen 3.076 N/A ASN 143.A N LYS 73.A O no hydrogen 2.745 N/A ASN 143.A ND2 GLU 70.A O no hydrogen 3.663 N/A ASN 143.A ND2 GLU 70.A OE1 no hydrogen 2.874 N/A THR 144.A N GLY 147.A O no hydrogen 3.174 N/A ALA 146.A N THR 144.A OG1 no hydrogen 3.049 N/A GLY 147.A N THR 144.A O no hydrogen 3.163 N/A LYS 148.A NZ GLU 70.A OE1 no hydrogen 3.280 N/A ALA 153.A N THR 140.A O no hydrogen 3.191 N/A HIS 155.A N GLY 138.A O no hydrogen 2.667 N/A HIS 155.A NE2 VAL 119.A O no hydrogen 2.851 N/A GLN 156.A NE2 GLY 137.A O no hydrogen 3.188 N/A LEU 158.A N ILE 121.A O no hydrogen 2.748 N/A VAL 160.A N PRO 14.A O no hydrogen 2.994 N/A LEU 161.A N HIS 123.A O no hydrogen 2.906 N/A VAL 162.A N VAL 16.A O no hydrogen 2.670 N/A LEU 164.A N GLY 18.A O no hydrogen 2.956 N/A ALA 165.A N ASP 163.A OD1 no hydrogen 2.985 N/A THR 166.A N ASP 163.A O no hydrogen 3.013 N/A THR 166.A OG1 ASP 163.A O no hydrogen 2.875 N/A LEU 167.A N LEU 164.A O no hydrogen 2.865 N/A GLN 168.A N ALA 165.A O no hydrogen 2.977 N/A GLN 168.A NE2 LEU 164.A O no hydrogen 3.044 N/A GLN 168.A NE2 PRO 207.A O no hydrogen 3.407 N/A THR 169.A N THR 166.A O no hydrogen 3.510 N/A LEU 170.A N LEU 167.A O no hydrogen 3.035 N/A ARG 172.A NH1 GLN 202.A OE1 no hydrogen 3.361 N/A ARG 172.A NH2 GLN 202.A OE1 no hydrogen 3.205 N/A GLU 174.A N PRO 171.A O no hydrogen 2.949 N/A MET 175.A N PRO 171.A O no hydrogen 3.032 N/A ILE 176.A N ARG 172.A O no hydrogen 2.983 N/A CYS 177.A N ASP 173.A O no hydrogen 3.169 N/A CYS 177.A SG ASP 173.A O no hydrogen 3.616 N/A GLY 178.A N GLU 174.A O no hydrogen 2.993 N/A MET 179.A N MET 175.A O no hydrogen 3.033 N/A MET 179.A N ILE 176.A O no hydrogen 3.112 N/A GLU 181.A N GLY 178.A O no hydrogen 3.312 N/A VAL 183.A N MET 179.A O no hydrogen 2.914 N/A LYS 184.A N ALA 180.A O no hydrogen 2.924 N/A LYS 184.A NZ GLU 181.A OE1 no hydrogen 2.893 N/A LYS 184.A NZ LEU 236.A O no hydrogen 2.860 N/A ALA 185.A N GLU 181.A O no hydrogen 3.011 N/A GLY 186.A N VAL 182.A O no hydrogen 2.971 N/A PHE 187.A N VAL 183.A O no hydrogen 2.967 N/A ILE 188.A N LYS 184.A O no hydrogen 3.073 N/A ALA 189.A N ALA 185.A O no hydrogen 3.042 N/A ASP 190.A N ALA 185.A O no hydrogen 3.224 N/A VAL 192.A N ASP 190.A OD1 no hydrogen 3.107 N/A ILE 193.A N ASP 190.A O no hydrogen 2.995 N/A ASP 195.A N PRO 191.A O no hydrogen 3.144 N/A LEU 196.A N VAL 192.A O no hydrogen 2.850 N/A ILE 197.A N ILE 193.A O no hydrogen 3.078 N/A GLU 198.A N LEU 194.A O no hydrogen 2.918 N/A ALA 199.A N ASP 195.A O no hydrogen 3.100 N/A GLN 202.A NE2 SER 291.A O no hydrogen 3.290 N/A ALA 203.A N ASP 200.A OD1 no hydrogen 3.216 N/A ALA 204.A N PRO 201.A O no hydrogen 3.216 N/A LEU 205.A N GLN 202.A O no hydrogen 3.200 N/A ASP 206.A N ALA 203.A O no hydrogen 3.142 N/A ALA 208.A N ASP 206.A OD1 no hydrogen 2.728 N/A GLY 209.A N ASP 206.A O no hydrogen 2.956 N/A LEU 215.A N VAL 211.A O no hydrogen 2.930 N/A ILE 216.A N LEU 212.A O no hydrogen 2.851 N/A ARG 217.A N PRO 213.A O no hydrogen 3.156 N/A ARG 217.A NE GLU 214.A OE1 no hydrogen 2.835 N/A ARG 217.A NH2 GLU 214.A OE1 no hydrogen 3.496 N/A ARG 217.A NH2 GLU 214.A OE2 no hydrogen 2.706 N/A ARG 218.A N GLU 214.A O no hydrogen 2.894 N/A ARG 218.A NE GLU 214.A OE2 no hydrogen 3.000 N/A ARG 218.A NH1 ASP 190.A OD2 no hydrogen 2.858 N/A ALA 219.A N LEU 215.A O no hydrogen 2.908 N/A ILE 220.A N ILE 216.A O no hydrogen 2.918 N/A THR 221.A N ARG 217.A O no hydrogen 2.924 N/A THR 221.A OG1 ARG 217.A O no hydrogen 2.725 N/A VAL 222.A N ARG 218.A O no hydrogen 2.959 N/A LYS 223.A N ALA 219.A O no hydrogen 3.067 N/A LYS 223.A NZ ASP 133.A O no hydrogen 2.615 N/A LYS 223.A NZ ASP 133.A OD1 no hydrogen 2.700 N/A LYS 223.A NZ VAL 136.A O no hydrogen 3.040 N/A ALA 224.A N ILE 220.A O no hydrogen 2.761 N/A GLU 225.A N THR 221.A O no hydrogen 2.821 N/A VAL 226.A N VAL 222.A O no hydrogen 2.939 N/A VAL 227.A N LYS 223.A O no hydrogen 2.983 N/A ALA 228.A N ALA 224.A O no hydrogen 3.031 N/A ALA 229.A N GLU 225.A O no hydrogen 3.139 N/A ARG 233.A NH1 GLY 137.A O no hydrogen 3.220 N/A ARG 233.A NH2 GLY 137.A O no hydrogen 3.367 N/A GLU 234.A N GLU 231.A O no hydrogen 3.243 N/A ILE 235.A N LEU 232.A O no hydrogen 3.043 N/A LEU 236.A N ARG 233.A O no hydrogen 3.070 N/A ASN 237.A N GLU 234.A O no hydrogen 2.968 N/A TYR 238.A N ILE 235.A O no hydrogen 3.053 N/A TYR 238.A OH HIS 285.A NE2 no hydrogen 2.812 N/A HIS 240.A N ASN 237.A O no hydrogen 2.810 N/A HIS 240.A ND1 TYR 238.A O no hydrogen 2.951 N/A THR 241.A OG1 ARG 322.A O no hydrogen 3.444 N/A GLY 243.A N GLY 239.A O no hydrogen 3.218 N/A HIS 244.A N HIS 240.A O no hydrogen 2.934 N/A ILE 246.A N LEU 242.A O no hydrogen 2.949 N/A GLU 247.A N GLY 243.A O no hydrogen 3.113 N/A ARG 248.A N HIS 244.A O no hydrogen 3.053 N/A ARG 249.A N ALA 245.A O no hydrogen 2.835 N/A ARG 249.A NH1 TYR 298.A OH no hydrogen 2.878 N/A ARG 249.A NH2 ASP 299.A OD2 no hydrogen 3.412 N/A GLU 250.A N ILE 246.A O no hydrogen 3.052 N/A GLU 250.A N GLU 247.A O no hydrogen 3.176 N/A ARG 251.A N ARG 248.A O no hydrogen 2.575 N/A TYR 252.A N GLU 247.A O no hydrogen 2.737 N/A ARG 253.A N GLU 250.A O no hydrogen 2.956 N/A ARG 255.A NH1 ASP 173.A O no hydrogen 3.165 N/A HIS 256.A ND1 GLU 247.A OE1 no hydrogen 2.689 N/A ALA 259.A N ARG 255.A O no hydrogen 3.188 N/A VAL 260.A N HIS 256.A O no hydrogen 2.949 N/A SER 261.A N GLY 257.A O no hydrogen 2.987 N/A SER 261.A OG PRO 295.A O no hydrogen 2.468 N/A VAL 262.A N ALA 258.A O no hydrogen 3.215 N/A GLY 263.A N ALA 259.A O no hydrogen 2.845 N/A LEU 264.A N VAL 260.A O no hydrogen 2.739 N/A VAL 265.A N SER 261.A O no hydrogen 3.146 N/A PHE 266.A N VAL 262.A O no hydrogen 2.877 N/A ALA 267.A N GLY 263.A O no hydrogen 2.774 N/A ALA 268.A N LEU 264.A O no hydrogen 2.918 N/A GLU 269.A N VAL 265.A O no hydrogen 3.205 N/A LEU 270.A N PHE 266.A O no hydrogen 2.828 N/A ALA 271.A N ALA 267.A O no hydrogen 3.079 N/A ARG 272.A N ALA 268.A O no hydrogen 2.882 N/A ARG 272.A NE GLU 269.A OE1 no hydrogen 2.921 N/A ARG 272.A NH1 ASP 279.A OD1 no hydrogen 3.131 N/A ARG 272.A NH2 GLU 269.A OE2 no hydrogen 2.972 N/A LEU 273.A N GLU 269.A O no hydrogen 2.963 N/A ALA 274.A N LEU 270.A O no hydrogen 2.938 N/A GLY 275.A N ARG 272.A O no hydrogen 3.016 N/A ARG 276.A N ALA 271.A O no hydrogen 2.886 N/A ARG 276.A NE ASP 327.A OD1 no hydrogen 2.886 N/A ARG 276.A NH1 ARG 334.A O no hydrogen 2.781 N/A ARG 276.A NH2 ASP 327.A OD2 no hydrogen 2.979 N/A ARG 276.A NH2 ARG 334.A O no hydrogen 3.248 N/A LEU 277.A N ALA 271.A O no hydrogen 3.208 N/A THR 281.A N ASP 278.A OD2 no hydrogen 3.003 N/A THR 281.A OG1 ASP 278.A OD1 no hydrogen 3.343 N/A THR 281.A OG1 ASP 278.A OD2 no hydrogen 2.516 N/A ALA 282.A N ASP 278.A O no hydrogen 2.940 N/A GLN 283.A N ASP 279.A O no hydrogen 2.828 N/A ARG 284.A N ALA 280.A O no hydrogen 2.962 N/A ARG 284.A NE GLU 198.A OE1 no hydrogen 3.122 N/A ARG 284.A NE GLU 198.A OE2 no hydrogen 2.609 N/A ARG 284.A NH2 ASP 195.A OD1 no hydrogen 2.634 N/A ARG 284.A NH2 GLU 198.A OE1 no hydrogen 2.779 N/A HIS 285.A N ALA 282.A O no hydrogen 3.204 N/A HIS 285.A ND1 THR 281.A O no hydrogen 2.918 N/A HIS 285.A NE2 TYR 238.A OH no hydrogen 2.812 N/A THR 287.A N GLN 283.A O no hydrogen 3.180 N/A THR 287.A OG1 ARG 284.A O no hydrogen 3.256 N/A ILE 288.A N ARG 284.A O no hydrogen 2.983 N/A LEU 289.A N HIS 285.A O no hydrogen 3.036 N/A SER 290.A N ARG 286.A O no hydrogen 2.969 N/A SER 290.A OG ARG 286.A O no hydrogen 2.710 N/A SER 290.A OG THR 287.A O no hydrogen 3.360 N/A SER 291.A N THR 287.A O no hydrogen 3.090 N/A SER 291.A OG THR 287.A O no hydrogen 3.327 N/A SER 291.A OG ILE 288.A O no hydrogen 2.812 N/A LEU 292.A N ILE 288.A O no hydrogen 3.230 N/A LEU 292.A N LEU 289.A O no hydrogen 3.181 N/A GLY 293.A N SER 290.A O no hydrogen 2.968 N/A LEU 294.A N LEU 289.A O no hydrogen 2.975 N/A TYR 298.A OH GLU 250.A OE2 no hydrogen 2.439 N/A ASP 301.A N ASP 299.A OD1 no hydrogen 3.006 N/A ALA 302.A N ASP 299.A O no hydrogen 3.126 N/A GLN 305.A N GLN 305.A OE1 no hydrogen 2.992 N/A LEU 306.A N ALA 302.A O no hydrogen 2.917 N/A LEU 307.A N LEU 303.A O no hydrogen 2.715 N/A GLU 308.A N PRO 304.A O no hydrogen 3.055 N/A ILE 309.A N GLN 305.A O no hydrogen 3.052 N/A MET 310.A N LEU 306.A O no hydrogen 2.846 N/A ALA 311.A N LEU 307.A O no hydrogen 2.849 N/A GLY 312.A N ILE 309.A O no hydrogen 2.998 N/A ASP 313.A N MET 310.A O no hydrogen 3.172 N/A LYS 314.A NZ ASN 149.A O no hydrogen 2.763 N/A LYS 315.A N ASP 313.A OD2 no hydrogen 2.892 N/A THR 316.A N ASP 313.A O no hydrogen 3.046 N/A THR 316.A OG1 MET 310.A O no hydrogen 2.770 N/A VAL 320.A N ARG 317.A O no hydrogen 2.866 N/A ARG 322.A NE GLU 234.A OE2 no hydrogen 2.843 N/A ARG 322.A NH2 GLU 234.A OE1 no hydrogen 3.216 N/A PHE 323.A N MET 335.A O no hydrogen 2.829 N/A VAL 325.A N GLY 333.A O no hydrogen 3.096 N/A ASP 327.A N LYS 331.A O no hydrogen 2.786 N/A ALA 330.A N PHE 187.A O no hydrogen 2.716 N/A LYS 331.A N GLY 328.A O no hydrogen 3.015 N/A LYS 331.A NZ ASP 327.A O no hydrogen 2.642 N/A GLY 333.A N VAL 325.A O no hydrogen 2.584 N/A ARG 334.A NE GLU 234.A OE1 no hydrogen 3.105 N/A MET 335.A N PHE 323.A O no hydrogen 2.883 N/A GLY 337.A N LEU 321.A O no hydrogen 2.642 N/A LEU 342.A N ASP 339.A OD2 no hydrogen 3.111 N/A LEU 343.A N ASP 339.A O no hydrogen 3.278 N/A VAL 344.A N PRO 340.A O no hydrogen 3.030 N/A THR 345.A N GLY 341.A O no hydrogen 2.930 N/A THR 345.A OG1 GLY 341.A O no hydrogen 3.016 N/A ALA 346.A N LEU 342.A O no hydrogen 2.879 N/A TYR 347.A N LEU 343.A O no hydrogen 2.807 N/A TYR 347.A OH ASP 299.A O no hydrogen 2.640 N/A ALA 348.A N VAL 344.A O no hydrogen 3.084 N/A GLY 349.A N THR 345.A O no hydrogen 3.118 N/A VAL 350.A N ALA 346.A O no hydrogen 3.182 N/A VAL 350.A N TYR 347.A O no hydrogen 3.165 N/A CYS 351.A N TYR 347.A O no hydrogen 2.873 N/A CYS 351.A SG TYR 298.A O no hydrogen 3.047 N/A ALA 352.A N ALA 348.A O no hydrogen 2.991 N/A