Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2bu8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A N SER 2.A O no hydrogen 3.037 N/A TYR 6.A N SER 2.A O no hydrogen 3.067 N/A ILE 7.A N ALA 3.A O no hydrogen 2.889 N/A GLU 8.A N PRO 4.A O no hydrogen 3.159 N/A HIS 9.A N LYS 5.A O no hydrogen 3.072 N/A PHE 10.A N TYR 6.A O no hydrogen 3.014 N/A SER 11.A N ILE 7.A O no hydrogen 2.950 N/A LYS 12.A N HIS 9.A O no hydrogen 2.780 N/A LYS 12.A NZ GLU 8.A OE2 no hydrogen 2.791 N/A PHE 13.A N PHE 10.A O no hydrogen 3.187 N/A SER 16.A N GLU 43.A OE2 no hydrogen 2.816 N/A LEU 18.A N GLU 345.A OE1 no hydrogen 2.793 N/A SER 19.A N GLN 22.A OE1 no hydrogen 2.766 N/A SER 19.A OG GLN 22.A OE1 no hydrogen 3.275 N/A MET 20.A N SER 343.A O no hydrogen 2.833 N/A GLN 22.A N SER 19.A OG no hydrogen 3.211 N/A PHE 23.A N SER 19.A O no hydrogen 3.068 N/A LEU 24.A N MET 20.A O no hydrogen 3.080 N/A ASP 25.A N LYS 21.A O no hydrogen 2.832 N/A PHE 26.A N GLN 22.A O no hydrogen 2.725 N/A SER 28.A N LEU 24.A O no hydrogen 2.966 N/A CYS 32.A SG ALA 31.A O no hydrogen 3.333 N/A LYS 34.A NZ GLU 91.A OE2 no hydrogen 3.233 N/A THR 35.A N CYS 32.A O no hydrogen 2.443 N/A THR 35.A OG1 ASN 30.A OD1 no hydrogen 2.981 N/A THR 35.A OG1 CYS 32.A O no hydrogen 3.463 N/A SER 36.A N CYS 32.A O no hydrogen 3.433 N/A SER 36.A OG HIS 159.A ND1 no hydrogen 2.541 N/A PHE 37.A N GLU 33.A O no hydrogen 2.396 N/A THR 38.A N LYS 34.A O no hydrogen 2.889 N/A THR 38.A OG1 LYS 34.A O no hydrogen 2.782 N/A PHE 39.A N THR 35.A O no hydrogen 3.209 N/A LEU 40.A N SER 36.A O no hydrogen 2.733 N/A ARG 41.A N PHE 37.A O no hydrogen 3.069 N/A GLN 42.A N PHE 39.A O no hydrogen 3.231 N/A GLU 43.A N PHE 39.A O no hydrogen 2.933 N/A LEU 44.A N LEU 40.A O no hydrogen 2.994 N/A VAL 46.A N GLN 42.A O no hydrogen 3.200 N/A ARG 47.A N GLU 43.A O no hydrogen 2.929 N/A ARG 47.A NE GLU 43.A OE2 no hydrogen 3.149 N/A ARG 47.A NH1 GLU 345.A OE2 no hydrogen 3.262 N/A ARG 47.A NH2 SER 16.A O no hydrogen 3.068 N/A ARG 47.A NH2 GLU 345.A OE1 no hydrogen 3.098 N/A LEU 48.A N LEU 44.A O no hydrogen 2.812 N/A ALA 49.A N PRO 45.A O no hydrogen 3.061 N/A ASN 50.A N VAL 46.A O no hydrogen 3.103 N/A ILE 51.A N ARG 47.A O no hydrogen 3.252 N/A MET 52.A N LEU 48.A O no hydrogen 2.939 N/A LYS 53.A N ALA 49.A O no hydrogen 2.766 N/A LYS 53.A NZ TYR 350.A OH no hydrogen 3.045 N/A GLU 54.A N ASN 50.A O no hydrogen 3.323 N/A ILE 55.A N ILE 51.A O no hydrogen 3.076 N/A ASN 56.A N MET 52.A O no hydrogen 3.165 N/A LEU 57.A N GLU 54.A O no hydrogen 3.189 N/A LEU 58.A N ILE 55.A O no hydrogen 2.824 N/A ARG 61.A NH2 TYR 124.A OH no hydrogen 3.506 N/A VAL 62.A N PRO 59.A O no hydrogen 2.970 N/A LEU 63.A N PRO 59.A O no hydrogen 2.798 N/A SER 64.A N ASP 60.A O no hydrogen 2.795 N/A SER 64.A OG ASP 60.A O no hydrogen 2.683 N/A THR 65.A N VAL 62.A O no hydrogen 3.155 N/A THR 65.A OG1 VAL 62.A O no hydrogen 2.928 N/A VAL 68.A N THR 65.A OG1 no hydrogen 3.267 N/A GLN 69.A N THR 65.A O no hydrogen 2.940 N/A LEU 70.A N PRO 66.A O no hydrogen 2.832 N/A VAL 71.A N SER 67.A O no hydrogen 3.005 N/A GLN 72.A N VAL 68.A O no hydrogen 2.809 N/A SER 73.A N GLN 69.A O no hydrogen 3.152 N/A SER 73.A N LEU 70.A O no hydrogen 3.028 N/A SER 73.A OG LEU 70.A O no hydrogen 2.509 N/A TRP 74.A N LEU 70.A O no hydrogen 3.337 N/A TRP 74.A N VAL 71.A O no hydrogen 3.000 N/A TYR 75.A N VAL 71.A O no hydrogen 3.267 N/A VAL 76.A N GLN 72.A O no hydrogen 3.321 N/A GLN 77.A N SER 73.A O no hydrogen 3.049 N/A SER 78.A N TRP 74.A O no hydrogen 2.838 N/A SER 78.A OG TRP 74.A O no hydrogen 3.148 N/A SER 78.A OG HIS 110.A NE2 no hydrogen 2.812 N/A LEU 79.A N TYR 75.A O no hydrogen 3.062 N/A LEU 80.A N VAL 76.A O no hydrogen 3.255 N/A ASP 81.A N GLN 77.A O no hydrogen 2.822 N/A ILE 82.A N SER 78.A O no hydrogen 3.036 N/A MET 83.A N LEU 79.A O no hydrogen 2.993 N/A PHE 85.A N ILE 82.A O no hydrogen 3.170 N/A LEU 86.A N MET 83.A O no hydrogen 2.675 N/A LYS 88.A N PHE 85.A O no hydrogen 3.368 N/A LYS 88.A NZ ASP 87.A OD2 no hydrogen 3.258 N/A THR 95.A N ASP 92.A O no hydrogen 2.686 N/A THR 95.A OG1 ASP 89.A O no hydrogen 3.328 N/A THR 95.A OG1 ASP 92.A OD2 no hydrogen 3.113 N/A SER 97.A OG ARG 94.A O no hydrogen 3.178 N/A PHE 99.A N LEU 96.A O no hydrogen 3.278 N/A THR 100.A N LEU 96.A O no hydrogen 3.175 N/A THR 100.A OG1 LEU 96.A O no hydrogen 3.076 N/A ASP 101.A N SER 97.A O no hydrogen 3.426 N/A ALA 102.A N GLN 98.A O no hydrogen 2.961 N/A LEU 103.A N PHE 99.A O no hydrogen 2.854 N/A LEU 103.A N THR 100.A O no hydrogen 3.188 N/A VAL 104.A N THR 100.A O no hydrogen 3.145 N/A THR 105.A N ASP 101.A O no hydrogen 3.256 N/A THR 105.A OG1 ASP 101.A O no hydrogen 2.988 N/A ILE 106.A N ALA 102.A O no hydrogen 3.230 N/A ILE 106.A N LEU 103.A O no hydrogen 2.902 N/A ARG 107.A N LEU 103.A O no hydrogen 2.886 N/A ARG 107.A NE ASN 108.A OD1 no hydrogen 3.642 N/A ARG 107.A NH1 ASN 157.A OD1 no hydrogen 3.020 N/A ASN 108.A N VAL 104.A O no hydrogen 3.350 N/A ARG 109.A N THR 105.A O no hydrogen 3.319 N/A ARG 109.A NH1 SER 78.A OG no hydrogen 3.026 N/A ARG 109.A NH2 ASP 81.A OD2 no hydrogen 2.926 N/A HIS 110.A N ARG 107.A O no hydrogen 3.330 N/A HIS 110.A NE2 SER 78.A OG no hydrogen 2.812 N/A ASN 111.A N ASN 108.A O no hydrogen 3.242 N/A ASN 111.A ND2 ASN 111.A O no hydrogen 3.223 N/A VAL 113.A N HIS 110.A O no hydrogen 3.270 N/A THR 116.A N ASP 112.A O no hydrogen 3.201 N/A THR 116.A OG1 ASP 112.A O no hydrogen 2.836 N/A MET 117.A N VAL 113.A O no hydrogen 2.763 N/A ALA 118.A N VAL 114.A O no hydrogen 2.804 N/A GLN 119.A N PRO 115.A O no hydrogen 3.048 N/A GLY 120.A N MET 117.A O no hydrogen 2.924 N/A VAL 121.A N MET 117.A O no hydrogen 3.139 N/A LEU 122.A N ALA 118.A O no hydrogen 3.061 N/A GLU 123.A N GLN 119.A O no hydrogen 3.087 N/A TYR 124.A N GLY 120.A O no hydrogen 3.114 N/A LYS 125.A N VAL 121.A O no hydrogen 3.045 N/A LYS 125.A NZ MET 294.A O no hydrogen 3.320 N/A LYS 125.A NZ THR 297.A O no hydrogen 2.637 N/A ASP 126.A N LEU 122.A O no hydrogen 3.232 N/A THR 127.A N GLU 123.A O no hydrogen 2.678 N/A THR 127.A OG1 GLU 123.A O no hydrogen 2.738 N/A TYR 128.A N TYR 124.A O no hydrogen 2.748 N/A GLY 129.A N TYR 124.A O no hydrogen 3.306 N/A ASP 131.A N SER 134.A OG no hydrogen 3.350 N/A SER 134.A N ASP 131.A OD2 no hydrogen 3.204 N/A SER 134.A OG ASP 131.A O no hydrogen 2.955 N/A SER 134.A OG ASP 131.A OD1 no hydrogen 2.832 N/A ASN 135.A N ASP 131.A O no hydrogen 2.961 N/A GLN 136.A N PRO 132.A O no hydrogen 2.955 N/A ASN 137.A N VAL 133.A O no hydrogen 3.029 N/A ILE 138.A N SER 134.A O no hydrogen 3.032 N/A GLN 139.A N ASN 135.A O no hydrogen 2.866 N/A GLN 139.A NE2 ASP 143.A OD2 no hydrogen 3.455 N/A GLN 139.A NE2 PHE 291.A O no hydrogen 3.089 N/A TYR 140.A N GLN 136.A O no hydrogen 2.930 N/A PHE 141.A N ASN 137.A O no hydrogen 2.930 N/A LEU 142.A N ILE 138.A O no hydrogen 2.774 N/A ASP 143.A N GLN 139.A O no hydrogen 3.002 N/A ARG 144.A N TYR 140.A O no hydrogen 3.392 N/A ARG 144.A NE GLU 54.A OE1 no hydrogen 3.489 N/A ARG 144.A NE GLU 54.A OE2 no hydrogen 2.554 N/A ARG 144.A NH2 GLU 54.A OE1 no hydrogen 3.258 N/A ARG 144.A NH2 VAL 349.A O no hydrogen 2.924 N/A PHE 145.A N PHE 141.A O no hydrogen 2.840 N/A TYR 146.A N LEU 142.A O no hydrogen 2.795 N/A LEU 147.A N ASP 143.A O no hydrogen 3.084 N/A SER 148.A N ARG 144.A O no hydrogen 2.997 N/A ARG 149.A N PHE 145.A O no hydrogen 3.045 N/A ARG 149.A NH2 HIS 110.A O no hydrogen 3.082 N/A ILE 150.A N TYR 146.A O no hydrogen 2.932 N/A SER 151.A N LEU 147.A O no hydrogen 2.965 N/A SER 151.A OG SER 148.A O no hydrogen 2.752 N/A ILE 152.A N SER 148.A O no hydrogen 3.035 N/A ARG 153.A N ARG 149.A O no hydrogen 2.954 N/A MET 154.A N ILE 150.A O no hydrogen 3.031 N/A LEU 155.A N SER 151.A O no hydrogen 3.195 N/A ILE 156.A N ILE 152.A O no hydrogen 3.046 N/A ASN 157.A N ARG 153.A O no hydrogen 2.878 N/A GLN 158.A N MET 154.A O no hydrogen 2.978 N/A GLN 158.A NE2 ILE 175.A O no hydrogen 2.934 N/A HIS 159.A N LEU 155.A O no hydrogen 3.103 N/A HIS 159.A ND1 SER 36.A OG no hydrogen 2.541 N/A THR 160.A N ILE 156.A O no hydrogen 2.976 N/A THR 160.A OG1 ILE 156.A O no hydrogen 3.028 N/A THR 160.A OG1 ASN 157.A O no hydrogen 3.270 N/A LEU 161.A N ASN 157.A O no hydrogen 2.899 N/A ILE 162.A N GLN 158.A O no hydrogen 3.134 N/A PHE 163.A N HIS 159.A O no hydrogen 2.982 N/A GLY 165.A N ASP 164.A OD2 no hydrogen 2.698 N/A ILE 175.A N ILE 178.A O no hydrogen 2.925 N/A SER 177.A N GLN 158.A OE1 no hydrogen 2.691 N/A SER 177.A OG GLN 158.A OE1 no hydrogen 3.083 N/A ILE 178.A N ILE 175.A O no hydrogen 3.354 N/A ASP 179.A N TYR 227.A O no hydrogen 2.819 N/A ASN 181.A N ASP 179.A OD1 no hydrogen 2.798 N/A CYS 182.A N MET 225.A O no hydrogen 2.834 N/A SER 185.A OG GLU 213.A OE2 no hydrogen 2.546 N/A GLU 186.A N ASN 183.A O no hydrogen 2.976 N/A VAL 187.A N ASN 183.A O no hydrogen 3.358 N/A VAL 188.A N VAL 184.A O no hydrogen 3.005 N/A LYS 189.A N SER 185.A O no hydrogen 2.907 N/A ASP 190.A N GLU 186.A O no hydrogen 2.936 N/A ALA 191.A N VAL 187.A O no hydrogen 3.031 N/A TYR 192.A N VAL 188.A O no hydrogen 2.869 N/A TYR 192.A OH PRO 207.A O no hydrogen 2.756 N/A ASP 193.A N LYS 189.A O no hydrogen 2.983 N/A MET 194.A N ASP 190.A O no hydrogen 3.057 N/A ALA 195.A N ALA 191.A O no hydrogen 3.036 N/A LYS 196.A N TYR 192.A O no hydrogen 2.800 N/A LEU 197.A N ASP 193.A O no hydrogen 3.078 N/A LEU 198.A N MET 194.A O no hydrogen 3.334 N/A CYS 199.A N ALA 195.A O no hydrogen 2.763 N/A CYS 199.A SG ALA 205.A O no hydrogen 3.231 N/A ASP 200.A N LYS 196.A O no hydrogen 2.766 N/A LYS 201.A N LEU 197.A O no hydrogen 3.094 N/A TYR 202.A N LEU 198.A O no hydrogen 3.105 N/A TYR 203.A N CYS 199.A O no hydrogen 2.781 N/A TYR 203.A OH GLU 249.A OE1 no hydrogen 2.872 N/A SER 206.A OG ASP 200.A OD1 no hydrogen 2.998 N/A GLU 210.A N ILE 260.A O no hydrogen 3.269 N/A GLN 212.A N VAL 262.A O no hydrogen 2.989 N/A ILE 214.A N VAL 264.A O no hydrogen 2.849 N/A ASN 215.A ND2 GLN 221.A O no hydrogen 2.971 N/A ALA 216.A N LEU 266.A O no hydrogen 3.347 N/A ASN 218.A N ASN 215.A OD1 no hydrogen 3.143 N/A GLN 221.A N ASN 218.A O no hydrogen 2.910 N/A ILE 223.A N GLU 213.A OE1 no hydrogen 3.136 N/A HIS 224.A ND1 ASN 181.A O no hydrogen 3.169 N/A MET 225.A N CYS 182.A O no hydrogen 3.037 N/A TYR 227.A N ASP 179.A O no hydrogen 3.224 N/A HIS 231.A N VAL 228.A O no hydrogen 2.970 N/A LEU 232.A N VAL 228.A O no hydrogen 3.392 N/A TYR 233.A N PRO 229.A O no hydrogen 2.955 N/A HIS 234.A N SER 230.A O no hydrogen 3.166 N/A MET 235.A N HIS 231.A O no hydrogen 3.297 N/A LEU 236.A N LEU 232.A O no hydrogen 3.058 N/A PHE 237.A N TYR 233.A O no hydrogen 2.831 N/A GLU 238.A N HIS 234.A O no hydrogen 3.023 N/A LEU 239.A N MET 235.A O no hydrogen 3.018 N/A PHE 240.A N LEU 236.A O no hydrogen 2.761 N/A LYS 241.A N PHE 237.A O no hydrogen 3.011 N/A LYS 241.A NZ GLU 238.A OE1 no hydrogen 3.508 N/A LYS 241.A NZ GLU 238.A OE2 no hydrogen 3.166 N/A ASN 242.A N GLU 238.A O no hydrogen 3.329 N/A ALA 243.A N LEU 239.A O no hydrogen 3.014 N/A MET 244.A N PHE 240.A O no hydrogen 2.898 N/A ARG 245.A N LYS 241.A O no hydrogen 3.120 N/A ALA 246.A N ASN 242.A O no hydrogen 3.010 N/A THR 247.A N ALA 243.A O no hydrogen 2.961 N/A THR 247.A OG1 ALA 243.A O no hydrogen 2.819 N/A VAL 248.A N MET 244.A O no hydrogen 2.962 N/A GLU 249.A N ARG 245.A O no hydrogen 2.864 N/A SER 250.A N ALA 246.A O no hydrogen 2.942 N/A SER 250.A OG ALA 246.A O no hydrogen 2.863 N/A SER 250.A OG THR 247.A O no hydrogen 3.305 N/A SER 250.A OG HIS 251.A ND1 no hydrogen 3.007 N/A HIS 251.A N VAL 248.A O no hydrogen 3.205 N/A HIS 251.A ND1 SER 250.A OG no hydrogen 3.007 N/A ILE 260.A N ASP 208.A O no hydrogen 2.939 N/A LYS 261.A N SER 276.A O no hydrogen 2.985 N/A VAL 262.A N GLU 210.A O no hydrogen 2.962 N/A MET 263.A N LYS 274.A O no hydrogen 2.837 N/A VAL 264.A N GLN 212.A O no hydrogen 2.821 N/A ALA 265.A N SER 272.A O no hydrogen 2.796 N/A LEU 266.A N ILE 214.A O no hydrogen 3.037 N/A GLY 267.A N ASP 270.A O no hydrogen 2.826 N/A LEU 271.A N LEU 336.A O no hydrogen 2.970 N/A SER 272.A N ALA 265.A O no hydrogen 2.785 N/A ILE 273.A N ILE 334.A O no hydrogen 3.052 N/A LYS 274.A N MET 263.A O no hydrogen 2.868 N/A LYS 274.A NZ ASP 331.A OD2 no hydrogen 2.978 N/A MET 275.A N ALA 332.A O no hydrogen 2.854 N/A SER 276.A N LYS 261.A O no hydrogen 2.736 N/A SER 276.A OG ASP 331.A OD1 no hydrogen 3.335 N/A ASP 277.A N THR 330.A O no hydrogen 3.033 N/A GLY 279.A N ASP 277.A OD1 no hydrogen 2.865 N/A GLY 280.A N PHE 328.A O no hydrogen 3.272 N/A VAL 282.A N SER 324.A OG no hydrogen 2.651 N/A LYS 286.A N PRO 283.A O no hydrogen 2.857 N/A ILE 287.A N LEU 284.A O no hydrogen 3.258 N/A LEU 290.A N ILE 287.A O no hydrogen 3.007 N/A SER 292.A N ARG 289.A O no hydrogen 3.136 N/A SER 292.A OG ASN 135.A OD1 no hydrogen 2.810 N/A TYR 293.A N GLN 139.A OE1 no hydrogen 3.001 N/A TYR 293.A OH ASP 143.A OD1 no hydrogen 2.915 N/A TYR 295.A N SER 292.A OG no hydrogen 3.142 N/A SER 296.A N SER 292.A O no hydrogen 3.225 N/A SER 296.A OG SER 292.A O no hydrogen 2.338 N/A SER 296.A OG TYR 293.A O no hydrogen 3.442 N/A SER 296.A OG GLY 303.A O no hydrogen 2.571 N/A THR 297.A N MET 294.A O no hydrogen 3.295 N/A THR 297.A OG1 TYR 293.A O no hydrogen 2.472 N/A THR 297.A OG1 TYR 304.A OH no hydrogen 2.930 N/A ILE 308.A N TYR 304.A O no hydrogen 3.139 N/A SER 309.A N GLY 305.A O no hydrogen 3.217 N/A SER 309.A OG GLY 305.A O no hydrogen 2.866 N/A ARG 310.A N LEU 306.A O no hydrogen 2.979 N/A LEU 311.A N PRO 307.A O no hydrogen 3.242 N/A TYR 312.A N ILE 308.A O no hydrogen 3.112 N/A ALA 313.A N SER 309.A O no hydrogen 3.152 N/A LYS 314.A N ARG 310.A O no hydrogen 2.853 N/A TYR 315.A N LEU 311.A O no hydrogen 2.861 N/A TYR 315.A OH GLU 345.A OE2 no hydrogen 2.556 N/A GLN 317.A N LYS 314.A O no hydrogen 2.921 N/A GLN 317.A NE2 VAL 344.A O no hydrogen 2.899 N/A GLY 318.A N ALA 313.A O no hydrogen 2.878 N/A ASP 319.A N TYR 335.A O no hydrogen 2.878 N/A LEU 320.A N ASP 319.A OD1 no hydrogen 2.679 N/A GLN 321.A N VAL 333.A O no hydrogen 2.917 N/A GLN 321.A NE2 ASP 319.A OD2 no hydrogen 3.156 N/A PHE 323.A N ASP 331.A O no hydrogen 3.014 N/A SER 324.A OG VAL 282.A O no hydrogen 3.479 N/A SER 324.A OG GLY 329.A O no hydrogen 3.114 N/A SER 324.A OG THR 330.A OG1 no hydrogen 2.934 N/A MET 325.A N GLY 329.A O no hydrogen 2.793 N/A GLY 327.A N GLY 280.A O no hydrogen 2.679 N/A PHE 328.A N MET 325.A O no hydrogen 2.868 N/A GLY 329.A N MET 325.A O no hydrogen 3.250 N/A THR 330.A N ASP 277.A O no hydrogen 3.241 N/A THR 330.A N ASP 277.A OD1 no hydrogen 3.200 N/A THR 330.A OG1 SER 324.A OG no hydrogen 2.934 N/A ASP 331.A N PHE 323.A O no hydrogen 2.856 N/A ALA 332.A N MET 275.A O no hydrogen 3.035 N/A VAL 333.A N GLN 321.A O no hydrogen 2.887 N/A ILE 334.A N ILE 273.A O no hydrogen 2.855 N/A TYR 335.A N ASP 319.A O no hydrogen 2.792 N/A LEU 336.A N LEU 271.A O no hydrogen 3.018 N/A ALA 338.A N GLU 269.A O no hydrogen 2.739 N/A ASP 342.A N LEU 339.A O no hydrogen 2.911 N/A SER 343.A N SER 340.A O no hydrogen 3.333 N/A SER 343.A OG LEU 339.A O no hydrogen 3.228 N/A GLU 345.A N LEU 18.A O no hydrogen 3.125 N/A ARG 346.A N TYR 315.A O no hydrogen 2.823 N/A TRP 355.A N ASN 351.A O no hydrogen 3.201 N/A HIS 357.A ND1 SER 353.A O no hydrogen 2.664 N/A TYR 358.A N TRP 355.A O no hydrogen 3.323 N/A TYR 358.A OH GLU 54.A OE2 no hydrogen 2.677 N/A