Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2bu6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A N SER 2.A O no hydrogen 2.668 N/A TYR 6.A N SER 2.A O no hydrogen 3.083 N/A ILE 7.A N ALA 3.A O no hydrogen 3.086 N/A GLU 8.A N PRO 4.A O no hydrogen 3.195 N/A HIS 9.A N LYS 5.A O no hydrogen 2.923 N/A PHE 10.A N TYR 6.A O no hydrogen 2.925 N/A SER 11.A N ILE 7.A O no hydrogen 2.856 N/A LYS 12.A N HIS 9.A O no hydrogen 2.924 N/A PHE 13.A N PHE 10.A O no hydrogen 3.116 N/A SER 16.A N GLU 39.A OE2 no hydrogen 2.869 N/A LEU 18.A N GLU 330.A OE1 no hydrogen 2.967 N/A SER 19.A N GLN 22.A OE1 no hydrogen 2.795 N/A MET 20.A N SER 328.A O no hydrogen 2.649 N/A LYS 21.A N SER 19.A OG no hydrogen 3.029 N/A GLN 22.A N SER 19.A OG no hydrogen 3.057 N/A PHE 23.A N SER 19.A O no hydrogen 3.123 N/A LEU 24.A N MET 20.A O no hydrogen 3.214 N/A ASP 25.A N LYS 21.A O no hydrogen 2.913 N/A PHE 26.A N LEU 24.A O no hydrogen 2.808 N/A SER 32.A OG HIS 155.A ND1 no hydrogen 2.618 N/A PHE 33.A N GLU 29.A O no hydrogen 2.573 N/A THR 34.A N LYS 30.A O no hydrogen 2.950 N/A THR 34.A OG1 LYS 30.A O no hydrogen 2.944 N/A THR 34.A OG1 THR 31.A O no hydrogen 3.030 N/A PHE 35.A N THR 31.A O no hydrogen 3.288 N/A LEU 36.A N SER 32.A O no hydrogen 2.650 N/A ARG 37.A N PHE 33.A O no hydrogen 2.963 N/A GLN 38.A N PHE 35.A O no hydrogen 3.108 N/A GLU 39.A N PHE 35.A O no hydrogen 2.980 N/A LEU 40.A N LEU 36.A O no hydrogen 3.032 N/A VAL 42.A N GLN 38.A O no hydrogen 3.118 N/A ARG 43.A N GLU 39.A O no hydrogen 2.842 N/A ARG 43.A NE GLU 39.A OE2 no hydrogen 3.098 N/A ARG 43.A NH1 GLU 330.A OE2 no hydrogen 3.062 N/A ARG 43.A NH2 SER 16.A O no hydrogen 3.056 N/A ARG 43.A NH2 GLU 330.A OE1 no hydrogen 2.875 N/A LEU 44.A N LEU 40.A O no hydrogen 2.804 N/A ALA 45.A N PRO 41.A O no hydrogen 2.873 N/A ASN 46.A N VAL 42.A O no hydrogen 2.990 N/A ILE 47.A N ARG 43.A O no hydrogen 3.189 N/A MET 48.A N LEU 44.A O no hydrogen 2.826 N/A LYS 49.A N ALA 45.A O no hydrogen 2.638 N/A LYS 49.A NZ TYR 335.A OH no hydrogen 3.127 N/A GLU 50.A N ASN 46.A O no hydrogen 3.186 N/A ILE 51.A N ILE 47.A O no hydrogen 3.153 N/A ASN 52.A N MET 48.A O no hydrogen 3.081 N/A LEU 53.A N GLU 50.A O no hydrogen 3.156 N/A LEU 54.A N ILE 51.A O no hydrogen 2.985 N/A VAL 58.A N PRO 55.A O no hydrogen 2.931 N/A LEU 59.A N PRO 55.A O no hydrogen 2.950 N/A SER 60.A N ASP 56.A O no hydrogen 2.855 N/A SER 60.A OG ASP 56.A O no hydrogen 3.021 N/A SER 60.A OG ASP 56.A OD1 no hydrogen 3.276 N/A SER 60.A OG ASP 56.A OD2 no hydrogen 3.338 N/A THR 61.A OG1 VAL 58.A O no hydrogen 2.736 N/A THR 61.A OG1 SER 63.A OG no hydrogen 3.150 N/A SER 63.A OG THR 61.A OG1 no hydrogen 3.150 N/A VAL 64.A N SER 63.A OG no hydrogen 2.560 N/A GLN 65.A N THR 61.A O no hydrogen 3.082 N/A LEU 66.A N PRO 62.A O no hydrogen 2.711 N/A VAL 67.A N SER 63.A O no hydrogen 3.033 N/A GLN 68.A N VAL 64.A O no hydrogen 2.699 N/A SER 69.A N GLN 65.A O no hydrogen 2.798 N/A SER 69.A N LEU 66.A O no hydrogen 3.269 N/A SER 69.A OG LEU 66.A O no hydrogen 2.697 N/A TRP 70.A N LEU 66.A O no hydrogen 3.218 N/A TRP 70.A N VAL 67.A O no hydrogen 2.738 N/A TYR 71.A N VAL 67.A O no hydrogen 2.976 N/A VAL 72.A N GLN 68.A O no hydrogen 3.261 N/A GLN 73.A N SER 69.A O no hydrogen 3.093 N/A SER 74.A N TRP 70.A O no hydrogen 2.830 N/A SER 74.A OG TRP 70.A O no hydrogen 3.417 N/A SER 74.A OG HIS 106.A NE2 no hydrogen 2.692 N/A LEU 75.A N TYR 71.A O no hydrogen 2.709 N/A LEU 76.A N VAL 72.A O no hydrogen 3.055 N/A ASP 77.A N GLN 73.A O no hydrogen 2.752 N/A ILE 78.A N SER 74.A O no hydrogen 3.245 N/A ILE 78.A N LEU 75.A O no hydrogen 3.229 N/A MET 79.A N LEU 75.A O no hydrogen 3.163 N/A PHE 81.A N ILE 78.A O no hydrogen 3.176 N/A LEU 82.A N MET 79.A O no hydrogen 2.582 N/A LYS 84.A N PHE 81.A O no hydrogen 3.177 N/A LYS 84.A NZ GLU 80.A O no hydrogen 3.116 N/A LYS 84.A NZ ASP 83.A OD1 no hydrogen 3.404 N/A ASP 88.A N PRO 86.A O no hydrogen 2.314 N/A HIS 89.A ND1 GLU 87.A O no hydrogen 3.100 N/A THR 91.A N ASP 88.A O no hydrogen 2.619 N/A THR 91.A OG1 ASP 85.A O no hydrogen 3.236 N/A THR 91.A OG1 ASP 88.A OD2 no hydrogen 2.745 N/A SER 93.A OG ARG 90.A O no hydrogen 3.190 N/A GLN 94.A N ARG 90.A O no hydrogen 3.264 N/A THR 96.A N LEU 92.A O no hydrogen 3.294 N/A THR 96.A OG1 LEU 92.A O no hydrogen 3.541 N/A ASP 97.A N SER 93.A O no hydrogen 3.201 N/A ALA 98.A N GLN 94.A O no hydrogen 3.121 N/A LEU 99.A N PHE 95.A O no hydrogen 2.794 N/A VAL 100.A N THR 96.A O no hydrogen 3.041 N/A THR 101.A N ASP 97.A O no hydrogen 3.060 N/A THR 101.A OG1 ASP 97.A O no hydrogen 2.930 N/A ILE 102.A N ALA 98.A O no hydrogen 3.177 N/A ARG 103.A N LEU 99.A O no hydrogen 2.806 N/A ARG 103.A NH1 ASN 153.A OD1 no hydrogen 3.028 N/A ASN 104.A N VAL 100.A O no hydrogen 3.465 N/A ARG 105.A N THR 101.A O no hydrogen 3.026 N/A ARG 105.A NH1 SER 74.A OG no hydrogen 3.244 N/A ARG 105.A NH2 ASP 77.A OD2 no hydrogen 2.813 N/A HIS 106.A N ILE 102.A O no hydrogen 3.229 N/A HIS 106.A N ARG 103.A O no hydrogen 3.153 N/A HIS 106.A NE2 SER 74.A OG no hydrogen 2.692 N/A ASN 107.A N ASN 104.A O no hydrogen 3.191 N/A ASN 107.A ND2 ASN 104.A O no hydrogen 3.571 N/A ASN 107.A ND2 ASN 104.A OD1 no hydrogen 3.220 N/A VAL 109.A N HIS 106.A O no hydrogen 3.177 N/A THR 112.A N ASP 108.A O no hydrogen 3.102 N/A THR 112.A OG1 ASP 108.A O no hydrogen 2.866 N/A MET 113.A N VAL 109.A O no hydrogen 2.902 N/A ALA 114.A N VAL 110.A O no hydrogen 2.849 N/A GLN 115.A N PRO 111.A O no hydrogen 2.924 N/A VAL 117.A N MET 113.A O no hydrogen 3.157 N/A LEU 118.A N ALA 114.A O no hydrogen 3.082 N/A GLU 119.A N GLN 115.A O no hydrogen 2.922 N/A TYR 120.A N GLY 116.A O no hydrogen 2.907 N/A TYR 120.A OH SER 130.A OG no hydrogen 2.801 N/A LYS 121.A N VAL 117.A O no hydrogen 2.949 N/A ASP 122.A N LEU 118.A O no hydrogen 3.204 N/A THR 123.A N GLU 119.A O no hydrogen 2.816 N/A THR 123.A OG1 GLU 119.A O no hydrogen 2.790 N/A TYR 124.A N TYR 120.A O no hydrogen 2.730 N/A GLY 125.A N LYS 121.A O no hydrogen 2.918 N/A SER 130.A OG TYR 120.A OH no hydrogen 2.801 N/A SER 130.A OG ASP 127.A OD1 no hydrogen 2.871 N/A SER 130.A OG ASP 127.A OD2 no hydrogen 3.127 N/A ASN 131.A N ASP 127.A O no hydrogen 2.877 N/A GLN 132.A N PRO 128.A O no hydrogen 2.724 N/A ASN 133.A N VAL 129.A O no hydrogen 3.024 N/A ILE 134.A N SER 130.A O no hydrogen 2.986 N/A GLN 135.A N ASN 131.A O no hydrogen 2.755 N/A GLN 135.A NE2 PHE 279.A O no hydrogen 3.094 N/A TYR 136.A N GLN 132.A O no hydrogen 2.782 N/A PHE 137.A N ASN 133.A O no hydrogen 2.833 N/A LEU 138.A N ILE 134.A O no hydrogen 2.657 N/A ASP 139.A N GLN 135.A O no hydrogen 2.944 N/A ARG 140.A N TYR 136.A O no hydrogen 3.411 N/A ARG 140.A NE GLU 50.A OE1 no hydrogen 3.116 N/A ARG 140.A NE GLU 50.A OE2 no hydrogen 2.822 N/A ARG 140.A NH2 GLU 50.A OE1 no hydrogen 2.895 N/A ARG 140.A NH2 VAL 334.A O no hydrogen 2.751 N/A PHE 141.A N PHE 137.A O no hydrogen 2.739 N/A TYR 142.A N LEU 138.A O no hydrogen 2.835 N/A LEU 143.A N ASP 139.A O no hydrogen 2.908 N/A SER 144.A N ARG 140.A O no hydrogen 2.800 N/A ARG 145.A N PHE 141.A O no hydrogen 2.898 N/A ARG 145.A NH2 HIS 106.A O no hydrogen 2.875 N/A ILE 146.A N TYR 142.A O no hydrogen 2.836 N/A SER 147.A N LEU 143.A O no hydrogen 2.958 N/A SER 147.A OG SER 144.A O no hydrogen 2.589 N/A ILE 148.A N SER 144.A O no hydrogen 3.030 N/A ARG 149.A N ARG 145.A O no hydrogen 2.860 N/A MET 150.A N ILE 146.A O no hydrogen 2.913 N/A LEU 151.A N SER 147.A O no hydrogen 3.238 N/A ILE 152.A N ILE 148.A O no hydrogen 3.105 N/A ASN 153.A N ARG 149.A O no hydrogen 2.821 N/A GLN 154.A N MET 150.A O no hydrogen 2.864 N/A GLN 154.A NE2 ILE 163.A O no hydrogen 2.937 N/A HIS 155.A N LEU 151.A O no hydrogen 2.945 N/A HIS 155.A ND1 SER 32.A OG no hydrogen 2.618 N/A THR 156.A N ILE 152.A O no hydrogen 2.977 N/A THR 156.A OG1 ILE 152.A O no hydrogen 2.797 N/A THR 156.A OG1 ASN 153.A O no hydrogen 3.395 N/A LEU 157.A N ASN 153.A O no hydrogen 3.033 N/A ILE 158.A N GLN 154.A O no hydrogen 3.091 N/A PHE 159.A N HIS 155.A O no hydrogen 2.957 N/A ILE 163.A N ILE 166.A O no hydrogen 2.882 N/A SER 165.A N GLN 154.A OE1 no hydrogen 2.493 N/A SER 165.A OG GLN 154.A OE1 no hydrogen 3.236 N/A ILE 166.A N ILE 163.A O no hydrogen 3.338 N/A ASP 167.A N TYR 215.A O no hydrogen 2.883 N/A ASN 169.A N ASP 167.A OD1 no hydrogen 2.830 N/A CYS 170.A N MET 213.A O no hydrogen 2.804 N/A SER 173.A OG GLU 201.A OE1 no hydrogen 2.329 N/A GLU 174.A N ASN 171.A O no hydrogen 2.917 N/A GLU 174.A N ASN 171.A OD1 no hydrogen 2.908 N/A VAL 175.A N ASN 171.A O no hydrogen 3.255 N/A VAL 176.A N VAL 172.A O no hydrogen 2.861 N/A LYS 177.A N SER 173.A O no hydrogen 3.020 N/A ASP 178.A N GLU 174.A O no hydrogen 3.067 N/A ALA 179.A N VAL 175.A O no hydrogen 3.088 N/A TYR 180.A N VAL 176.A O no hydrogen 3.025 N/A TYR 180.A OH PRO 195.A O no hydrogen 2.557 N/A ASP 181.A N LYS 177.A O no hydrogen 2.817 N/A MET 182.A N ASP 178.A O no hydrogen 3.089 N/A ALA 183.A N ALA 179.A O no hydrogen 3.023 N/A LYS 184.A N TYR 180.A O no hydrogen 2.733 N/A LYS 184.A NZ ASP 188.A OD2 no hydrogen 2.683 N/A LEU 185.A N ASP 181.A O no hydrogen 3.012 N/A LEU 186.A N MET 182.A O no hydrogen 3.248 N/A CYS 187.A N ALA 183.A O no hydrogen 2.703 N/A CYS 187.A SG ALA 193.A O no hydrogen 3.359 N/A ASP 188.A N LYS 184.A O no hydrogen 2.702 N/A LYS 189.A N LEU 185.A O no hydrogen 3.108 N/A TYR 190.A N LEU 186.A O no hydrogen 3.075 N/A TYR 191.A N CYS 187.A O no hydrogen 2.852 N/A TYR 191.A OH GLU 237.A OE1 no hydrogen 2.762 N/A SER 194.A OG ASP 188.A OD1 no hydrogen 3.103 N/A GLU 198.A N ILE 248.A O no hydrogen 3.187 N/A GLN 200.A N VAL 250.A O no hydrogen 2.894 N/A ILE 202.A N VAL 252.A O no hydrogen 2.824 N/A ASN 203.A ND2 GLN 209.A O no hydrogen 2.857 N/A ALA 204.A N LEU 254.A O no hydrogen 3.229 N/A ASN 206.A N ASN 203.A OD1 no hydrogen 3.133 N/A GLN 209.A N ASN 206.A O no hydrogen 3.055 N/A ILE 211.A N GLU 201.A OE2 no hydrogen 3.110 N/A HIS 212.A ND1 PRO 210.A O no hydrogen 3.175 N/A MET 213.A N CYS 170.A O no hydrogen 3.003 N/A TYR 215.A N ASP 167.A O no hydrogen 3.133 N/A HIS 219.A N VAL 216.A O no hydrogen 2.856 N/A LEU 220.A N VAL 216.A O no hydrogen 3.272 N/A TYR 221.A N PRO 217.A O no hydrogen 2.856 N/A HIS 222.A N SER 218.A O no hydrogen 3.054 N/A MET 223.A N HIS 219.A O no hydrogen 3.169 N/A LEU 224.A N LEU 220.A O no hydrogen 2.944 N/A PHE 225.A N TYR 221.A O no hydrogen 2.752 N/A GLU 226.A N HIS 222.A O no hydrogen 3.173 N/A LEU 227.A N MET 223.A O no hydrogen 3.120 N/A PHE 228.A N LEU 224.A O no hydrogen 2.772 N/A LYS 229.A N PHE 225.A O no hydrogen 2.933 N/A ASN 230.A N GLU 226.A O no hydrogen 3.206 N/A ALA 231.A N LEU 227.A O no hydrogen 2.987 N/A MET 232.A N PHE 228.A O no hydrogen 2.877 N/A ARG 233.A N LYS 229.A O no hydrogen 3.072 N/A ALA 234.A N ASN 230.A O no hydrogen 3.017 N/A THR 235.A N ALA 231.A O no hydrogen 3.035 N/A THR 235.A OG1 ALA 231.A O no hydrogen 2.587 N/A VAL 236.A N MET 232.A O no hydrogen 2.932 N/A GLU 237.A N ARG 233.A O no hydrogen 3.017 N/A SER 238.A N ALA 234.A O no hydrogen 3.025 N/A SER 238.A OG ALA 234.A O no hydrogen 2.778 N/A SER 238.A OG THR 235.A O no hydrogen 3.179 N/A SER 238.A OG HIS 239.A ND1 no hydrogen 2.784 N/A HIS 239.A N VAL 236.A O no hydrogen 3.267 N/A HIS 239.A ND1 THR 235.A O no hydrogen 3.035 N/A HIS 239.A ND1 SER 238.A OG no hydrogen 2.784 N/A SER 242.A N HIS 239.A O no hydrogen 2.954 N/A SER 242.A OG ILE 244.A O no hydrogen 3.433 N/A ILE 248.A N ASP 196.A O no hydrogen 2.952 N/A LYS 249.A N SER 264.A O no hydrogen 2.940 N/A VAL 250.A N GLU 198.A O no hydrogen 2.846 N/A MET 251.A N LYS 262.A O no hydrogen 2.897 N/A VAL 252.A N GLN 200.A O no hydrogen 2.841 N/A ALA 253.A N SER 260.A O no hydrogen 2.772 N/A LEU 254.A N ILE 202.A O no hydrogen 2.985 N/A GLY 255.A N ASP 258.A O no hydrogen 2.744 N/A LEU 259.A N LEU 321.A O no hydrogen 2.961 N/A SER 260.A N ALA 253.A O no hydrogen 2.729 N/A ILE 261.A N ILE 319.A O no hydrogen 2.911 N/A LYS 262.A N MET 251.A O no hydrogen 2.811 N/A LYS 262.A NZ ASP 316.A OD2 no hydrogen 3.320 N/A MET 263.A N ALA 317.A O no hydrogen 2.755 N/A SER 264.A N LYS 249.A O no hydrogen 2.731 N/A SER 264.A OG ASP 316.A OD1 no hydrogen 3.030 N/A ASP 265.A N THR 315.A O no hydrogen 2.956 N/A GLY 267.A N ASP 265.A OD1 no hydrogen 2.938 N/A GLY 268.A N PHE 313.A O no hydrogen 3.085 N/A VAL 270.A N SER 309.A OG no hydrogen 2.978 N/A LYS 274.A N PRO 271.A O no hydrogen 2.845 N/A ILE 275.A N PRO 271.A O no hydrogen 3.345 N/A ILE 275.A N LEU 272.A O no hydrogen 3.198 N/A ARG 277.A N LYS 274.A O no hydrogen 3.078 N/A LEU 278.A N ILE 275.A O no hydrogen 2.802 N/A SER 280.A N ARG 277.A O no hydrogen 3.434 N/A SER 280.A OG ASN 131.A OD1 no hydrogen 2.500 N/A TYR 281.A N GLN 135.A OE1 no hydrogen 2.997 N/A TYR 281.A OH ASP 139.A OD1 no hydrogen 2.877 N/A TYR 283.A N SER 280.A OG no hydrogen 3.292 N/A SER 284.A N SER 280.A O no hydrogen 3.050 N/A SER 284.A OG SER 280.A O no hydrogen 2.545 N/A SER 284.A OG TYR 281.A O no hydrogen 3.367 N/A THR 285.A N MET 282.A O no hydrogen 3.287 N/A THR 285.A OG1 TYR 281.A O no hydrogen 2.469 N/A THR 285.A OG1 TYR 289.A OH no hydrogen 2.614 N/A TYR 289.A OH THR 285.A OG1 no hydrogen 2.614 N/A ILE 293.A N TYR 289.A O no hydrogen 3.135 N/A SER 294.A N GLY 290.A O no hydrogen 2.846 N/A SER 294.A OG GLY 290.A O no hydrogen 2.517 N/A ARG 295.A N LEU 291.A O no hydrogen 2.955 N/A LEU 296.A N PRO 292.A O no hydrogen 3.285 N/A TYR 297.A N ILE 293.A O no hydrogen 3.089 N/A ALA 298.A N SER 294.A O no hydrogen 3.142 N/A LYS 299.A N ARG 295.A O no hydrogen 2.889 N/A TYR 300.A N LEU 296.A O no hydrogen 2.863 N/A TYR 300.A OH GLU 330.A OE2 no hydrogen 2.449 N/A GLN 302.A N LYS 299.A O no hydrogen 2.797 N/A GLN 302.A NE2 VAL 329.A O no hydrogen 2.724 N/A GLY 303.A N ALA 298.A O no hydrogen 2.797 N/A ASP 304.A N TYR 320.A O no hydrogen 2.722 N/A LEU 305.A N ASP 304.A OD1 no hydrogen 2.605 N/A GLN 306.A N VAL 318.A O no hydrogen 2.826 N/A GLN 306.A NE2 ASP 304.A OD2 no hydrogen 2.921 N/A PHE 308.A N ASP 316.A O no hydrogen 2.993 N/A SER 309.A OG VAL 270.A O no hydrogen 2.894 N/A MET 310.A N GLY 314.A O no hydrogen 2.773 N/A GLY 312.A N GLY 268.A O no hydrogen 2.531 N/A PHE 313.A N MET 310.A O no hydrogen 2.856 N/A GLY 314.A N MET 310.A O no hydrogen 3.342 N/A THR 315.A N ASP 265.A O no hydrogen 3.045 N/A THR 315.A N ASP 265.A OD1 no hydrogen 3.072 N/A ASP 316.A N PHE 308.A O no hydrogen 2.892 N/A ALA 317.A N MET 263.A O no hydrogen 2.908 N/A VAL 318.A N GLN 306.A O no hydrogen 2.883 N/A ILE 319.A N ILE 261.A O no hydrogen 2.832 N/A TYR 320.A N ASP 304.A O no hydrogen 2.849 N/A LEU 321.A N LEU 259.A O no hydrogen 3.039 N/A ALA 323.A N GLU 257.A O no hydrogen 2.712 N/A ASP 327.A N LEU 324.A O no hydrogen 2.888 N/A SER 328.A N LEU 324.A O no hydrogen 3.262 N/A SER 328.A N SER 325.A O no hydrogen 3.352 N/A SER 328.A OG LEU 324.A O no hydrogen 3.037 N/A VAL 329.A N ASP 327.A O no hydrogen 2.969 N/A GLU 330.A N LEU 18.A O no hydrogen 2.859 N/A ARG 331.A N TYR 300.A O no hydrogen 2.653 N/A TRP 340.A N ASN 336.A O no hydrogen 3.269 N/A HIS 342.A ND1 SER 338.A O no hydrogen 2.807 N/A TYR 343.A N TRP 340.A O no hydrogen 3.291 N/A TYR 343.A OH GLU 50.A OE2 no hydrogen 2.691 N/A THR 345.A OG1 ASN 133.A OD1 no hydrogen 3.558 N/A THR 345.A OG1 HIS 342.A O no hydrogen 3.390 N/A