Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8qfd_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 9.A NE GLY 11.A O no hydrogen 3.114 N/A ARG 9.A NH1 SER 264.A O no hydrogen 3.168 N/A ARG 9.A NH2 HIS 10.A O no hydrogen 2.936 N/A GLY 14.A N SER 12.A OG no hydrogen 3.216 N/A ARG 18.A NH1 ARG 233.A O no hydrogen 3.283 N/A ARG 20.A NE GLN 270.A OE1 no hydrogen 3.121 N/A SER 21.A N TYR 273.A O no hydrogen 2.981 N/A SER 21.A OG ARG 23.A O no hydrogen 2.893 N/A ARG 23.A N SER 21.A OG no hydrogen 3.371 N/A HIS 24.A ND1 TYR 273.A OH no hydrogen 3.083 N/A LYS 27.A N HIS 275.A NE2 no hydrogen 3.109 N/A SER 37.A OG ASP 35.A OD1 no hydrogen 2.974 N/A SER 37.A OG ASP 35.A OD2 no hydrogen 2.986 N/A LYS 38.A N ASP 35.A O no hydrogen 3.412 N/A HIS 41.A N ASN 185.A O no hydrogen 2.976 N/A HIS 41.A ND1 PRO 39.A O no hydrogen 2.727 N/A THR 43.A OG1 GLN 183.A O no hydrogen 3.069 N/A PHE 45.A N LEU 346.A O no hydrogen 2.917 N/A GLY 47.A N LEU 344.A O no hydrogen 2.925 N/A TYR 48.A N GLU 79.A O no hydrogen 2.936 N/A TYR 48.A OH THR 165.A OG1 no hydrogen 3.242 N/A TYR 48.A OH HIS 178.A ND1 no hydrogen 2.644 N/A LYS 49.A N ARG 342.A O no hydrogen 2.978 N/A LYS 49.A NZ VAL 336.A O no hydrogen 3.125 N/A LYS 49.A NZ GLY 338.A O no hydrogen 2.731 N/A ALA 50.A N ILE 77.A O no hydrogen 2.943 N/A THR 53.A N VAL 75.A O no hydrogen 2.961 N/A THR 53.A OG1 ASP 368.A O no hydrogen 2.852 N/A ILE 55.A N GLU 73.A O no hydrogen 2.892 N/A VAL 56.A N PHE 366.A O no hydrogen 3.001 N/A ARG 57.A N VAL 71.A O no hydrogen 2.989 N/A ARG 57.A NE GLU 73.A OE1 no hydrogen 2.854 N/A ARG 57.A NE GLU 73.A OE2 no hydrogen 3.559 N/A ARG 57.A NH1 GLU 360.A OE2 no hydrogen 3.001 N/A ARG 57.A NH2 GLU 73.A OE2 no hydrogen 3.430 N/A VAL 59.A N LYS 69.A O no hydrogen 3.008 N/A ARG 61.A N ASN 67.A OD1 no hydrogen 2.739 N/A SER 64.A N ARG 61.A O no hydrogen 3.122 N/A VAL 66.A N SER 64.A OG no hydrogen 3.356 N/A LYS 68.A N VAL 59.A O no hydrogen 2.832 N/A LYS 69.A N VAL 66.A O no hydrogen 3.201 N/A VAL 71.A N ARG 57.A O no hydrogen 2.860 N/A GLU 73.A N ILE 55.A O no hydrogen 2.919 N/A VAL 75.A N THR 53.A O no hydrogen 2.862 N/A THR 76.A N LEU 332.A O no hydrogen 2.761 N/A THR 76.A OG1 GLY 334.A O no hydrogen 2.711 N/A ILE 77.A N GLY 51.A O no hydrogen 2.760 N/A VAL 78.A N VAL 330.A O no hydrogen 2.927 N/A GLU 79.A N TYR 48.A O no hydrogen 2.872 N/A THR 80.A N ASP 328.A O no hydrogen 2.746 N/A THR 80.A OG1 ASP 328.A O no hydrogen 3.520 N/A MET 83.A N VAL 204.A O no hydrogen 2.964 N/A VAL 84.A N HIS 164.A O no hydrogen 2.941 N/A VAL 85.A N GLN 202.A O no hydrogen 2.971 N/A VAL 86.A N ILE 162.A O no hydrogen 2.848 N/A GLY 87.A N ILE 162.A O no hydrogen 3.015 N/A ILE 88.A N VAL 104.A O no hydrogen 2.889 N/A VAL 89.A N ARG 160.A O no hydrogen 2.898 N/A GLY 90.A N LYS 102.A O no hydrogen 2.944 N/A TYR 91.A N VAL 158.A O no hydrogen 2.851 N/A TYR 91.A OH GLU 181.A OE1 no hydrogen 2.997 N/A VAL 92.A N ARG 99.A O no hydrogen 2.924 N/A GLU 93.A N GLN 157.A OE1 no hydrogen 2.982 N/A THR 94.A N GLY 97.A O no hydrogen 2.913 N/A THR 94.A OG1 GLY 97.A O no hydrogen 2.822 N/A ARG 96.A N THR 94.A OG1 no hydrogen 3.100 N/A GLY 97.A N THR 94.A O no hydrogen 2.922 N/A ARG 99.A N VAL 92.A O no hydrogen 2.916 N/A PHE 101.A N GLY 90.A O no hydrogen 2.866 N/A VAL 104.A N ILE 88.A O no hydrogen 2.904 N/A PHE 105.A N TYR 132.A OH no hydrogen 3.020 N/A ALA 106.A N VAL 86.A O no hydrogen 2.942 N/A HIS 108.A N GLU 201.A OE2 no hydrogen 2.787 N/A LYS 114.A N SER 110.A O no hydrogen 2.951 N/A ARG 115.A N ASP 111.A O no hydrogen 2.912 N/A ARG 116.A N CYS 113.A O no hydrogen 3.061 N/A ARG 116.A NE ALA 177.A O no hydrogen 2.816 N/A ARG 116.A NH2 ALA 177.A O no hydrogen 2.925 N/A PHE 117.A N LYS 114.A O no hydrogen 3.038 N/A TYR 118.A N ARG 115.A O no hydrogen 3.329 N/A LYS 123.A N ASN 120.A OD1 no hydrogen 3.157 N/A SER 124.A N TRP 121.A O no hydrogen 3.197 N/A LYS 126.A N SER 124.A OG no hydrogen 2.792 N/A LYS 126.A NZ TRP 121.A O no hydrogen 2.835 N/A LYS 126.A NZ SER 124.A O no hydrogen 3.171 N/A THR 130.A N LYS 127.A O no hydrogen 3.158 N/A THR 130.A OG1 LYS 127.A O no hydrogen 2.409 N/A CYS 133.A N PHE 129.A O no hydrogen 2.961 N/A CYS 133.A SG THR 130.A O no hydrogen 3.520 N/A LYS 134.A N LYS 131.A O no hydrogen 3.426 N/A LYS 135.A N TYR 132.A O no hydrogen 3.127 N/A TRP 136.A N CYS 133.A O no hydrogen 3.384 N/A TRP 136.A NE1 PHE 105.A O no hydrogen 3.066 N/A GLN 137.A N LYS 134.A O no hydrogen 3.057 N/A GLN 137.A NE2 GLU 107.A OE1 no hydrogen 3.356 N/A GLN 137.A NE2 GLU 107.A OE2 no hydrogen 2.862 N/A ASP 138.A N LYS 134.A O no hydrogen 2.960 N/A GLY 141.A N ASP 138.A OD1 no hydrogen 2.913 N/A LYS 142.A N ASP 138.A O no hydrogen 2.912 N/A LYS 143.A N GLU 139.A O no hydrogen 2.975 N/A GLN 144.A N ASP 140.A O no hydrogen 2.913 N/A LEU 145.A N GLY 141.A O no hydrogen 2.905 N/A GLU 146.A N LYS 142.A O no hydrogen 2.967 N/A LYS 147.A N LYS 143.A O no hydrogen 2.923 N/A ASP 148.A N GLN 144.A O no hydrogen 2.924 N/A PHE 149.A N LEU 145.A O no hydrogen 2.979 N/A SER 150.A N GLU 146.A O no hydrogen 2.928 N/A SER 151.A N LYS 147.A O no hydrogen 2.882 N/A MET 152.A N ASP 148.A O no hydrogen 2.967 N/A LYS 153.A N PHE 149.A O no hydrogen 2.931 N/A LYS 153.A NZ ASP 194.A OD1 no hydrogen 3.460 N/A LYS 154.A N SER 150.A O no hydrogen 2.914 N/A LYS 154.A NZ TYR 155.A OH no hydrogen 2.901 N/A TYR 155.A N SER 151.A O no hydrogen 2.948 N/A CYS 156.A N MET 152.A O no hydrogen 3.109 N/A GLN 157.A N TYR 91.A O no hydrogen 2.919 N/A VAL 158.A N TYR 91.A O no hydrogen 3.026 N/A ARG 160.A N VAL 89.A O no hydrogen 2.961 N/A ARG 160.A NE GLN 183.A OE1 no hydrogen 3.531 N/A ARG 160.A NH1 GLU 181.A OE1 no hydrogen 3.190 N/A VAL 161.A N ILE 182.A O no hydrogen 2.898 N/A ILE 162.A N GLY 87.A O no hydrogen 2.848 N/A ALA 163.A N MET 180.A O no hydrogen 2.963 N/A HIS 164.A N VAL 84.A O no hydrogen 2.932 N/A HIS 164.A ND1 THR 165.A O no hydrogen 2.759 N/A THR 165.A N HIS 178.A O no hydrogen 2.952 N/A THR 165.A OG1 TYR 48.A OH no hydrogen 3.242 N/A THR 165.A OG1 HIS 178.A O no hydrogen 3.510 N/A GLN 166.A NE2 PRO 82.A O no hydrogen 2.762 N/A ARG 168.A N GLU 112.A OE1 no hydrogen 3.425 N/A ARG 168.A NH1 GLN 166.A OE1 no hydrogen 2.976 N/A LEU 169.A N GLN 166.A O no hydrogen 3.446 N/A LEU 170.A N MET 167.A O no hydrogen 3.058 N/A GLN 174.A NE2 LYS 176.A O no hydrogen 2.727 N/A ALA 177.A N GLU 112.A O no hydrogen 3.048 N/A HIS 178.A N THR 165.A OG1 no hydrogen 2.993 N/A HIS 178.A ND1 TYR 48.A OH no hydrogen 2.644 N/A MET 180.A N ALA 163.A O no hydrogen 2.912 N/A ILE 182.A N VAL 161.A O no hydrogen 2.873 N/A GLN 183.A NE2 ASN 185.A OD1 no hydrogen 2.997 N/A VAL 184.A N ILE 159.A O no hydrogen 2.932 N/A ASN 185.A N HIS 41.A O no hydrogen 3.082 N/A ASN 185.A ND2 PRO 32.A O no hydrogen 3.107 N/A GLY 186.A N ASP 34.A OD1 no hydrogen 3.081 N/A THR 188.A N GLU 191.A OE1 no hydrogen 2.948 N/A GLU 191.A N THR 188.A OG1 no hydrogen 3.194 N/A LYS 192.A N THR 188.A O no hydrogen 2.890 N/A LYS 192.A NZ ASP 34.A OD1 no hydrogen 3.376 N/A LYS 192.A NZ ASP 34.A OD2 no hydrogen 2.818 N/A LYS 192.A NZ VAL 184.A O no hydrogen 3.176 N/A LYS 192.A NZ GLY 186.A O no hydrogen 3.186 N/A LEU 193.A N VAL 189.A O no hydrogen 2.914 N/A ASP 194.A N ALA 190.A O no hydrogen 2.935 N/A TRP 195.A N GLU 191.A O no hydrogen 2.928 N/A ALA 196.A N LYS 192.A O no hydrogen 2.909 N/A ARG 197.A N LEU 193.A O no hydrogen 2.859 N/A ARG 197.A NH1 GLU 146.A OE1 no hydrogen 3.540 N/A ARG 197.A NH2 GLU 146.A OE2 no hydrogen 3.024 N/A GLU 198.A N ASP 194.A O no hydrogen 3.000 N/A ARG 199.A N ALA 196.A O no hydrogen 3.201 N/A ARG 199.A NH1 TRP 195.A O no hydrogen 3.223 N/A LEU 200.A N ARG 197.A O no hydrogen 3.409 N/A GLU 201.A N VAL 85.A O no hydrogen 2.723 N/A GLN 202.A N ARG 199.A O no hydrogen 2.998 N/A GLN 202.A NE2 LEU 200.A O no hydrogen 3.042 N/A VAL 204.A N MET 83.A O no hydrogen 2.867 N/A GLN 208.A N PRO 205.A O no hydrogen 3.311 N/A VAL 209.A N VAL 206.A O no hydrogen 3.054 N/A PHE 210.A N VAL 206.A O no hydrogen 2.963 N/A GLY 211.A N GLU 214.A OE1 no hydrogen 3.137 N/A GLN 212.A NE2 TYR 284.A O no hydrogen 3.137 N/A GLN 212.A NE2 ILE 362.A O no hydrogen 3.494 N/A ASP 213.A N ILE 283.A O no hydrogen 3.146 N/A ILE 216.A N LYS 281.A O no hydrogen 2.906 N/A ASP 217.A N ARG 347.A O no hydrogen 2.954 N/A VAL 218.A N GLU 278.A O no hydrogen 2.892 N/A ILE 219.A N THR 345.A O no hydrogen 2.967 N/A GLY 220.A N ARG 276.A O no hydrogen 2.997 N/A THR 222.A N HIS 274.A O no hydrogen 2.917 N/A THR 222.A OG1 HIS 274.A O no hydrogen 3.363 N/A LYS 225.A N LYS 271.A O no hydrogen 2.950 N/A LYS 228.A N GLY 269.A O no hydrogen 2.937 N/A SER 232.A N GLY 229.A O no hydrogen 3.101 N/A ARG 233.A N GLY 229.A O no hydrogen 2.860 N/A ARG 233.A NE GLN 270.A O no hydrogen 2.761 N/A ARG 233.A NH1 ARG 267.A O no hydrogen 2.999 N/A ARG 233.A NH2 ARG 18.A O no hydrogen 2.969 N/A ARG 233.A NH2 GLN 270.A O no hydrogen 3.148 N/A TRP 234.A N VAL 230.A O no hydrogen 2.879 N/A HIS 235.A N VAL 230.A O no hydrogen 3.091 N/A LEU 239.A N LEU 247.A O no hydrogen 3.148 N/A THR 243.A N PRO 240.A O no hydrogen 3.173 N/A THR 243.A OG1 PRO 240.A O no hydrogen 2.584 N/A LYS 249.A NZ ARG 245.A O no hydrogen 2.859 N/A CYS 252.A SG GLY 254.A O no hydrogen 3.471 N/A ARG 260.A N PRO 258.A O no hydrogen 2.747 N/A VAL 265.A N ALA 262.A O no hydrogen 3.514 N/A GLY 269.A N LYS 228.A O no hydrogen 2.994 N/A GLN 270.A NE2 GLY 272.A O no hydrogen 3.159 N/A LYS 271.A N GLY 226.A O no hydrogen 2.904 N/A LYS 271.A NZ SER 232.A O no hydrogen 3.302 N/A LYS 271.A NZ SER 232.A OG no hydrogen 3.365 N/A GLY 272.A N HIS 274.A NE2 no hydrogen 3.253 N/A TYR 273.A N LYS 223.A O no hydrogen 3.288 N/A TYR 273.A OH HIS 24.A ND1 no hydrogen 3.083 N/A HIS 274.A N THR 222.A OG1 no hydrogen 2.972 N/A HIS 274.A ND1 LYS 19.A O no hydrogen 2.701 N/A ARG 276.A N GLY 220.A O no hydrogen 2.883 N/A ARG 276.A NH1 HIS 275.A O no hydrogen 2.886 N/A GLU 278.A N VAL 218.A O no hydrogen 2.903 N/A ASN 280.A N ASP 217.A OD1 no hydrogen 3.336 N/A LYS 281.A N ILE 216.A O no hydrogen 2.901 N/A LYS 281.A NZ CYS 335.A O no hydrogen 3.032 N/A LYS 282.A NZ ASP 213.A O no hydrogen 3.039 N/A LYS 282.A NZ ARG 357.A O no hydrogen 3.463 N/A LYS 282.A NZ GLU 360.A O no hydrogen 2.912 N/A ILE 283.A N GLU 214.A O no hydrogen 2.887 N/A TYR 284.A N MET 331.A O no hydrogen 2.789 N/A TYR 284.A OH GLU 73.A OE2 no hydrogen 3.350 N/A LYS 285.A NZ ASN 301.A O no hydrogen 3.072 N/A GLY 287.A N PHE 329.A O no hydrogen 2.890 N/A GLN 288.A NE2 GLY 289.A O no hydrogen 2.546 N/A GLY 289.A N ASP 328.A OD1 no hydrogen 2.745 N/A TYR 290.A N THR 326.A O no hydrogen 3.042 N/A TYR 290.A OH SER 312.A OG no hydrogen 3.216 N/A LEU 291.A N ILE 298.A O no hydrogen 2.984 N/A LYS 293.A N LYS 296.A O no hydrogen 2.902 N/A LYS 296.A N LYS 293.A O no hydrogen 2.894 N/A ILE 298.A N LEU 291.A O no hydrogen 2.849 N/A LYS 299.A NZ ASP 310.A OD2 no hydrogen 3.061 N/A ASN 301.A N LYS 299.A O no hydrogen 2.902 N/A ASN 301.A ND2 GLN 288.A O no hydrogen 3.126 N/A ALA 302.A N LYS 311.A O no hydrogen 3.174 N/A SER 303.A OG ASN 300.A O no hydrogen 2.703 N/A THR 304.A N ASP 307.A O no hydrogen 2.936 N/A THR 304.A OG1 LYS 365.A O no hydrogen 2.848 N/A TYR 306.A N THR 304.A OG1 no hydrogen 3.259 N/A TYR 306.A OH ASP 363.A OD2 no hydrogen 2.739 N/A ASP 307.A N THR 304.A OG1 no hydrogen 2.877 N/A SER 309.A OG ASP 307.A OD1 no hydrogen 3.096 N/A LYS 311.A N SER 309.A O no hydrogen 2.928 N/A LYS 311.A NZ ILE 367.A O no hydrogen 2.817 N/A LYS 311.A NZ THR 369.A OG1 no hydrogen 2.832 N/A SER 312.A OG TYR 290.A OH no hydrogen 3.216 N/A ILE 313.A N ASN 301.A OD1 no hydrogen 2.778 N/A ASN 314.A N SER 312.A OG no hydrogen 3.229 N/A ASN 314.A ND2 SER 312.A OG no hydrogen 3.232 N/A ASN 314.A ND2 VAL 325.A O no hydrogen 3.021 N/A LEU 316.A N THR 369.A O no hydrogen 3.259 N/A GLY 318.A N PRO 315.A O no hydrogen 2.878 N/A PHE 319.A N GLY 323.A O no hydrogen 3.306 N/A TYR 322.A N PHE 319.A O no hydrogen 3.171 N/A TYR 322.A OH GLU 79.A OE1 no hydrogen 2.336 N/A GLY 323.A N PHE 319.A O no hydrogen 3.317 N/A VAL 325.A N ASN 314.A OD1 no hydrogen 2.852 N/A THR 326.A N GLU 79.A OE2 no hydrogen 3.137 N/A ASN 327.A N GLU 79.A OE2 no hydrogen 3.260 N/A ASN 327.A ND2 GLU 79.A OE2 no hydrogen 3.218 N/A ASN 327.A ND2 LEU 169.A O no hydrogen 2.619 N/A PHE 329.A N GLY 287.A O no hydrogen 2.945 N/A VAL 330.A N VAL 78.A O no hydrogen 2.755 N/A MET 331.A N LYS 285.A O no hydrogen 2.875 N/A LEU 332.A N THR 76.A O no hydrogen 2.907 N/A LYS 333.A N LYS 282.A O no hydrogen 3.072 N/A GLY 334.A N ALA 74.A O no hydrogen 2.939 N/A THR 339.A OG1 LYS 340.A O no hydrogen 3.263 N/A LYS 341.A N LYS 49.A O no hydrogen 2.933 N/A LYS 341.A NZ HIS 321.A O no hydrogen 2.626 N/A ARG 342.A N THR 339.A O no hydrogen 3.419 N/A ARG 342.A NE VAL 221.A O no hydrogen 3.082 N/A ARG 342.A NH2 VAL 221.A O no hydrogen 3.438 N/A ARG 342.A NH2 THR 222.A O no hydrogen 2.860 N/A LEU 344.A N GLY 47.A O no hydrogen 2.854 N/A THR 345.A N ILE 219.A O no hydrogen 3.138 N/A THR 345.A OG1 GLY 26.A O no hydrogen 2.859 N/A LEU 346.A N PHE 45.A O no hydrogen 2.887 N/A ARG 347.A N ASP 217.A O no hydrogen 2.967 N/A ARG 347.A NE LYS 348.A O no hydrogen 3.365 N/A ARG 347.A NH1 SER 30.A O no hydrogen 3.234 N/A ARG 347.A NH2 ASP 217.A OD2 no hydrogen 2.476 N/A LYS 348.A N THR 43.A O no hydrogen 3.139 N/A LYS 348.A NZ VAL 209.A O no hydrogen 3.350 N/A LYS 348.A NZ GLU 214.A OE2 no hydrogen 3.236 N/A SER 349.A OG LEU 351.A O no hydrogen 3.416 N/A LEU 351.A N SER 349.A OG no hydrogen 3.071 N/A GLN 353.A NE2 ASN 280.A OD1 no hydrogen 3.341 N/A GLN 353.A NE2 SER 349.A OG no hydrogen 2.943 N/A LEU 359.A N LYS 355.A O no hydrogen 2.955 N/A ILE 362.A N ASP 213.A OD1 no hydrogen 2.883 N/A LYS 365.A N VAL 56.A O no hydrogen 2.981 N/A LYS 365.A NZ GLU 70.A OE2 no hydrogen 3.188 N/A PHE 366.A N VAL 56.A O no hydrogen 3.385 N/A ASP 368.A N HIS 54.A O no hydrogen 3.213 N/A THR 369.A N GLN 379.A OE1 no hydrogen 2.722 N/A THR 369.A OG1 GLN 379.A O no hydrogen 3.162 N/A THR 369.A OG1 GLN 379.A OE1 no hydrogen 3.060 N/A THR 370.A N ASP 368.A OD1 no hydrogen 3.245 N/A THR 370.A OG1 ASP 368.A OD1 no hydrogen 2.932 N/A SER 371.A OG LEU 316.A O no hydrogen 3.358 N/A LYS 372.A NZ THR 370.A O no hydrogen 2.949 N/A PHE 373.A N SER 371.A OG no hydrogen 3.108 N/A GLN 379.A N GLU 383.A OE1 no hydrogen 2.867 N/A GLN 379.A NE2 ASP 368.A OD2 no hydrogen 3.060 N/A GLU 383.A N THR 380.A OG1 no hydrogen 3.184 N/A LYS 384.A N THR 380.A O no hydrogen 2.968 N/A LYS 385.A N MET 381.A O no hydrogen 2.895 N/A ALA 386.A N GLU 382.A O no hydrogen 2.914 N/A PHE 387.A N GLU 383.A O no hydrogen 2.945 N/A MET 388.A N LYS 384.A O no hydrogen 2.946 N/A GLY 389.A N LYS 385.A O no hydrogen 2.902 N/A LEU 391.A N ASP 394.A OD2 no hydrogen 2.996 N/A ASP 394.A N LEU 391.A O no hydrogen 3.143 N/A ARG 395.A N LEU 391.A O no hydrogen 3.467 N/A