Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8f9m_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 3.A N THR 428.A O no hydrogen 2.907 N/A THR 5.A N ALA 426.A O no hydrogen 2.923 N/A TYR 7.A N GLY 424.A O no hydrogen 2.867 N/A GLY 9.A N PRO 422.A O no hydrogen 2.534 N/A VAL 10.A N PRO 422.A O no hydrogen 2.617 N/A VAL 12.A N VAL 10.A O no hydrogen 2.799 N/A LYS 14.A N LYS 419.A O no hydrogen 2.964 N/A GLU 17.A N GLU 17.A OE1 no hydrogen 2.703 N/A LEU 20.A N GLN 63.A OE1 no hydrogen 2.973 N/A PHE 21.A N CYS 167.A O no hydrogen 2.859 N/A ALA 23.A N HIS 165.A O no hydrogen 2.889 N/A SER 24.A N VAL 35.A O no hydrogen 2.944 N/A ASN 27.A ND2 GLU 160.A O no hydrogen 2.575 N/A VAL 28.A N SER 158.A O no hydrogen 2.641 N/A TRP 29.A N ASN 27.A OD1 no hydrogen 2.484 N/A ALA 30.A N ASN 27.A OD1 no hydrogen 3.322 N/A ALA 33.A N THR 31.A OG1 no hydrogen 3.326 N/A VAL 35.A N CYS 22.A O no hydrogen 3.080 N/A THR 37.A N ASP 25.A O no hydrogen 2.503 N/A THR 37.A OG1 ASP 25.A O no hydrogen 3.133 N/A ASN 40.A N ASP 38.A OD1 no hydrogen 3.027 N/A GLN 42.A NE2 ASN 40.A O no hydrogen 2.497 N/A ILE 44.A N THR 193.A O no hydrogen 3.001 N/A LEU 46.A N VAL 191.A O no hydrogen 3.117 N/A PHE 53.A N GLY 186.A O no hydrogen 2.955 N/A MET 55.A N GLY 184.A O no hydrogen 2.860 N/A TRP 56.A N ASN 54.A OD1 no hydrogen 3.002 N/A LYS 57.A N ASN 54.A O no hydrogen 3.241 N/A MET 60.A N ASN 58.A OD1 no hydrogen 2.740 N/A GLN 63.A N ASN 59.A O no hydrogen 3.347 N/A GLN 63.A NE2 THR 18.A O no hydrogen 2.290 N/A MET 64.A N MET 60.A O no hydrogen 2.882 N/A HIS 65.A N VAL 61.A O no hydrogen 2.913 N/A GLU 66.A N GLU 62.A O no hydrogen 2.894 N/A ASP 67.A N GLN 63.A O no hydrogen 2.842 N/A ILE 68.A N MET 64.A O no hydrogen 2.932 N/A ILE 69.A N HIS 65.A O no hydrogen 2.969 N/A SER 70.A N GLU 66.A O no hydrogen 2.894 N/A LEU 71.A N ASP 67.A O no hydrogen 2.872 N/A TRP 72.A N ILE 68.A O no hydrogen 2.919 N/A ASP 73.A N ILE 69.A O no hydrogen 2.903 N/A GLN 74.A N SER 70.A O no hydrogen 2.885 N/A SER 75.A N LEU 71.A O no hydrogen 2.912 N/A SER 75.A OG VAL 28.A O no hydrogen 2.706 N/A SER 75.A OG LEU 71.A O no hydrogen 2.813 N/A LEU 76.A N TRP 72.A O no hydrogen 3.353 N/A LYS 77.A N GLN 74.A O no hydrogen 3.227 N/A LYS 77.A NZ GLN 74.A OE1 no hydrogen 2.653 N/A CYS 79.A N LYS 77.A O no hydrogen 2.802 N/A CYS 79.A SG SER 75.A O no hydrogen 4.040 N/A LEU 82.A N ILE 150.A O no hydrogen 3.109 N/A LEU 85.A N LEU 82.A O no hydrogen 3.494 N/A CYS 86.A N THR 83.A O no hydrogen 3.335 N/A LEU 89.A N TYR 140.A O no hydrogen 2.952 N/A GLN 90.A N SER 110.A O no hydrogen 2.973 N/A CYS 91.A N LYS 138.A O no hydrogen 2.970 N/A THR 92.A N ASN 108.A O no hydrogen 2.927 N/A TYR 94.A N ILE 106.A O no hydrogen 3.388 N/A ALA 95.A N ASN 93.A OD1 no hydrogen 3.069 N/A SER 100.A OG VAL 274.A O no hydrogen 3.186 N/A GLU 105.A N MET 102.A O no hydrogen 2.936 N/A LYS 107.A N PHE 128.A O no hydrogen 2.820 N/A ASN 108.A N THR 92.A O no hydrogen 2.899 N/A CYS 109.A N SER 126.A O no hydrogen 2.900 N/A SER 110.A N GLN 90.A O no hydrogen 2.829 N/A SER 110.A OG GLN 90.A O no hydrogen 3.415 N/A PHE 111.A N VAL 124.A O no hydrogen 2.986 N/A THR 115.A OG1 LEU 117.A O no hydrogen 2.827 N/A THR 115.A OG1 LYS 120.A O no hydrogen 2.470 N/A LYS 120.A N LEU 117.A O no hydrogen 3.365 N/A LYS 121.A NZ ARG 118.A O no hydrogen 2.939 N/A GLN 122.A NE2 LYS 123.A O no hydrogen 3.054 N/A LYS 123.A NZ TYR 125.A OH no hydrogen 3.238 N/A VAL 124.A N PHE 111.A O no hydrogen 2.985 N/A SER 126.A N CYS 109.A O no hydrogen 2.892 N/A LEU 127.A N PHE 267.A O no hydrogen 3.204 N/A PHE 128.A N LYS 107.A O no hydrogen 2.972 N/A ARG 130.A N GLU 105.A O no hydrogen 2.672 N/A ASP 132.A N TYR 129.A O no hydrogen 3.066 N/A VAL 133.A N TYR 129.A O no hydrogen 3.362 N/A VAL 134.A N ARG 141.A O no hydrogen 2.910 N/A GLN 135.A NE2 ASN 137.A OD1 no hydrogen 2.588 N/A ILE 136.A N GLU 139.A O no hydrogen 3.469 N/A GLU 139.A N GLU 139.A OE1 no hydrogen 2.593 N/A TYR 140.A N LEU 89.A O no hydrogen 2.814 N/A ARG 141.A N VAL 134.A O no hydrogen 2.892 N/A ARG 141.A NH1 LEU 142.A O no hydrogen 3.153 N/A ILE 143.A N ASP 132.A O no hydrogen 3.049 N/A ASN 144.A ND2 SER 148.A O no hydrogen 3.493 N/A CYS 145.A N LEU 142.A O no hydrogen 3.185 N/A ASN 146.A N ILE 143.A O no hydrogen 2.940 N/A THR 147.A N ASN 144.A O no hydrogen 3.130 N/A SER 148.A N ASN 144.A O no hydrogen 2.822 N/A SER 148.A OG ALA 149.A O no hydrogen 3.500 N/A THR 151.A N ALA 367.A O no hydrogen 3.081 N/A GLN 152.A N VAL 80.A O no hydrogen 2.802 N/A GLN 152.A NE2 ALA 263.A O no hydrogen 3.077 N/A ALA 153.A N TYR 369.A O no hydrogen 3.505 N/A CYS 154.A SG PRO 78.A O no hydrogen 3.003 N/A VAL 157.A N CYS 154.A O no hydrogen 3.294 N/A SER 158.A N HIS 26.A O no hydrogen 2.884 N/A GLU 160.A N SER 158.A OG no hydrogen 3.040 N/A ILE 164.A N ILE 200.A O no hydrogen 2.875 N/A HIS 165.A N ALA 23.A O no hydrogen 2.882 N/A HIS 165.A ND1 THR 197.A O no hydrogen 2.860 N/A TYR 166.A N THR 197.A OG1 no hydrogen 3.068 N/A CYS 167.A N PHE 21.A O no hydrogen 2.931 N/A ALA 168.A N GLN 195.A O no hydrogen 3.020 N/A PHE 172.A N PRO 169.A O no hydrogen 3.038 N/A ALA 173.A N VAL 418.A O no hydrogen 2.975 N/A ILE 174.A N VAL 194.A O no hydrogen 3.035 N/A LEU 175.A N LYS 416.A O no hydrogen 2.821 N/A LYS 176.A N SER 192.A O no hydrogen 2.896 N/A LYS 176.A NZ GLU 43.A OE1 no hydrogen 3.037 N/A CYS 177.A N LYS 414.A O no hydrogen 3.197 N/A LYS 178.A NZ GLU 43.A OE2 no hydrogen 2.886 N/A PHE 182.A N ASP 179.A O no hydrogen 3.150 N/A THR 185.A N ASN 183.A OD1 no hydrogen 3.062 N/A GLY 186.A N PHE 53.A O no hydrogen 2.887 N/A CYS 188.A N GLU 51.A O no hydrogen 3.260 N/A CYS 188.A SG GLU 51.A O no hydrogen 3.899 N/A SER 190.A N CYS 188.A O no hydrogen 2.475 N/A SER 192.A N LYS 176.A O no hydrogen 2.942 N/A THR 193.A N ILE 44.A O no hydrogen 2.878 N/A THR 193.A OG1 ILE 44.A O no hydrogen 3.472 N/A VAL 194.A N ILE 174.A O no hydrogen 2.876 N/A GLN 195.A NE2 ALA 168.A O no hydrogen 2.940 N/A CYS 196.A SG THR 197.A O no hydrogen 3.826 N/A THR 197.A N TYR 166.A O no hydrogen 3.026 N/A THR 197.A OG1 TYR 166.A O no hydrogen 3.431 N/A THR 197.A OG1 HIS 198.A O no hydrogen 2.943 N/A HIS 198.A N TYR 415.A OH no hydrogen 3.348 N/A HIS 198.A ND1 GLY 199.A O no hydrogen 2.784 N/A ILE 200.A N ILE 164.A O no hydrogen 2.853 N/A VAL 203.A N LYS 201.A O no hydrogen 2.741 N/A SER 205.A OG LEU 208.A O no hydrogen 2.790 N/A THR 206.A OG1 THR 321.A O no hydrogen 2.979 N/A THR 206.A OG1 SER 323.A OG no hydrogen 3.217 N/A GLN 207.A NE2 VAL 319.A O no hydrogen 3.390 N/A GLN 207.A NE2 THR 320.A O no hydrogen 2.477 N/A LEU 208.A N THR 206.A O no hydrogen 2.670 N/A LEU 209.A N GLY 385.A O no hydrogen 2.698 N/A ASN 211.A N ASN 382.A O no hydrogen 2.855 N/A GLY 212.A N THR 384.A OG1 no hydrogen 2.934 N/A SER 213.A N GLU 411.A OE2 no hydrogen 3.146 N/A SER 213.A OG GLN 236.A OE1 no hydrogen 2.633 N/A ALA 215.A N LEU 237.A O no hydrogen 2.794 N/A GLU 216.A N GLU 216.A OE1 no hydrogen 2.696 N/A ILE 220.A N GLN 236.A O no hydrogen 2.969 N/A ARG 222.A N LEU 234.A O no hydrogen 2.799 N/A ASN 225.A N SER 223.A OG no hydrogen 3.327 N/A ASN 228.A N ASN 225.A O no hydrogen 3.155 N/A ASN 229.A ND2 ARG 390.A O no hydrogen 3.230 N/A ALA 230.A N ASN 228.A OD1 no hydrogen 2.989 N/A LYS 231.A N ASN 228.A O no hydrogen 3.261 N/A LYS 231.A NZ GLU 224.A OE1 no hydrogen 2.904 N/A ASN 232.A ND2 ASP 406.A OD2 no hydrogen 2.466 N/A ILE 233.A N LEU 388.A O no hydrogen 2.878 N/A LEU 234.A N ARG 222.A O no hydrogen 2.926 N/A VAL 235.A N LEU 386.A O no hydrogen 2.885 N/A GLN 236.A N ILE 220.A O no hydrogen 2.928 N/A LEU 237.A N THR 384.A O no hydrogen 3.134 N/A VAL 241.A N ILE 383.A O no hydrogen 3.034 N/A GLN 242.A NE2 ASN 382.A OD1 no hydrogen 2.861 N/A ILE 243.A N SER 381.A O no hydrogen 2.931 N/A ASN 244.A N ASN 280.A O no hydrogen 3.059 N/A CYS 245.A N CYS 379.A O no hydrogen 2.910 N/A THR 246.A N HIS 278.A O no hydrogen 2.947 N/A THR 246.A OG1 ILE 377.A O no hydrogen 2.423 N/A ARG 247.A N ILE 377.A O no hydrogen 2.831 N/A ARG 247.A NH1 GLU 329.A OE2 no hydrogen 2.981 N/A ARG 247.A NH1 ILE 373.A O no hydrogen 3.547 N/A ARG 247.A NH2 ILE 373.A O no hydrogen 2.588 N/A ARG 247.A NH2 GLY 375.A O no hydrogen 2.629 N/A SER 249.A OG ARG 275.A O no hydrogen 3.292 N/A ASN 251.A N SER 249.A O no hydrogen 2.859 N/A LYS 254.A N TYR 266.A O no hydrogen 2.984 N/A LYS 254.A NZ ASP 269.A OD1 no hydrogen 3.533 N/A ILE 256.A N PHE 264.A O no hydrogen 2.924 N/A ILE 258.A N GLN 262.A O no hydrogen 2.908 N/A GLY 259.A N GLN 262.A O no hydrogen 3.326 N/A GLN 262.A N GLY 259.A O no hydrogen 3.276 N/A GLN 262.A NE2 GLY 261.A O no hydrogen 2.926 N/A PHE 264.A N ILE 256.A O no hydrogen 2.902 N/A TYR 265.A N GLN 152.A OE1 no hydrogen 3.245 N/A TYR 266.A N LYS 254.A O no hydrogen 2.902 N/A GLY 268.A N THR 252.A O no hydrogen 3.462 N/A VAL 270.A N TYR 94.A OH no hydrogen 2.909 N/A HIS 278.A N THR 246.A O no hydrogen 2.986 N/A HIS 278.A ND1 MET 276.A O no hydrogen 3.179 N/A CYS 279.A N LEU 350.A O no hydrogen 3.024 N/A ASN 280.A N ASN 244.A O no hydrogen 2.756 N/A ILE 281.A N LEU 348.A O no hydrogen 2.893 N/A LYS 283.A N ASP 346.A O no hydrogen 3.331 N/A TRP 286.A N SER 282.A O no hydrogen 3.279 N/A TRP 286.A NE1 LEU 338.A O no hydrogen 3.259 N/A ASN 287.A N LYS 283.A O no hydrogen 2.897 N/A GLU 288.A N ALA 284.A O no hydrogen 2.971 N/A THR 289.A N THR 285.A O no hydrogen 2.900 N/A THR 289.A OG1 THR 285.A O no hydrogen 2.823 N/A LEU 290.A N TRP 286.A O no hydrogen 2.874 N/A GLY 291.A N ASN 287.A O no hydrogen 2.869 N/A LYS 292.A N GLU 288.A O no hydrogen 3.001 N/A VAL 293.A N THR 289.A O no hydrogen 2.981 N/A VAL 294.A N LEU 290.A O no hydrogen 2.790 N/A LYS 295.A N GLY 291.A O no hydrogen 2.930 N/A GLN 296.A N LYS 292.A O no hydrogen 3.060 N/A GLN 296.A NE2 VAL 219.A O no hydrogen 2.466 N/A LEU 297.A N VAL 293.A O no hydrogen 2.837 N/A ARG 298.A N VAL 294.A O no hydrogen 2.842 N/A ARG 298.A NE ASN 303.A O no hydrogen 3.169 N/A ARG 298.A NH2 ASN 303.A O no hydrogen 2.736 N/A LYS 299.A N LYS 295.A O no hydrogen 2.920 N/A HIS 300.A N GLN 296.A O no hydrogen 2.966 N/A PHE 301.A N LEU 297.A O no hydrogen 2.837 N/A THR 305.A N GLY 302.A O no hydrogen 3.381 N/A THR 305.A OG1 PHE 301.A O no hydrogen 2.851 N/A ILE 307.A N TRP 343.A O no hydrogen 3.025 N/A ARG 308.A N GLU 395.A O no hydrogen 2.581 N/A ARG 308.A NH1 THR 342.A OG1 no hydrogen 2.571 N/A PHE 309.A N SER 341.A O no hydrogen 2.830 N/A ALA 310.A N PHE 397.A O no hydrogen 3.053 N/A GLN 311.A N GLN 311.A OE1 no hydrogen 2.674 N/A SER 312.A OG GLY 314.A O no hydrogen 3.181 N/A GLY 314.A N SER 312.A OG no hydrogen 3.356 N/A GLU 318.A N GLU 318.A OE1 no hydrogen 2.675 N/A VAL 319.A N ASP 316.A O no hydrogen 2.934 N/A THR 320.A N ASP 316.A O no hydrogen 2.591 N/A THR 320.A OG1 GLY 315.A O no hydrogen 2.796 N/A THR 320.A OG1 ASP 316.A O no hydrogen 2.825 N/A THR 321.A N LEU 317.A O no hydrogen 3.079 N/A THR 321.A OG1 LEU 317.A O no hydrogen 2.449 N/A HIS 322.A N CYS 333.A O no hydrogen 2.894 N/A SER 323.A OG THR 206.A OG1 no hydrogen 3.217 N/A PHE 324.A N PHE 331.A O no hydrogen 2.976 N/A CYS 326.A N GLU 329.A O no hydrogen 2.972 N/A GLY 328.A N ASN 325.A OD1 no hydrogen 3.187 N/A GLU 329.A N CYS 326.A O no hydrogen 2.942 N/A PHE 330.A N GLU 329.A OE1 no hydrogen 3.192 N/A PHE 331.A N PHE 324.A O no hydrogen 2.874 N/A TYR 332.A N TRP 353.A O no hydrogen 2.931 N/A CYS 333.A N HIS 322.A O no hydrogen 2.866 N/A ASN 334.A N PRO 351.A O no hydrogen 3.407 N/A THR 335.A OG1 GLN 207.A OE1 no hydrogen 3.566 N/A THR 335.A OG1 ASN 334.A O no hydrogen 2.434 N/A LEU 338.A N THR 335.A O no hydrogen 2.826 N/A PHE 339.A N SER 336.A O no hydrogen 3.339 N/A SER 341.A N PHE 309.A O no hydrogen 3.038 N/A TRP 343.A N ILE 307.A O no hydrogen 2.881 N/A TRP 343.A NE1 SER 341.A OG no hydrogen 2.929 N/A SER 345.A OG SER 345.A O no hydrogen 2.591 N/A LEU 348.A N ILE 281.A O no hydrogen 2.874 N/A LEU 350.A N CYS 279.A O no hydrogen 2.839 N/A CYS 352.A N ALA 277.A O no hydrogen 2.639 N/A CYS 352.A SG LEU 350.A O no hydrogen 3.757 N/A TRP 353.A N TYR 332.A O no hydrogen 2.811 N/A LYS 355.A NZ GLU 318.A OE2 no hydrogen 2.715 N/A GLN 356.A N ASP 132.A OD2 no hydrogen 2.751 N/A GLN 356.A NE2 LEU 127.A O no hydrogen 3.471 N/A ILE 357.A N ASP 132.A OD1 no hydrogen 2.819 N/A ILE 358.A N MET 368.A O no hydrogen 2.635 N/A GLN 362.A NE2 GLY 402.A O no hydrogen 2.431 N/A ARG 363.A N MET 360.A O no hydrogen 3.437 N/A ARG 363.A NH1 ASP 73.A OD1 no hydrogen 3.447 N/A ARG 363.A NH1 ASP 73.A OD2 no hydrogen 2.605 N/A ARG 363.A NH2 ASP 73.A OD1 no hydrogen 2.662 N/A ARG 363.A NH2 ASP 73.A OD2 no hydrogen 3.432 N/A ALA 367.A N ALA 149.A O no hydrogen 3.356 N/A MET 368.A N ILE 358.A O no hydrogen 2.856 N/A TYR 369.A N THR 151.A O no hydrogen 2.860 N/A TYR 369.A OH TYR 265.A O no hydrogen 3.287 N/A TYR 369.A OH GLN 356.A OE1 no hydrogen 2.752 N/A ALA 370.A N GLN 356.A O no hydrogen 2.620 N/A GLY 375.A N ASN 251.A O no hydrogen 2.518 N/A ILE 377.A N ARG 247.A O no hydrogen 3.084 N/A CYS 379.A N CYS 245.A O no hydrogen 2.915 N/A CYS 379.A SG CYS 245.A O no hydrogen 3.828 N/A SER 381.A N ILE 243.A O no hydrogen 2.890 N/A ASN 382.A N ASN 211.A OD1 no hydrogen 3.388 N/A ILE 383.A N VAL 241.A O no hydrogen 2.941 N/A THR 384.A N LEU 209.A O no hydrogen 2.890 N/A THR 384.A OG1 LEU 209.A O no hydrogen 3.476 N/A GLY 385.A N LEU 209.A O no hydrogen 3.292 N/A LEU 386.A N VAL 235.A O no hydrogen 2.861 N/A ILE 387.A N GLN 207.A O no hydrogen 2.851 N/A LEU 388.A N ILE 233.A O no hydrogen 2.863 N/A THR 389.A N ARG 398.A O no hydrogen 2.466 N/A ARG 390.A NH1 GLU 395.A OE2 no hydrogen 3.125 N/A ARG 390.A NH2 ILE 226.A O no hydrogen 2.532 N/A ARG 390.A NH2 THR 227.A O no hydrogen 2.652 N/A ASP 391.A N THR 396.A O no hydrogen 2.921 N/A GLU 395.A N ILE 306.A O no hydrogen 3.275 N/A THR 396.A N GLU 395.A OE1 no hydrogen 2.753 N/A PHE 397.A N ARG 308.A O no hydrogen 2.808 N/A ARG 398.A N THR 389.A O no hydrogen 2.690 N/A ARG 398.A NE GLN 311.A O no hydrogen 3.109 N/A ARG 405.A N ASP 403.A OD1 no hydrogen 3.165 N/A ARG 405.A NH1 GLU 62.A OE2 no hydrogen 2.785 N/A ASP 406.A N ASP 403.A O no hydrogen 3.026 N/A ASN 407.A N MET 404.A O no hydrogen 2.952 N/A ASN 407.A ND2 SER 205.A O no hydrogen 2.805 N/A TRP 408.A N MET 404.A O no hydrogen 3.398 N/A ARG 409.A N ARG 405.A O no hydrogen 2.778 N/A ARG 409.A NH1 ASP 406.A OD1 no hydrogen 2.478 N/A SER 410.A N ASP 406.A O no hydrogen 3.116 N/A GLU 411.A N ASN 407.A O no hydrogen 3.114 N/A LEU 412.A N TRP 408.A O no hydrogen 2.833 N/A TYR 415.A N LEU 412.A O no hydrogen 3.199 N/A LYS 416.A N LEU 175.A O no hydrogen 3.002 N/A LYS 416.A NZ GLU 51.A OE2 no hydrogen 2.649 N/A LYS 416.A NZ GLU 52.A O no hydrogen 3.043 N/A VAL 418.A N ALA 173.A O no hydrogen 2.952 N/A LYS 419.A N LYS 14.A O no hydrogen 2.826 N/A LYS 419.A NZ GLU 421.A OE2 no hydrogen 3.229 N/A ILE 420.A N GLY 171.A O no hydrogen 3.053 N/A GLU 421.A N VAL 12.A O no hydrogen 2.749 N/A GLY 424.A N TYR 7.A O no hydrogen 2.960 N/A ALA 426.A N THR 5.A O no hydrogen 2.974 N/A THR 428.A N TRP 3.A O no hydrogen 2.873 N/A LEU 271A.A N ASN 250.A O no hydrogen 3.255 N/A