Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8j84_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 5.A N ALA 361.A O no hydrogen 2.859 N/A ILE 7.A N GLY 359.A O no hydrogen 3.427 N/A ILE 12.A N CYS 20.A O no hydrogen 3.341 N/A LEU 13.A N LYS 221.A O no hydrogen 2.348 N/A PHE 14.A N GLN 18.A O no hydrogen 2.427 N/A ALA 15.A N GLY 31.A O no hydrogen 3.214 N/A GLN 18.A N ALA 15.A O no hydrogen 3.195 N/A CYS 20.A N ILE 12.A O no hydrogen 3.085 N/A CYS 20.A SG ASP 22.A O no hydrogen 3.132 N/A THR 21.A OG1 TYR 423.A OH no hydrogen 2.745 N/A ARG 24.A NE HIS 202.A NE2 no hydrogen 3.112 N/A ARG 24.A NH1 ASP 22.A OD2 no hydrogen 2.936 N/A GLY 26.A N ASP 22.A O no hydrogen 2.987 N/A LEU 27.A N PRO 23.A O no hydrogen 2.899 N/A ALA 28.A N ARG 24.A O no hydrogen 2.920 N/A LEU 29.A N ASP 25.A O no hydrogen 2.904 N/A PHE 30.A N GLY 26.A O no hydrogen 2.897 N/A GLY 31.A N LEU 27.A O no hydrogen 2.901 N/A LEU 33.A N PRO 219.A O no hydrogen 3.068 N/A ILE 39.A N LYS 85.A O no hydrogen 3.122 N/A LYS 40.A N ASP 137.A OD2 no hydrogen 2.611 N/A LYS 40.A NZ ASP 137.A OD1 no hydrogen 3.298 N/A LYS 40.A NZ ASP 137.A OD2 no hydrogen 2.522 N/A SER 41.A N ILE 39.A O no hydrogen 2.707 N/A SER 41.A OG ILE 39.A O no hydrogen 3.359 N/A GLY 42.A N VAL 138.A O no hydrogen 2.932 N/A VAL 43.A N VAL 92.A O no hydrogen 3.278 N/A VAL 44.A N PHE 140.A O no hydrogen 3.281 N/A LEU 50.A N THR 46.A O no hydrogen 2.456 N/A GLN 51.A N GLN 47.A O no hydrogen 2.928 N/A ILE 52.A N LYS 48.A O no hydrogen 2.905 N/A PHE 53.A N GLY 49.A O no hydrogen 2.898 N/A LYS 54.A N LEU 50.A O no hydrogen 2.907 N/A LYS 54.A NZ SER 88.A OG no hydrogen 2.363 N/A SER 55.A N GLN 51.A O no hydrogen 2.892 N/A SER 55.A OG GLN 51.A O no hydrogen 3.060 N/A SER 55.A OG ILE 52.A O no hydrogen 2.633 N/A TYR 56.A N ILE 52.A O no hydrogen 2.895 N/A LEU 57.A N PHE 53.A O no hydrogen 2.904 N/A ASP 58.A N LYS 54.A O no hydrogen 2.934 N/A LYS 59.A N SER 55.A O no hydrogen 2.876 N/A ILE 60.A N TYR 56.A O no hydrogen 2.887 N/A ILE 60.A N LEU 57.A O no hydrogen 3.250 N/A ILE 64.A N PHE 75.A O no hydrogen 3.141 N/A ASN 66.A N ASN 69.A OD1 no hydrogen 2.550 N/A ASN 66.A ND2 ARG 72.A O no hydrogen 2.369 N/A HIS 67.A N LYS 198.A O no hydrogen 2.971 N/A ASN 69.A N ASN 68.A OD1 no hydrogen 2.933 N/A ASN 69.A ND2 ASN 66.A O no hydrogen 2.460 N/A PHE 75.A N ILE 64.A O no hydrogen 2.958 N/A GLU 79.A N GLU 79.A OE2 no hydrogen 2.462 N/A VAL 81.A N GLY 77.A O no hydrogen 2.872 N/A VAL 81.A N PHE 78.A O no hydrogen 3.251 N/A PHE 82.A N PHE 78.A O no hydrogen 2.888 N/A GLY 83.A N GLU 79.A O no hydrogen 3.225 N/A SER 88.A OG SER 88.A O no hydrogen 2.227 N/A VAL 92.A N SER 41.A O no hydrogen 3.184 N/A LYS 94.A N VAL 43.A O no hydrogen 3.203 N/A GLU 95.A N GLU 95.A OE1 no hydrogen 2.998 N/A ARG 102.A N ASP 98.A O no hydrogen 2.878 N/A ARG 103.A N GLU 99.A O no hydrogen 2.982 N/A TYR 104.A N GLU 100.A O no hydrogen 2.884 N/A PHE 106.A N ARG 103.A O no hydrogen 3.494 N/A SER 109.A N ASN 107.A OD1 no hydrogen 2.682 N/A ARG 113.A N SER 109.A O no hydrogen 2.659 N/A THR 114.A N THR 110.A O no hydrogen 2.925 N/A THR 114.A OG1 ALA 155.A O no hydrogen 3.325 N/A THR 114.A OG1 GLN 160.A OE1 no hydrogen 2.525 N/A TYR 115.A N HIS 111.A O no hydrogen 2.907 N/A ASP 116.A N LYS 112.A O no hydrogen 2.885 N/A LEU 117.A N ARG 113.A O no hydrogen 2.968 N/A VAL 118.A N THR 114.A O no hydrogen 2.912 N/A THR 119.A N TYR 115.A O no hydrogen 2.898 N/A THR 119.A OG1 ASP 116.A O no hydrogen 2.706 N/A LEU 120.A N ASP 116.A O no hydrogen 2.908 N/A PHE 121.A N LEU 117.A O no hydrogen 2.965 N/A ASN 122.A N VAL 118.A O no hydrogen 2.842 N/A ASN 122.A ND2 HIS 168.A ND1 no hydrogen 3.649 N/A ASP 123.A N THR 119.A O no hydrogen 2.867 N/A LYS 124.A N LEU 120.A O no hydrogen 2.962 N/A ILE 125.A N PHE 121.A O no hydrogen 2.918 N/A ILE 126.A N ASN 122.A O no hydrogen 2.916 N/A THR 127.A N ASP 123.A O no hydrogen 2.933 N/A THR 127.A OG1 ASP 123.A O no hydrogen 2.565 N/A ALA 128.A N LYS 124.A O no hydrogen 2.926 N/A ASN 129.A N ILE 125.A O no hydrogen 2.953 N/A LYS 130.A N ILE 126.A O no hydrogen 2.892 N/A ASN 131.A N THR 127.A O no hydrogen 2.905 N/A GLU 133.A N ASP 132.A OD1 no hydrogen 2.619 N/A ASP 137.A N LYS 40.A O no hydrogen 2.982 N/A PHE 140.A N GLY 42.A O no hydrogen 2.659 N/A VAL 141.A N GLN 173.A O no hydrogen 2.912 N/A ILE 142.A N VAL 44.A O no hydrogen 3.011 N/A VAL 143.A N LEU 175.A O no hydrogen 2.905 N/A GLU 145.A N GLU 177.A OE1 no hydrogen 3.163 N/A GLU 146.A N GLU 146.A OE1 no hydrogen 2.534 N/A ILE 147.A N PRO 144.A O no hydrogen 2.965 N/A TYR 148.A N PRO 144.A O no hydrogen 3.399 N/A LYS 149.A N GLU 145.A O no hydrogen 2.882 N/A LYS 149.A NZ TYR 150.A OH no hydrogen 3.470 N/A TYR 150.A N GLU 146.A O no hydrogen 2.924 N/A CYS 151.A N TYR 148.A O no hydrogen 3.206 N/A CYS 151.A SG ILE 147.A O no hydrogen 3.324 N/A GLN 160.A N ASP 159.A OD1 no hydrogen 2.824 N/A LEU 161.A N PHE 157.A O no hydrogen 2.936 N/A LYS 162.A N HIS 158.A O no hydrogen 2.882 N/A LYS 162.A NZ HIS 158.A NE2 no hydrogen 3.085 N/A ALA 163.A N ASP 159.A O no hydrogen 2.912 N/A ARG 164.A N GLN 160.A O no hydrogen 2.916 N/A LEU 165.A N LEU 161.A O no hydrogen 2.944 N/A LEU 166.A N LYS 162.A O no hydrogen 2.863 N/A GLU 167.A N ALA 163.A O no hydrogen 2.925 N/A HIS 168.A N ARG 164.A O no hydrogen 2.924 N/A THR 169.A N LEU 166.A O no hydrogen 2.991 N/A ILE 170.A N LEU 165.A O no hydrogen 2.575 N/A THR 172.A OG1 TRP 139.A O no hydrogen 3.281 N/A GLN 173.A N TRP 139.A O no hydrogen 2.912 N/A LEU 175.A N VAL 141.A O no hydrogen 2.904 N/A GLU 177.A N GLU 177.A OE2 no hydrogen 2.752 N/A SER 178.A OG GLU 145.A OE1 no hydrogen 2.972 N/A ALA 181.A N GLU 177.A O no hydrogen 2.346 N/A TRP 182.A NE1 GLU 200.A OE1 no hydrogen 2.463 N/A TRP 182.A NE1 GLU 200.A OE2 no hydrogen 2.971 N/A ASP 184.A N ALA 181.A O no hydrogen 2.849 N/A PHE 185.A N TRP 182.A O no hydrogen 3.005 N/A LYS 186.A NZ ARG 183.A O no hydrogen 3.321 N/A ASN 187.A N ALA 191.A O no hydrogen 2.805 N/A GLY 190.A N ASN 187.A O no hydrogen 3.089 N/A ILE 193.A N PHE 185.A O no hydrogen 3.366 N/A ARG 194.A NH2 SER 178.A OG no hydrogen 2.516 N/A ARG 194.A NH2 THR 179.A OG1 no hydrogen 2.843 N/A SER 197.A OG ASP 195.A OD1 no hydrogen 2.796 N/A SER 197.A OG ASP 195.A OD2 no hydrogen 3.176 N/A ILE 199.A N PHE 196.A O no hydrogen 2.918 N/A HIS 202.A N ASN 66.A OD1 no hydrogen 2.899 N/A LEU 203.A N ILE 199.A O no hydrogen 2.975 N/A ALA 204.A N GLU 200.A O no hydrogen 2.943 N/A TRP 205.A N GLY 201.A O no hydrogen 2.877 N/A TRP 205.A NE1 MET 74.A O no hydrogen 2.431 N/A THR 206.A N HIS 202.A O no hydrogen 2.902 N/A ILE 207.A N LEU 203.A O no hydrogen 2.987 N/A SER 208.A N ALA 204.A O no hydrogen 2.878 N/A THR 209.A N TRP 205.A O no hydrogen 2.919 N/A THR 209.A OG1 TRP 205.A O no hydrogen 2.539 N/A ALA 210.A N THR 206.A O no hydrogen 2.958 N/A ALA 211.A N ILE 207.A O no hydrogen 2.907 N/A TYR 212.A N SER 208.A O no hydrogen 2.897 N/A TYR 212.A OH ASN 34.A O no hydrogen 2.691 N/A TYR 213.A N THR 209.A O no hydrogen 2.937 N/A TYR 213.A OH ASP 260.A OD1 no hydrogen 2.444 N/A LYS 214.A N ALA 210.A O no hydrogen 2.935 N/A LYS 214.A NZ ASN 419.A OD1 no hydrogen 3.158 N/A ALA 215.A N TYR 212.A O no hydrogen 3.160 N/A GLY 216.A N TYR 213.A O no hydrogen 3.327 N/A LYS 218.A N ASN 34.A OD1 no hydrogen 2.821 N/A LYS 221.A N LEU 13.A O no hydrogen 3.163 N/A LYS 221.A NZ LEU 222.A O no hydrogen 3.370 N/A LYS 221.A NZ ASP 257.A OD2 no hydrogen 3.045 N/A LEU 222.A N ASP 257.A O no hydrogen 3.266 N/A GLY 223.A N SER 11.A O no hydrogen 3.254 N/A ARG 226.A NH2 ASP 409.A OD2 no hydrogen 2.385 N/A CYS 230.A SG GLU 307.A O no hydrogen 3.119 N/A TYR 231.A N PHE 255.A O no hydrogen 2.924 N/A LEU 232.A N GLU 307.A O no hydrogen 3.033 N/A GLY 233.A N GLN 253.A O no hydrogen 2.876 N/A VAL 235.A N ALA 251.A O no hydrogen 2.912 N/A LYS 237.A N CYS 249.A O no hydrogen 2.901 N/A LYS 237.A NZ LYS 238.A O no hydrogen 3.344 N/A LYS 241.A NZ GLU 240.A OE1 no hydrogen 2.335 N/A SER 242.A OG ILE 239.A O no hydrogen 2.939 N/A SER 242.A OG ASN 244.A O no hydrogen 2.984 N/A SER 242.A OG ASN 247.A OD1 no hydrogen 2.502 N/A ASN 244.A N ASN 244.A OD1 no hydrogen 2.439 N/A GLN 246.A N GLN 246.A OE1 no hydrogen 2.230 N/A ALA 248.A N GLY 269.A O no hydrogen 2.560 N/A CYS 249.A N LYS 237.A O no hydrogen 2.882 N/A ALA 251.A N VAL 235.A O no hydrogen 2.892 N/A ALA 252.A N PHE 264.A O no hydrogen 2.935 N/A GLN 253.A N GLY 233.A O no hydrogen 2.888 N/A GLN 253.A NE2 THR 430.A O no hydrogen 2.881 N/A MET 254.A N THR 262.A O no hydrogen 2.902 N/A PHE 255.A N TYR 231.A O no hydrogen 2.899 N/A ASP 260.A N ASN 258.A OD1 no hydrogen 2.934 N/A THR 262.A N MET 254.A O no hydrogen 2.911 N/A VAL 263.A N LEU 452.A O no hydrogen 3.305 N/A PHE 264.A N ALA 252.A O no hydrogen 2.855 N/A LYS 265.A NZ THR 445.A O no hydrogen 2.908 N/A GLY 266.A N CYS 250.A O no hydrogen 2.974 N/A GLY 269.A N ALA 248.A O no hydrogen 3.007 N/A TRP 271.A NE1 GLU 285.A OE2 no hydrogen 2.764 N/A TYR 272.A N GLN 246.A O no hydrogen 2.531 N/A LYS 276.A N ASN 273.A OD1 no hydrogen 2.645 N/A LYS 276.A NZ GLU 278.A OE2 no hydrogen 3.002 N/A GLY 277.A N ASN 273.A O no hydrogen 2.823 N/A LEU 281.A N GLU 320.A OE2 no hydrogen 2.449 N/A LYS 282.A NZ PRO 270.A O no hydrogen 2.531 N/A LYS 284.A NZ LYS 284.A O no hydrogen 2.474 N/A GLU 285.A N GLU 285.A OE1 no hydrogen 2.694 N/A ALA 286.A N LYS 282.A O no hydrogen 3.140 N/A LYS 287.A N PRO 283.A O no hydrogen 2.901 N/A ALA 288.A N LYS 284.A O no hydrogen 2.923 N/A LEU 289.A N GLU 285.A O no hydrogen 2.890 N/A LEU 290.A N ALA 286.A O no hydrogen 2.947 N/A THR 291.A N LYS 287.A O no hydrogen 2.884 N/A THR 291.A OG1 LYS 287.A O no hydrogen 2.664 N/A THR 291.A OG1 ALA 288.A O no hydrogen 2.553 N/A GLN 292.A N ALA 288.A O no hydrogen 2.906 N/A ALA 293.A N LEU 289.A O no hydrogen 2.956 N/A LEU 294.A N LEU 290.A O no hydrogen 2.884 N/A GLU 295.A N THR 291.A O no hydrogen 2.885 N/A SER 296.A N GLN 292.A O no hydrogen 2.915 N/A TYR 297.A N ALA 293.A O no hydrogen 2.953 N/A LYS 298.A N LEU 294.A O no hydrogen 2.891 N/A GLU 299.A N GLU 295.A O no hydrogen 2.893 N/A GLN 300.A N SER 296.A O no hydrogen 2.916 N/A LYS 302.A NZ GLU 299.A O no hydrogen 2.454 N/A SER 303.A OG TYR 304.A O no hydrogen 3.554 N/A ILE 310.A N VAL 335.A O no hydrogen 3.420 N/A ARG 315.A NH1 ASN 397.A OD1 no hydrogen 2.408 N/A GLU 319.A N GLU 319.A OE1 no hydrogen 3.149 N/A ASN 322.A N ASP 318.A O no hydrogen 2.899 N/A ALA 323.A N GLU 319.A O no hydrogen 2.926 N/A PHE 324.A N GLU 320.A O no hydrogen 2.929 N/A ASN 325.A N TRP 321.A O no hydrogen 2.868 N/A GLU 326.A N ASN 322.A O no hydrogen 2.921 N/A VAL 327.A N ALA 323.A O no hydrogen 2.940 N/A THR 328.A N PHE 324.A O no hydrogen 2.957 N/A THR 328.A OG1 PHE 324.A O no hydrogen 3.183 N/A THR 328.A OG1 ASN 325.A O no hydrogen 3.210 N/A THR 332.A OG1 PRO 329.A O no hydrogen 2.259 N/A GLY 336.A N LYS 398.A O no hydrogen 2.887 N/A VAL 337.A N ILE 310.A O no hydrogen 3.134 N/A THR 338.A N GLU 395.A O no hydrogen 2.492 N/A THR 338.A OG1 THR 314.A O no hydrogen 2.398 N/A ILE 339.A N ALA 312.A O no hydrogen 2.751 N/A THR 340.A N PHE 393.A O no hydrogen 2.679 N/A SER 342.A N THR 340.A OG1 no hydrogen 3.342 N/A THR 350.A OG1 GLU 351.A OE1 no hydrogen 3.141 N/A THR 350.A OG1 GLU 351.A OE2 no hydrogen 3.155 N/A ARG 358.A NH1 GLU 9.A OE2 no hydrogen 2.444 N/A GLY 359.A N TRP 372.A O no hydrogen 2.315 N/A ALA 361.A N ILE 5.A O no hydrogen 2.566 N/A TYR 362.A N PHE 370.A O no hydrogen 2.889 N/A VAL 364.A N LYS 368.A O no hydrogen 3.284 N/A ASP 365.A N LYS 368.A O no hydrogen 3.407 N/A LYS 367.A N ASP 365.A OD1 no hydrogen 2.713 N/A LYS 368.A N ASP 365.A OD1 no hydrogen 2.332 N/A LYS 368.A NZ ASP 365.A OD2 no hydrogen 2.349 N/A ALA 369.A N ILE 394.A O no hydrogen 2.902 N/A PHE 370.A N TYR 362.A O no hydrogen 2.886 N/A LEU 371.A N ILE 392.A O no hydrogen 2.919 N/A TRP 372.A N ASN 360.A O no hydrogen 2.877 N/A THR 373.A OG1 GLY 426.A O no hydrogen 2.947 N/A PHE 376.A N ILE 356.A O no hydrogen 2.777 N/A VAL 377.A N SER 382.A O no hydrogen 2.826 N/A LYS 379.A NZ ASP 22.A OD2 no hydrogen 2.394 N/A LYS 379.A NZ ASP 25.A OD2 no hydrogen 2.924 N/A GLN 381.A N VAL 377.A O no hydrogen 2.980 N/A GLN 381.A NE2 PRO 378.A O no hydrogen 2.837 N/A THR 383.A OG1 SER 385.A O no hydrogen 2.436 N/A LEU 384.A N GLY 375.A O no hydrogen 3.081 N/A SER 385.A OG THR 383.A OG1 no hydrogen 2.788 N/A SER 385.A OG GLU 387.A O no hydrogen 3.038 N/A ILE 392.A N LEU 371.A O no hydrogen 2.891 N/A PHE 393.A N THR 340.A O no hydrogen 2.396 N/A ILE 394.A N ALA 369.A O no hydrogen 2.906 N/A GLU 395.A N THR 338.A O no hydrogen 2.588 N/A ILE 396.A N LYS 367.A O no hydrogen 2.575 N/A LYS 398.A N GLY 336.A O no hydrogen 2.941 N/A LYS 398.A NZ PHE 316.A O no hydrogen 2.973 N/A GLN 405.A N GLU 402.A OE1 no hydrogen 2.587 N/A VAL 406.A N GLU 402.A O no hydrogen 3.115 N/A LEU 407.A N ILE 403.A O no hydrogen 2.934 N/A LYS 408.A N GLN 404.A O no hydrogen 2.917 N/A LYS 408.A NZ GLN 404.A O no hydrogen 3.161 N/A LYS 408.A NZ GLN 405.A OE1 no hydrogen 2.397 N/A ASP 409.A N GLN 405.A O no hydrogen 2.916 N/A ILE 410.A N VAL 406.A O no hydrogen 2.852 N/A LEU 411.A N LEU 407.A O no hydrogen 2.970 N/A ALA 412.A N LYS 408.A O no hydrogen 2.943 N/A LEU 413.A N ASP 409.A O no hydrogen 2.887 N/A THR 414.A N ILE 410.A O no hydrogen 2.889 N/A THR 414.A OG1 LEU 411.A O no hydrogen 2.565 N/A LYS 415.A N LEU 411.A O no hydrogen 2.992 N/A LEU 416.A N LEU 413.A O no hydrogen 3.215 N/A TYR 418.A OH TRP 220.A O no hydrogen 2.166 N/A TYR 418.A OH ASN 258.A O no hydrogen 2.621 N/A ASN 419.A N ASN 417.A OD1 no hydrogen 3.235 N/A CYS 421.A N THR 206.A OG1 no hydrogen 3.309 N/A CYS 421.A SG THR 209.A OG1 no hydrogen 3.311 N/A TYR 423.A OH THR 21.A OG1 no hydrogen 2.745 N/A LEU 431.A N PRO 428.A O no hydrogen 2.841 N/A ARG 432.A N VAL 429.A O no hydrogen 3.081 N/A ALA 434.A N LEU 431.A O no hydrogen 3.364 N/A ILE 437.A N PHE 433.A O no hydrogen 2.498 N/A GLY 438.A N ALA 434.A O no hydrogen 2.884 N/A GLU 439.A N ASN 435.A O no hydrogen 2.922 N/A ILE 440.A N LYS 436.A O no hydrogen 2.903 N/A LEU 441.A N ILE 437.A O no hydrogen 2.884 N/A THR 442.A N GLY 438.A O no hydrogen 2.934 N/A ALA 443.A N GLU 439.A O no hydrogen 2.911 N/A ALA 443.A N ILE 440.A O no hydrogen 3.237 N/A SER 444.A N ILE 440.A O no hydrogen 3.300 N/A SER 444.A OG SER 444.A O no hydrogen 2.392 N/A THR 445.A OG1 GLU 446.A OE1 no hydrogen 2.988 N/A GLU 446.A N GLU 446.A OE1 no hydrogen 2.673 N/A