Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6sh8_J.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 1.A N ASP 214.A O no hydrogen 2.957 N/A GLU 2.A N LEU 213.A O no hydrogen 2.807 N/A LEU 4.A N ILE 211.A O no hydrogen 2.950 N/A SER 6.A N LYS 260.A O no hydrogen 3.028 N/A LYS 10.A NZ SER 255.A OG no hydrogen 2.953 N/A ALA 11.A N VAL 205.A O no hydrogen 2.593 N/A TYR 13.A OH GLU 339.A OE2 no hydrogen 3.040 N/A THR 16.A OG1 LEU 31.A O no hydrogen 2.430 N/A GLY 18.A N HIS 22.A O no hydrogen 3.080 N/A ASN 20.A ND2 ILE 24.A O no hydrogen 3.000 N/A ASN 20.A ND2 GLU 197.A OE1 no hydrogen 2.230 N/A ARG 21.A N GLY 18.A O no hydrogen 2.749 N/A SER 23.A OG GLU 30.A O no hydrogen 3.510 N/A ASN 25.A N TYR 28.A O no hydrogen 3.261 N/A PHE 27.A N ASN 25.A OD1 no hydrogen 3.122 N/A TYR 28.A N ASN 25.A OD1 no hydrogen 2.676 N/A GLU 30.A N SER 23.A O no hydrogen 3.088 N/A ILE 37.A N ARG 33.A O no hydrogen 3.183 N/A LYS 38.A N PRO 34.A O no hydrogen 2.930 N/A GLY 39.A N THR 35.A O no hydrogen 2.921 N/A LEU 40.A N GLU 36.A O no hydrogen 2.891 N/A TRP 41.A N ILE 37.A O no hydrogen 2.864 N/A TRP 41.A NE1 ALA 230.A O no hydrogen 2.939 N/A ARG 42.A N LYS 38.A O no hydrogen 2.941 N/A ARG 42.A NH1 GLY 75.A O no hydrogen 3.309 N/A TRP 43.A N GLY 39.A O no hydrogen 2.944 N/A TRP 44.A N LEU 40.A O no hydrogen 2.872 N/A ASN 45.A N TRP 41.A O no hydrogen 2.892 N/A ARG 46.A N ARG 42.A O no hydrogen 2.952 N/A ARG 46.A NH1 ASP 67.A OD1 no hydrogen 3.532 N/A ARG 46.A NH1 ASP 67.A OD2 no hydrogen 3.569 N/A VAL 47.A N TRP 43.A O no hydrogen 2.954 N/A LEU 48.A N TRP 44.A O no hydrogen 2.835 N/A PHE 49.A N ASN 45.A O no hydrogen 2.911 N/A ASN 50.A ND2 TYR 61.A O no hydrogen 3.335 N/A THR 51.A N VAL 47.A O no hydrogen 2.928 N/A THR 51.A OG1 VAL 47.A O no hydrogen 3.035 N/A LEU 52.A N LEU 48.A O no hydrogen 2.921 N/A ALA 53.A N PHE 49.A O no hydrogen 2.862 N/A TYR 54.A N THR 51.A O no hydrogen 3.285 N/A SER 55.A N THR 51.A O no hydrogen 2.961 N/A SER 55.A OG LEU 52.A O no hydrogen 3.261 N/A THR 56.A N LEU 52.A O no hydrogen 3.038 N/A THR 56.A OG1 LEU 52.A O no hydrogen 3.350 N/A LYS 57.A NZ GLU 308.A OE2 no hydrogen 3.502 N/A GLY 58.A N TYR 54.A O no hydrogen 2.885 N/A LEU 60.A N GLU 314.A OE1 no hydrogen 3.320 N/A THR 62.A N SER 313.A O no hydrogen 2.986 N/A THR 62.A OG1 SER 65.A OG no hydrogen 2.402 N/A SER 65.A OG THR 62.A O no hydrogen 2.425 N/A SER 65.A OG THR 62.A OG1 no hydrogen 2.402 N/A ILE 66.A N THR 62.A O no hydrogen 3.084 N/A ASP 67.A N TYR 63.A O no hydrogen 2.917 N/A ARG 68.A N GLU 64.A O no hydrogen 2.863 N/A LEU 69.A N SER 65.A O no hydrogen 2.928 N/A PHE 70.A N ILE 66.A O no hydrogen 2.927 N/A VAL 73.A N PHE 70.A O no hydrogen 2.854 N/A PHE 74.A N PHE 70.A O no hydrogen 2.905 N/A GLY 75.A N GLU 71.A O no hydrogen 2.943 N/A SER 76.A N LYS 79.A O no hydrogen 2.749 N/A GLU 77.A N GLU 77.A OE1 no hydrogen 2.438 N/A ASN 78.A N SER 76.A OG no hydrogen 3.002 N/A LYS 79.A N SER 76.A O no hydrogen 3.335 N/A SER 81.A OG VAL 73.A O no hydrogen 3.451 N/A SER 81.A OG VAL 83.A O no hydrogen 3.148 N/A ALA 82.A N VAL 73.A O no hydrogen 3.279 N/A ARG 84.A N TYR 212.A O no hydrogen 2.956 N/A ARG 84.A NE GLU 1.A OE2 no hydrogen 3.037 N/A ARG 84.A NH1 GLU 86.A OE1 no hydrogen 3.298 N/A GLU 86.A N ASN 210.A O no hydrogen 3.266 N/A ILE 88.A N THR 208.A O no hydrogen 3.299 N/A PHE 97.A N ASN 25.A O no hydrogen 3.002 N/A GLU 98.A N ASN 144.A OD1 no hydrogen 2.452 N/A SER 100.A N LYS 142.A O no hydrogen 3.038 N/A ASP 109.A N ASP 105.A O no hydrogen 2.931 N/A CYS 110.A N LYS 106.A O no hydrogen 3.108 N/A CYS 110.A SG LYS 106.A O no hydrogen 3.216 N/A LEU 111.A N ILE 108.A O no hydrogen 2.732 N/A ASN 113.A N ALA 175.A O no hydrogen 2.881 N/A ARG 116.A N ILE 173.A O no hydrogen 2.843 N/A VAL 118.A N VAL 171.A O no hydrogen 2.974 N/A SER 119.A N GLU 130.A O no hydrogen 3.197 N/A SER 119.A OG SER 170.A OG no hydrogen 3.197 N/A PHE 122.A N TYR 195.A OH no hydrogen 3.212 N/A ILE 123.A N THR 126.A O no hydrogen 2.739 N/A THR 126.A N ILE 123.A O no hydrogen 3.223 N/A THR 126.A OG1 ILE 123.A O no hydrogen 2.531 N/A ILE 128.A N ASP 121.A O no hydrogen 2.947 N/A ALA 129.A N ILE 137.A O no hydrogen 2.836 N/A GLU 132.A N LYS 117.A O no hydrogen 3.014 N/A SER 134.A N GLU 132.A O no hydrogen 2.585 N/A THR 135.A OG1 GLY 133.A O no hydrogen 2.643 N/A ILE 139.A N LEU 127.A O no hydrogen 2.974 N/A LYS 142.A N TYR 101.A O no hydrogen 2.874 N/A LYS 142.A NZ SER 100.A OG no hydrogen 3.416 N/A ASN 144.A N GLU 98.A O no hydrogen 3.003 N/A ASN 144.A ND2 ARG 96.A O no hydrogen 2.772 N/A LEU 145.A N SER 143.A OG no hydrogen 2.812 N/A ASP 146.A N ASP 146.A OD1 no hydrogen 2.418 N/A LYS 149.A NZ ASP 153.A OD2 no hydrogen 2.557 N/A ILE 150.A N ASP 148.A OD2 no hydrogen 2.495 N/A LYS 152.A N ASP 148.A O no hydrogen 3.069 N/A LYS 152.A NZ ILE 147.A O no hydrogen 2.419 N/A ASP 153.A N LYS 149.A O no hydrogen 2.923 N/A LEU 154.A N ILE 150.A O no hydrogen 2.875 N/A VAL 155.A N ILE 151.A O no hydrogen 2.947 N/A HIS 156.A N LYS 152.A O no hydrogen 2.901 N/A ASN 157.A N ASP 153.A O no hydrogen 2.869 N/A ASN 158.A N LEU 154.A O no hydrogen 3.008 N/A LEU 160.A N ASN 158.A OD1 no hydrogen 2.966 N/A SER 162.A N ASN 158.A O no hydrogen 3.208 N/A SER 162.A OG ASN 158.A O no hydrogen 2.813 N/A PHE 163.A N LEU 160.A O no hydrogen 2.837 N/A GLU 164.A N LEU 160.A O no hydrogen 3.120 N/A LEU 166.A N PHE 163.A O no hydrogen 2.903 N/A SER 170.A OG SER 119.A OG no hydrogen 3.197 N/A VAL 171.A N VAL 118.A O no hydrogen 2.909 N/A ILE 173.A N ARG 116.A O no hydrogen 3.325 N/A THR 176.A OG1 ASP 174.A OD2 no hydrogen 3.530 N/A SER 179.A OG LYS 177.A O no hydrogen 2.810 N/A LYS 181.A NZ ASP 109.A OD2 no hydrogen 2.498 N/A LYS 182.A NZ ASP 180.A OD2 no hydrogen 3.262 N/A ILE 187.A N ILE 183.A O no hydrogen 2.912 N/A LEU 188.A N LEU 184.A O no hydrogen 2.940 N/A ARG 189.A N LYS 185.A O no hydrogen 2.869 N/A ARG 189.A NH2 LEU 99.A O no hydrogen 3.063 N/A ASP 190.A N GLU 186.A O no hydrogen 2.902 N/A LEU 191.A N ILE 187.A O no hydrogen 2.996 N/A ILE 192.A N LEU 188.A O no hydrogen 2.878 N/A THR 193.A N ARG 189.A O no hydrogen 2.858 N/A THR 193.A OG1 ARG 189.A O no hydrogen 2.420 N/A ASN 194.A N ASP 190.A O no hydrogen 2.938 N/A TYR 195.A N LEU 191.A O no hydrogen 2.981 N/A LEU 196.A N ILE 192.A O no hydrogen 2.859 N/A GLU 197.A N THR 193.A O no hydrogen 2.892 N/A TYR 198.A N ASN 194.A O no hydrogen 3.001 N/A TYR 198.A OH GLU 164.A OE2 no hydrogen 2.321 N/A PHE 199.A N LEU 196.A O no hydrogen 2.815 N/A ASN 200.A N GLU 197.A O no hydrogen 3.442 N/A ASN 200.A ND2 SER 23.A OG no hydrogen 3.392 N/A ASN 210.A N GLU 86.A O no hydrogen 2.852 N/A ILE 211.A N MET 5.A O no hydrogen 3.026 N/A TYR 212.A N ARG 84.A O no hydrogen 3.057 N/A LEU 213.A N GLU 2.A O no hydrogen 2.719 N/A LYS 215.A NZ GLU 2.A OE2 no hydrogen 2.815 N/A SER 216.A N ASP 214.A OD1 no hydrogen 3.291 N/A ARG 217.A NH1 ASP 214.A OD2 no hydrogen 2.622 N/A LYS 226.A N ASN 222.A O no hydrogen 3.072 N/A LYS 226.A NZ LEU 69.A O no hydrogen 3.423 N/A LYS 226.A NZ ASP 72.A OD2 no hydrogen 2.240 N/A LEU 227.A N PHE 223.A O no hydrogen 2.861 N/A LYS 228.A N GLU 224.A O no hydrogen 2.922 N/A LYS 228.A NZ SER 265.A O no hydrogen 3.542 N/A LYS 228.A NZ ILE 266.A O no hydrogen 2.652 N/A PHE 229.A N ASP 225.A O no hydrogen 2.945 N/A ALA 230.A N LYS 226.A O no hydrogen 2.888 N/A LEU 231.A N LEU 227.A O no hydrogen 2.922 N/A TYR 232.A N LYS 228.A O no hydrogen 2.939 N/A SER 233.A N PHE 229.A O no hydrogen 2.916 N/A LEU 234.A N ALA 230.A O no hydrogen 2.882 N/A LEU 235.A N LEU 231.A O no hydrogen 2.984 N/A VAL 236.A N TYR 232.A O no hydrogen 2.903 N/A PHE 237.A N SER 233.A O no hydrogen 2.834 N/A ILE 238.A N LEU 234.A O no hydrogen 2.949 N/A LEU 239.A N LEU 235.A O no hydrogen 2.926 N/A LEU 239.A N VAL 236.A O no hydrogen 3.205 N/A LEU 240.A N VAL 236.A O no hydrogen 2.846 N/A GLY 241.A N PHE 237.A O no hydrogen 2.984 N/A ILE 243.A N GLY 252.A O no hydrogen 3.139 N/A ARG 245.A N LEU 15.A O no hydrogen 3.469 N/A ARG 245.A NE GLU 164.A OE1 no hydrogen 3.141 N/A ARG 245.A NE GLU 164.A OE2 no hydrogen 3.460 N/A ARG 245.A NH1 GLU 164.A OE2 no hydrogen 3.358 N/A ARG 249.A N LYS 246.A O no hydrogen 2.948 N/A ARG 249.A NH1 SER 248.A O no hydrogen 2.395 N/A ARG 249.A NH1 LEU 423.A O no hydrogen 2.781 N/A ARG 249.A NH2 SER 421.A OG no hydrogen 3.157 N/A GLY 250.A N THR 247.A O no hydrogen 3.352 N/A GLY 252.A N LEU 12.A O no hydrogen 2.931 N/A SER 253.A OG GLY 250.A O no hydrogen 2.135 N/A SER 255.A N LYS 10.A O no hydrogen 3.039 N/A ILE 257.A N LYS 8.A O no hydrogen 2.858 N/A ASP 258.A N LYS 8.A O no hydrogen 3.392 N/A LYS 260.A N SER 6.A O no hydrogen 3.178 N/A LYS 260.A NZ CYS 261.A O no hydrogen 2.235 N/A CYS 261.A SG LEU 4.A O no hydrogen 3.067 N/A TYR 262.A N LEU 4.A O no hydrogen 3.493 N/A SER 265.A OG ASP 263.A OD2 no hydrogen 3.086 N/A ILE 266.A N ASP 263.A O no hydrogen 3.230 N/A CYS 267.A N ASN 264.A O no hydrogen 3.000 N/A CYS 267.A SG ASP 263.A O no hydrogen 3.101 N/A LYS 268.A N ASN 264.A O no hydrogen 2.917 N/A GLU 271.A N CYS 267.A O no hydrogen 2.884 N/A ASP 272.A N LYS 268.A O no hydrogen 2.934 N/A LEU 273.A N LYS 269.A O no hydrogen 2.918 N/A ALA 274.A N ILE 270.A O no hydrogen 2.905 N/A LYS 275.A N GLU 271.A O no hydrogen 2.853 N/A LYS 275.A NZ GLU 271.A OE2 no hydrogen 3.027 N/A ASN 276.A N ASP 272.A O no hydrogen 2.982 N/A PHE 277.A N ALA 274.A O no hydrogen 2.571 N/A LEU 278.A N LYS 275.A O no hydrogen 3.065 N/A ILE 280.A N ASP 430.A OD2 no hydrogen 2.412 N/A SER 281.A N GLU 285.A OE2 no hydrogen 3.020 N/A SER 281.A OG GLU 285.A OE2 no hydrogen 2.279 N/A ASN 284.A N SER 282.A OG no hydrogen 2.969 N/A GLU 285.A N SER 282.A O no hydrogen 3.356 N/A LEU 286.A N SER 282.A O no hydrogen 3.337 N/A SER 288.A OG GLU 285.A O no hydrogen 2.681 N/A LYS 289.A N GLU 285.A O no hydrogen 2.878 N/A LYS 289.A NZ ASN 276.A O no hydrogen 2.393 N/A ILE 290.A N LEU 286.A O no hydrogen 2.878 N/A GLU 291.A N LYS 287.A O no hydrogen 2.945 N/A SER 292.A N SER 288.A O no hydrogen 2.853 N/A SER 292.A OG SER 288.A O no hydrogen 3.134 N/A SER 292.A OG LYS 289.A O no hydrogen 2.332 N/A LEU 294.A N ILE 290.A O no hydrogen 2.930 N/A ASP 295.A N GLU 291.A O no hydrogen 2.898 N/A CYS 296.A N SER 292.A O no hydrogen 2.885 N/A CYS 296.A SG ILE 293.A O no hydrogen 3.315 N/A ILE 297.A N ILE 293.A O no hydrogen 3.173 N/A ASN 299.A N ASP 295.A O no hydrogen 3.160 N/A ASN 299.A N CYS 296.A O no hydrogen 2.791 N/A SER 300.A N ASP 303.A OD1 no hydrogen 3.111 N/A SER 300.A N ASP 303.A OD2 no hydrogen 2.360 N/A ASN 309.A N TYR 306.A O no hydrogen 3.274 N/A SER 313.A OG GLU 314.A O no hydrogen 3.476 N/A ASP 316.A N ASN 320.A OD1 no hydrogen 3.355 N/A LYS 319.A N ASP 316.A O no hydrogen 2.365 N/A ASN 320.A N ASP 316.A O no hydrogen 2.742 N/A TYR 323.A N TYR 63.A OH no hydrogen 3.298 N/A PHE 324.A N HIS 443.A O no hydrogen 2.810 N/A ILE 325.A N THR 51.A OG1 no hydrogen 2.466 N/A SER 327.A OG GLU 291.A OE1 no hydrogen 2.410 N/A SER 327.A OG GLU 291.A OE2 no hydrogen 3.362 N/A SER 327.A OG ASP 295.A OD1 no hydrogen 3.213 N/A GLU 331.A N GLY 439.A O no hydrogen 3.009 N/A LYS 333.A N LEU 437.A O no hydrogen 2.855 N/A ARG 334.A NH1 SER 281.A O no hydrogen 3.446 N/A ILE 335.A N SER 435.A O no hydrogen 3.030 N/A GLU 339.A N GLU 339.A OE1 no hydrogen 2.712 N/A LEU 342.A N LYS 338.A O no hydrogen 2.914 N/A ALA 343.A N GLU 339.A O no hydrogen 2.920 N/A ASN 344.A N VAL 341.A O no hydrogen 2.829 N/A ILE 345.A N VAL 341.A O no hydrogen 3.199 N/A LYS 347.A N ASN 344.A O no hydrogen 2.666 N/A ALA 348.A N ILE 345.A O no hydrogen 3.164 N/A VAL 349.A N TYR 346.A O no hydrogen 3.266 N/A SER 350.A N TYR 346.A O no hydrogen 3.290 N/A GLY 353.A N SER 350.A O no hydrogen 3.251 N/A CYS 355.A N LYS 347.A O no hydrogen 3.167 N/A ILE 356.A N GLY 353.A O no hydrogen 2.800 N/A LYS 357.A N GLY 353.A O no hydrogen 2.894 N/A SER 358.A OG CYS 354.A O no hydrogen 2.976 N/A ILE 359.A N ILE 356.A O no hydrogen 3.027 N/A ILE 360.A N ILE 356.A O no hydrogen 2.976 N/A THR 361.A N ILE 356.A O no hydrogen 3.510 N/A THR 361.A OG1 ILE 360.A O no hydrogen 2.663 N/A ARG 366.A N ASP 362.A O no hydrogen 3.096 N/A ARG 366.A NH1 SER 351.A O no hydrogen 2.359 N/A SER 368.A OG TYR 364.A O no hydrogen 3.221 N/A SER 368.A OG VAL 365.A O no hydrogen 2.881 N/A PHE 369.A N VAL 365.A O no hydrogen 2.906 N/A LEU 370.A N ARG 366.A O no hydrogen 2.915 N/A ILE 371.A N LYS 367.A O no hydrogen 2.893 N/A ALA 372.A N SER 368.A O no hydrogen 2.927 N/A PHE 373.A N PHE 369.A O no hydrogen 2.580 N/A ARG 377.A NH1 GLY 374.A O no hydrogen 2.317 N/A ARG 377.A NH1 TYR 376.A O no hydrogen 3.279 N/A TYR 385.A N ILE 382.A O no hydrogen 2.913 N/A LEU 386.A N LYS 383.A O no hydrogen 2.915 N/A CYS 387.A N LYS 383.A O no hydrogen 2.737 N/A CYS 387.A SG LYS 383.A O no hydrogen 3.339 N/A CYS 387.A SG ASN 384.A O no hydrogen 3.086 N/A GLU 388.A N PHE 401.A O no hydrogen 2.714 N/A CYS 390.A SG ASN 384.A O no hydrogen 3.836 N/A CYS 390.A SG CYS 387.A O no hydrogen 3.107 N/A CYS 390.A SG ASN 397.A OD1 no hydrogen 3.918 N/A GLU 391.A N GLU 391.A OE1 no hydrogen 2.480 N/A THR 392.A OG1 CYS 390.A O no hydrogen 2.822 N/A PHE 396.A N SER 394.A O no hydrogen 2.715 N/A ILE 398.A N LEU 386.A O no hydrogen 2.910 N/A VAL 399.A N TYR 446.A O no hydrogen 2.475 N/A PHE 401.A N ILE 398.A O no hydrogen 3.250 N/A SER 404.A N LEU 402.A O no hydrogen 3.106 N/A SER 404.A OG LEU 403.A O no hydrogen 2.384 N/A SER 407.A OG ASP 400.A OD1 no hydrogen 2.114 N/A PHE 408.A N SER 407.A OG no hydrogen 2.441 N/A SER 410.A OG GLU 405.A O no hydrogen 3.064 N/A ASP 411.A N PHE 408.A O no hydrogen 2.942 N/A TYR 412.A N PHE 408.A O no hydrogen 2.888 N/A GLN 415.A N ASP 411.A O no hydrogen 2.192 N/A ARG 419.A NH2 ILE 371.A O no hydrogen 2.314 N/A SER 421.A OG LEU 423.A O no hydrogen 2.860 N/A ARG 424.A N TYR 440.A O no hydrogen 3.038 N/A ARG 424.A NE TYR 440.A OH no hydrogen 3.100 N/A ARG 424.A NH1 THR 247.A OG1 no hydrogen 3.416 N/A LYS 426.A NZ GLY 241.A O no hydrogen 3.313 N/A LYS 426.A NZ LEU 254.A O no hydrogen 2.709 N/A LEU 427.A N SER 253.A OG no hydrogen 3.222 N/A ILE 428.A N TYR 436.A O no hydrogen 2.928 N/A ASN 431.A ND2 LEU 278.A O no hydrogen 3.539 N/A SER 432.A OG ASP 430.A O no hydrogen 3.121 N/A SER 432.A OG ASN 431.A OD1 no hydrogen 2.736 N/A TYR 436.A N ILE 428.A O no hydrogen 2.870 N/A ILE 438.A N LYS 426.A O no hydrogen 2.703 N/A GLY 439.A N GLU 331.A O no hydrogen 3.307 N/A TYR 440.A N ARG 424.A O no hydrogen 2.925 N/A TYR 440.A OH LEU 240.A O no hydrogen 2.354 N/A ILE 441.A N LEU 329.A O no hydrogen 3.175 N/A LEU 442.A N LEU 422.A O no hydrogen 3.039 N/A HIS 443.A ND1 SER 444.A O no hydrogen 2.791 N/A SER 445.A OG ASN 320.A O no hydrogen 3.507 N/A TYR 446.A OH ALA 372.A O no hydrogen 3.087 N/A LYS 448.A N ASN 397.A O no hydrogen 3.050 N/A VAL 455.A N ASP 451.A O no hydrogen 2.816 N/A ARG 456.A N ILE 452.A O no hydrogen 2.851 N/A CYS 457.A N LYS 453.A O no hydrogen 2.928 N/A CYS 457.A SG LYS 453.A O no hydrogen 3.504 N/A ILE 458.A N TYR 454.A O no hydrogen 2.961 N/A LEU 459.A N VAL 455.A O no hydrogen 2.822 N/A GLU 460.A N ARG 456.A O no hydrogen 2.914 N/A LYS 461.A N CYS 457.A O no hydrogen 2.929 N/A LEU 462.A N ILE 458.A O no hydrogen 2.900 N/A THR 463.A N LEU 459.A O no hydrogen 2.881 N/A THR 463.A OG1 LEU 459.A O no hydrogen 2.323 N/A TYR 464.A N GLU 460.A O no hydrogen 2.902 N/A CYS 465.A N LYS 461.A O no hydrogen 2.898 N/A VAL 466.A N LEU 462.A O no hydrogen 2.765 N/A ILE 467.A N TYR 464.A O no hydrogen 3.096 N/A