Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8wy4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N THR 86.A OG1 no hydrogen 3.142 N/A LYS 2.A N LEU 75.A O no hydrogen 3.149 N/A LYS 2.A NZ ASP 22.A OD1 no hydrogen 3.177 N/A SER 4.A N THR 74.A O no hydrogen 3.076 N/A SER 4.A OG LYS 2.A O no hydrogen 3.306 N/A SER 4.A OG ASP 76.A OD2 no hydrogen 2.370 N/A ILE 6.A N ILE 19.A O no hydrogen 3.200 N/A THR 7.A N ILE 72.A O no hydrogen 2.760 N/A LYS 9.A N GLU 70.A O no hydrogen 3.073 N/A ILE 19.A N ILE 6.A O no hydrogen 3.309 N/A LEU 21.A N SER 4.A O no hydrogen 2.614 N/A ASP 22.A N ASN 25.A OD1 no hydrogen 3.157 N/A LYS 24.A NZ LEU 182.A O no hydrogen 3.007 N/A LYS 24.A NZ GLN 185.A O no hydrogen 3.515 N/A LYS 24.A NZ TYR 188.A O no hydrogen 2.771 N/A ASN 25.A N PHE 191.A O no hydrogen 3.174 N/A ASN 25.A ND2 ASP 22.A O no hydrogen 2.618 N/A VAL 26.A N ARG 208.A O no hydrogen 2.733 N/A ILE 27.A N LEU 193.A O no hydrogen 2.709 N/A PHE 28.A N ILE 210.A O no hydrogen 2.759 N/A GLY 34.A N ASN 31.A OD1 no hydrogen 3.483 N/A LYS 35.A N ASN 31.A O no hydrogen 3.449 N/A THR 36.A N ASP 32.A O no hydrogen 2.960 N/A THR 36.A OG1 ASP 32.A O no hydrogen 2.512 N/A ASN 37.A N ILE 33.A O no hydrogen 2.906 N/A PHE 38.A N GLY 34.A O no hydrogen 2.952 N/A TYR 40.A N THR 36.A O no hydrogen 2.986 N/A ALA 41.A N ASN 37.A O no hydrogen 2.891 N/A LEU 42.A N PHE 38.A O no hydrogen 3.051 N/A ARG 43.A N LEU 39.A O no hydrogen 2.910 N/A PHE 44.A N TYR 40.A O no hydrogen 2.900 N/A LEU 45.A N ALA 41.A O no hydrogen 2.982 N/A LEU 46.A N LEU 42.A O no hydrogen 2.940 N/A ASP 47.A N ARG 43.A O no hydrogen 3.097 N/A ARG 51.A N ASP 47.A O no hydrogen 3.334 N/A ARG 51.A NH2 ASP 146.A OD1 no hydrogen 2.698 N/A LYS 52.A N LYS 48.A O no hydrogen 2.913 N/A GLY 54.A N ARG 51.A O no hydrogen 3.416 N/A LYS 67.A NZ HIS 63.A O no hydrogen 2.697 N/A ILE 71.A N LEU 109.A O no hydrogen 3.358 N/A ILE 72.A N THR 7.A O no hydrogen 3.058 N/A LEU 73.A N ILE 107.A O no hydrogen 2.987 N/A THR 74.A N ASN 5.A O no hydrogen 2.937 N/A THR 74.A OG1 ASN 5.A O no hydrogen 3.225 N/A THR 74.A OG1 ASN 5.A OD1 no hydrogen 2.887 N/A LEU 75.A N PHE 105.A O no hydrogen 3.111 N/A SER 78.A N ASP 103.A O no hydrogen 3.472 N/A SER 78.A OG ALA 102.A O no hydrogen 2.815 N/A SER 78.A OG ASP 103.A OD1 no hydrogen 2.993 N/A ASP 83.A N TYR 80.A O no hydrogen 3.349 N/A THR 86.A N ASP 83.A OD2 no hydrogen 2.863 N/A THR 86.A OG1 ASP 83.A OD2 no hydrogen 2.900 N/A LYS 88.A N GLU 84.A O no hydrogen 2.927 N/A LEU 89.A N ASP 85.A O no hydrogen 2.962 N/A ILE 90.A N THR 86.A O no hydrogen 2.917 N/A SER 91.A N LYS 87.A O no hydrogen 2.932 N/A LYS 94.A NZ VAL 92.A O no hydrogen 3.338 N/A SER 99.A OG ASN 101.A OD1 no hydrogen 3.290 N/A ALA 102.A N SER 99.A O no hydrogen 3.279 N/A TYR 106.A N GLY 127.A O no hydrogen 3.430 N/A ILE 107.A N LEU 73.A O no hydrogen 3.116 N/A ALA 108.A N LYS 125.A O no hydrogen 3.090 N/A LEU 109.A N ILE 71.A O no hydrogen 2.659 N/A GLU 110.A N ILE 123.A O no hydrogen 2.653 N/A SER 111.A OG TYR 60.A OH no hydrogen 3.381 N/A SER 111.A OG LYS 112.A O no hydrogen 2.945 N/A SER 111.A OG GLY 120.A O no hydrogen 3.240 N/A LYS 112.A N GLY 120.A O no hydrogen 3.097 N/A LYS 116.A NZ GLU 117.A OE2 no hydrogen 3.105 N/A ILE 123.A N GLU 110.A O no hydrogen 2.650 N/A LYS 125.A N ALA 108.A O no hydrogen 2.836 N/A LYS 125.A NZ LEU 133.A O no hydrogen 3.159 N/A TRP 126.A N ILE 134.A O no hydrogen 2.834 N/A SER 128.A OG GLU 129.A OE1 no hydrogen 2.390 N/A ILE 134.A N TRP 126.A O no hydrogen 2.760 N/A ILE 136.A N LEU 124.A O no hydrogen 3.509 N/A ASN 143.A N ASP 146.A OD2 no hydrogen 3.270 N/A ASP 146.A N ASN 143.A O no hydrogen 3.310 N/A VAL 148.A N LEU 145.A O no hydrogen 3.234 N/A LYS 150.A N ILE 158.A O no hydrogen 2.819 N/A ILE 152.A N ILE 160.A O no hydrogen 3.172 N/A TYR 153.A OH GLU 164.A OE1 no hydrogen 2.386 N/A ILE 154.A N LEU 162.A O no hydrogen 2.782 N/A ASN 155.A ND2 TYR 153.A OH no hydrogen 2.533 N/A LYS 157.A NZ ASP 146.A O no hydrogen 2.600 N/A LYS 157.A NZ PHE 149.A O no hydrogen 3.518 N/A ILE 158.A N VAL 148.A O no hydrogen 2.965 N/A ILE 160.A N LYS 150.A O no hydrogen 2.895 N/A TYR 161.A N TYR 190.A O no hydrogen 3.024 N/A LEU 162.A N ILE 152.A O no hydrogen 3.003 N/A ILE 163.A N PHE 192.A O no hydrogen 3.164 N/A GLU 164.A N ILE 154.A O no hydrogen 3.106 N/A GLU 165.A N SER 194.A O no hydrogen 3.030 N/A ARG 172.A N HIS 171.A ND1 no hydrogen 3.133 N/A ARG 172.A NE GLU 199.A OE2 no hydrogen 3.430 N/A GLN 175.A N HIS 171.A O no hydrogen 3.341 N/A GLN 175.A NE2 LEU 170.A O no hydrogen 3.151 N/A ILE 176.A N ARG 172.A O no hydrogen 3.098 N/A ALA 177.A N SER 173.A O no hydrogen 2.925 N/A LEU 178.A N MET 174.A O no hydrogen 2.918 N/A SER 179.A N GLN 175.A O no hydrogen 2.977 N/A SER 179.A OG LEU 200.A O no hydrogen 3.159 N/A SER 179.A OG GLU 203.A OE1 no hydrogen 3.566 N/A LYS 180.A N ILE 176.A O no hydrogen 3.010 N/A GLN 181.A N ALA 177.A O no hydrogen 2.949 N/A LEU 182.A N LEU 178.A O no hydrogen 2.884 N/A PHE 183.A N SER 179.A O no hydrogen 3.065 N/A GLU 184.A N LYS 180.A O no hydrogen 3.299 N/A THR 187.A OG1 GLN 185.A OE1 no hydrogen 3.493 N/A TYR 190.A OH ASP 85.A OD2 no hydrogen 3.075 N/A PHE 192.A N TYR 161.A O no hydrogen 3.155 N/A LEU 193.A N ASN 25.A O no hydrogen 3.101 N/A SER 194.A N ILE 163.A O no hydrogen 3.067 N/A THR 195.A OG1 GLU 167.A OE1 no hydrogen 2.940 N/A THR 195.A OG1 SER 197.A O no hydrogen 3.543 N/A HIS 196.A N GLU 167.A OE2 no hydrogen 3.388 N/A HIS 196.A ND1 GLU 165.A OE1 no hydrogen 2.827 N/A HIS 196.A ND1 GLU 165.A OE2 no hydrogen 3.067 N/A SER 197.A N THR 195.A OG1 no hydrogen 3.021 N/A SER 197.A OG GLN 175.A OE1 no hydrogen 2.637 N/A GLU 199.A N SER 197.A OG no hydrogen 3.424 N/A LEU 201.A N PRO 198.A O no hydrogen 3.323 N/A GLU 203.A N SER 179.A OG no hydrogen 3.427 N/A THR 207.A N TYR 225.A O no hydrogen 3.283 N/A THR 207.A OG1 LYS 24.A O no hydrogen 2.396 N/A THR 207.A OG1 ARG 208.A O no hydrogen 3.413 N/A ARG 208.A N LYS 24.A O no hydrogen 3.213 N/A LEU 209.A N HIS 223.A O no hydrogen 3.290 N/A ILE 210.A N VAL 26.A O no hydrogen 2.556 N/A ARG 211.A N SER 221.A O no hydrogen 2.981 N/A ARG 211.A NH1 LEU 299.A O no hydrogen 3.563 N/A VAL 212.A N PHE 28.A O no hydrogen 2.782 N/A HIS 213.A N VAL 219.A O no hydrogen 3.143 N/A HIS 213.A NE2 SER 221.A OG no hydrogen 2.718 N/A SER 214.A OG GLU 249.A OE2 no hydrogen 2.970 N/A THR 215.A OG1 LYS 217.A O no hydrogen 2.378 N/A SER 221.A N ARG 211.A O no hydrogen 3.131 N/A SER 221.A OG HIS 213.A NE2 no hydrogen 2.718 N/A HIS 223.A N LEU 209.A O no hydrogen 3.219 N/A TYR 225.A N THR 207.A O no hydrogen 2.878 N/A TYR 225.A OH ASN 239.A OD1 no hydrogen 2.561 N/A VAL 227.A N ASP 205.A OD1 no hydrogen 3.111 N/A GLU 228.A N GLU 228.A OE1 no hydrogen 2.877 N/A TYR 231.A OH TYR 288.A O no hydrogen 3.209 N/A LYS 235.A NZ ASP 205.A OD2 no hydrogen 2.607 N/A ASN 239.A N LYS 235.A O no hydrogen 2.945 N/A ASN 239.A ND2 MET 204.A O no hydrogen 2.937 N/A LYS 240.A N LYS 236.A O no hydrogen 2.865 N/A ALA 241.A N LYS 237.A O no hydrogen 2.965 N/A LEU 242.A N LEU 238.A O no hydrogen 2.896 N/A SER 243.A N ASN 239.A O no hydrogen 2.880 N/A SER 243.A OG PRO 198.A O no hydrogen 3.514 N/A SER 243.A OG ASN 239.A O no hydrogen 2.564 N/A SER 243.A OG LYS 240.A O no hydrogen 3.178 N/A ALA 245.A N ALA 241.A O no hydrogen 3.047 N/A GLU 249.A N GLY 278.A O no hydrogen 3.252 N/A ARG 250.A N GLY 278.A O no hydrogen 3.099 N/A ARG 250.A NH1 VAL 449.A O no hydrogen 2.837 N/A VAL 251.A N THR 302.A O no hydrogen 3.339 N/A LEU 252.A N PHE 280.A O no hydrogen 2.926 N/A LEU 253.A N ILE 304.A O no hydrogen 2.614 N/A ILE 254.A N LEU 282.A O no hydrogen 2.732 N/A ILE 261.A N PRO 257.A O no hydrogen 2.950 N/A LEU 262.A N SER 258.A O no hydrogen 2.979 N/A PHE 263.A N GLU 259.A O no hydrogen 2.893 N/A GLU 264.A N LYS 260.A O no hydrogen 2.915 N/A LYS 265.A N ILE 261.A O no hydrogen 3.050 N/A VAL 266.A N LEU 262.A O no hydrogen 2.996 N/A LEU 267.A N PHE 263.A O no hydrogen 2.858 N/A ASP 268.A N GLU 264.A O no hydrogen 3.010 N/A GLU 269.A N LYS 265.A O no hydrogen 3.035 N/A VAL 270.A N LEU 267.A O no hydrogen 3.148 N/A GLU 271.A N LEU 267.A O no hydrogen 2.740 N/A GLY 279.A N TYR 274.A O no hydrogen 2.823 N/A PHE 280.A N ARG 250.A O no hydrogen 3.151 N/A LEU 282.A N LEU 252.A O no hydrogen 2.764 N/A VAL 284.A N ILE 254.A O no hydrogen 2.662 N/A THR 287.A OG1 TYR 288.A O no hydrogen 3.555 N/A HIS 291.A NE2 ASN 226.A O no hydrogen 2.689 N/A VAL 293.A N PHE 289.A O no hydrogen 3.107 N/A CYS 294.A N ASN 290.A O no hydrogen 2.960 N/A CYS 294.A SG ASN 290.A O no hydrogen 3.338 N/A CYS 294.A SG HIS 291.A O no hydrogen 3.372 N/A CYS 294.A SG THR 295.A OG1 no hydrogen 3.773 N/A THR 295.A OG1 HIS 291.A O no hydrogen 2.719 N/A LEU 296.A N TYR 292.A O no hydrogen 2.959 N/A ASN 297.A N VAL 293.A O no hydrogen 2.819 N/A ASP 298.A N CYS 294.A O no hydrogen 2.996 N/A LEU 299.A N THR 295.A O no hydrogen 2.986 N/A GLY 300.A N ASN 297.A O no hydrogen 3.245 N/A ILE 301.A N LEU 296.A O no hydrogen 2.706 N/A THR 302.A OG1 GLU 249.A O no hydrogen 3.031 N/A ILE 304.A N VAL 251.A O no hydrogen 2.938 N/A ILE 305.A N ARG 380.A O no hydrogen 2.718 N/A LYS 306.A N LEU 253.A O no hydrogen 3.143 N/A LYS 306.A NZ LYS 441.A O no hydrogen 3.524 N/A THR 307.A N TYR 382.A O no hydrogen 2.954 N/A THR 307.A OG1 ASP 308.A O no hydrogen 3.392 N/A ASN 309.A ND2 LYS 362.A O no hydrogen 3.595 N/A LYS 312.A N GLU 322.A O no hydrogen 3.054 N/A LYS 314.A NZ GLU 340.A OE2 no hydrogen 2.852 N/A TYR 321.A N ILE 341.A O no hydrogen 2.706 N/A GLU 322.A N LYS 312.A O no hydrogen 2.602 N/A ASN 327.A N LEU 323.A O no hydrogen 3.120 N/A ARG 328.A N LEU 324.A O no hydrogen 3.038 N/A ARG 328.A NH1 THR 287.A O no hydrogen 3.266 N/A CYS 329.A SG GLY 325.A O no hydrogen 3.330 N/A LEU 330.A N LEU 326.A O no hydrogen 2.924 N/A ASN 331.A N ASN 327.A O no hydrogen 2.886 N/A LEU 332.A N ARG 328.A O no hydrogen 2.955 N/A LEU 333.A N CYS 329.A O no hydrogen 2.987 N/A GLY 334.A N ASN 331.A O no hydrogen 3.400 N/A ARG 335.A N LEU 330.A O no hydrogen 2.663 N/A LEU 338.A N ASN 327.A OD1 no hydrogen 2.890 N/A ASP 339.A N ASP 339.A OD1 no hydrogen 2.482 N/A ILE 341.A N TYR 321.A O no hydrogen 3.121 N/A THR 342.A OG1 GLY 319.A O no hydrogen 2.733 N/A ILE 343.A N GLY 319.A O no hydrogen 2.890 N/A ASP 344.A N ASP 344.A OD1 no hydrogen 2.517 N/A LYS 352.A NZ ASP 408.A OD2 no hydrogen 3.436 N/A GLU 356.A N LYS 352.A O no hydrogen 2.917 N/A ARG 357.A N LYS 353.A O no hydrogen 2.930 N/A ARG 357.A NH2 ASP 348.A OD2 no hydrogen 2.580 N/A LEU 358.A N LYS 354.A O no hydrogen 2.973 N/A ASN 359.A N LYS 355.A O no hydrogen 2.904 N/A GLU 360.A N GLU 356.A O no hydrogen 2.921 N/A ARG 361.A N ARG 357.A O no hydrogen 2.971 N/A LYS 362.A N LEU 358.A O no hydrogen 2.950 N/A LYS 362.A NZ ASN 309.A O no hydrogen 3.369 N/A LYS 363.A N ASN 359.A O no hydrogen 2.883 N/A GLU 364.A N GLU 360.A O no hydrogen 2.956 N/A ILE 365.A N ARG 361.A O no hydrogen 2.950 N/A PHE 366.A N LYS 362.A O no hydrogen 2.898 N/A LYS 367.A N LYS 363.A O no hydrogen 2.903 N/A GLN 368.A N GLU 364.A O no hydrogen 2.961 N/A TYR 369.A N ILE 365.A O no hydrogen 3.311 N/A VAL 373.A N TYR 369.A O no hydrogen 3.225 N/A GLY 374.A N LYS 370.A O no hydrogen 3.013 N/A GLU 375.A N ASN 371.A O no hydrogen 3.039 N/A PHE 376.A N GLU 372.A O no hydrogen 3.007 N/A LEU 377.A N VAL 373.A O no hydrogen 2.758 N/A GLY 378.A N GLY 374.A O no hydrogen 2.637 N/A GLU 379.A N PHE 376.A O no hydrogen 2.915 N/A ARG 380.A NE GLU 447.A OE2 no hydrogen 3.360 N/A ARG 380.A NH2 GLU 447.A OE2 no hydrogen 3.481 N/A ILE 381.A N PHE 376.A O no hydrogen 3.374 N/A TYR 382.A N ILE 305.A O no hydrogen 2.846 N/A SER 384.A N THR 307.A O no hydrogen 2.779 N/A SER 384.A OG THR 307.A O no hydrogen 3.056 N/A SER 384.A OG ASP 308.A OD1 no hydrogen 3.027 N/A SER 384.A OG ASP 391.A OD2 no hydrogen 3.194 N/A GLU 389.A N GLU 389.A OE1 no hydrogen 2.974 N/A LEU 392.A N LEU 388.A O no hydrogen 2.890 N/A TYR 393.A N GLU 389.A O no hydrogen 2.921 N/A SER 394.A OG ASP 391.A O no hydrogen 3.217 N/A SER 394.A OG HIS 439.A NE2 no hydrogen 3.100 N/A ILE 396.A N LEU 392.A O no hydrogen 3.237 N/A SER 399.A OG ASP 432.A OD1 no hydrogen 2.592 N/A SER 399.A OG ASP 432.A OD2 no hydrogen 3.204 N/A MET 400.A N ILE 396.A O no hydrogen 2.907 N/A LYS 401.A N GLY 397.A O no hydrogen 2.898 N/A LYS 401.A NZ TYR 393.A OH no hydrogen 2.959 N/A ARG 402.A N GLU 398.A O no hydrogen 2.957 N/A ARG 402.A N SER 399.A O no hydrogen 3.242 N/A ILE 403.A N SER 399.A O no hydrogen 2.943 N/A LEU 413.A N PRO 409.A O no hydrogen 2.921 N/A GLN 414.A N VAL 410.A O no hydrogen 2.908 N/A MET 421.A N LYS 417.A O no hydrogen 2.952 N/A VAL 422.A N LEU 418.A O no hydrogen 2.970 N/A GLU 423.A N PHE 419.A O no hydrogen 2.957 N/A LEU 424.A N ASN 420.A O no hydrogen 2.886 N/A VAL 425.A N MET 421.A O no hydrogen 2.915 N/A ASN 426.A N VAL 422.A O no hydrogen 2.932 N/A SER 429.A OG ASP 432.A OD2 no hydrogen 3.034 N/A THR 430.A OG1 GLU 269.A OE1 no hydrogen 3.022 N/A LYS 431.A NZ ASP 435.A OD2 no hydrogen 3.367 N/A CYS 433.A SG LYS 265.A O no hydrogen 3.937 N/A CYS 433.A SG SER 429.A O no hydrogen 3.531 N/A PHE 434.A N THR 430.A O no hydrogen 2.968 N/A ASP 435.A N LYS 431.A O no hydrogen 2.875 N/A VAL 436.A N ASP 432.A O no hydrogen 2.943 N/A PHE 437.A N CYS 433.A O no hydrogen 2.895 N/A GLU 438.A N PHE 434.A O no hydrogen 2.894 N/A HIS 439.A N VAL 436.A O no hydrogen 3.362 N/A GLU 440.A N GLU 440.A OE1 no hydrogen 2.890 N/A LYS 441.A N HIS 439.A ND1 no hydrogen 3.242 N/A LYS 441.A NZ ASP 391.A OD1 no hydrogen 3.061 N/A GLU 447.A N ALA 443.A O no hydrogen 3.137 N/A LEU 448.A N CYS 444.A O no hydrogen 2.756 N/A VAL 449.A N LEU 445.A O no hydrogen 3.137 N/A VAL 449.A N LYS 446.A O no hydrogen 3.006 N/A GLY 450.A N LYS 446.A O no hydrogen 2.560 N/A