Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6rxy_CM.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 11.A N SER 8.A OG no hydrogen 2.379 N/A GLN 13.A N ILE 9.A O no hydrogen 2.992 N/A SER 17.A OG ALA 14.A O no hydrogen 2.701 N/A SER 17.A OG PRO 15.A O no hydrogen 3.138 N/A LEU 30.A N ALA 27.A O no hydrogen 2.525 N/A ARG 37.A N PHE 33.A O no hydrogen 2.942 N/A ARG 37.A NH2 PRO 32.A O no hydrogen 3.193 N/A GLU 38.A N GLU 34.A O no hydrogen 3.013 N/A TYR 39.A N ARG 35.A O no hydrogen 2.954 N/A TYR 39.A OH GLU 386.A OE1 no hydrogen 2.186 N/A GLN 40.A N ALA 36.A O no hydrogen 2.984 N/A ARG 41.A N ARG 37.A O no hydrogen 2.947 N/A ARG 41.A NH1 TYR 373.A OH no hydrogen 2.804 N/A ALA 42.A N GLU 38.A O no hydrogen 2.998 N/A LEU 43.A N TYR 39.A O no hydrogen 2.952 N/A ASN 44.A N GLN 40.A O no hydrogen 3.016 N/A ASN 44.A ND2 GLN 40.A OE1 no hydrogen 3.497 N/A ALA 45.A N ARG 41.A O no hydrogen 2.886 N/A VAL 46.A N ALA 42.A O no hydrogen 2.992 N/A LYS 47.A N LEU 43.A O no hydrogen 3.033 N/A LEU 48.A N ASN 44.A O no hydrogen 2.886 N/A GLU 49.A N ALA 45.A O no hydrogen 2.830 N/A ARG 50.A N VAL 46.A O no hydrogen 2.955 N/A ARG 50.A NE GLU 49.A OE1 no hydrogen 2.421 N/A ARG 50.A NH2 GLU 49.A OE2 no hydrogen 2.308 N/A MET 51.A N LYS 47.A O no hydrogen 2.993 N/A PHE 52.A N LEU 48.A O no hydrogen 2.955 N/A LEU 57.A N LEU 351.A O no hydrogen 2.966 N/A GLY 58.A N LEU 351.A O no hydrogen 3.034 N/A GLN 59.A NE2 ASN 348.A OD1 no hydrogen 2.356 N/A LEU 60.A N VAL 349.A O no hydrogen 2.914 N/A HIS 64.A NE2 SER 83.A O no hydrogen 2.427 N/A GLN 66.A N ASP 87.A OD2 no hydrogen 3.188 N/A VAL 68.A N SER 344.A O no hydrogen 2.822 N/A TYR 69.A N GLY 84.A O no hydrogen 3.063 N/A SER 70.A N GLY 84.A O no hydrogen 3.084 N/A CYS 72.A N ALA 82.A O no hydrogen 2.877 N/A CYS 72.A SG LYS 73.A O no hydrogen 3.156 N/A ASP 74.A N CYS 80.A O no hydrogen 2.928 N/A LYS 75.A NZ ARG 162.A O no hydrogen 2.638 N/A ASN 76.A N ASP 74.A OD1 no hydrogen 2.572 N/A SER 77.A N ASP 74.A OD1 no hydrogen 2.783 N/A SER 77.A OG ASN 79.A OD1 no hydrogen 2.816 N/A LEU 78.A N SER 77.A OG no hydrogen 2.298 N/A CYS 80.A SG ASP 74.A OD2 no hydrogen 3.894 N/A CYS 80.A SG ASN 79.A OD1 no hydrogen 3.224 N/A CYS 80.A SG TYR 137.A OH no hydrogen 3.186 N/A ILE 81.A N TRP 93.A O no hydrogen 2.940 N/A ALA 82.A N CYS 72.A O no hydrogen 2.967 N/A SER 83.A N LYS 91.A O no hydrogen 2.918 N/A SER 83.A OG HIS 64.A NE2 no hydrogen 2.886 N/A GLY 84.A N SER 70.A O no hydrogen 2.768 N/A SER 85.A N VAL 89.A O no hydrogen 2.801 N/A SER 85.A OG VAL 89.A O no hydrogen 3.545 N/A ASP 87.A N SER 85.A OG no hydrogen 2.508 N/A VAL 89.A N SER 85.A OG no hydrogen 3.340 N/A VAL 90.A N VAL 105.A O no hydrogen 2.836 N/A LYS 91.A N SER 83.A O no hydrogen 2.937 N/A VAL 92.A N TRP 103.A O no hydrogen 2.846 N/A TRP 93.A N ILE 81.A O no hydrogen 2.782 N/A LEU 95.A N ASN 79.A O no hydrogen 2.878 N/A THR 96.A N ASP 94.A OD2 no hydrogen 3.109 N/A THR 96.A OG1 ASP 94.A OD2 no hydrogen 2.239 N/A THR 97.A N ASP 94.A OD2 no hydrogen 3.224 N/A GLU 101.A N GLU 101.A OE1 no hydrogen 2.416 N/A THR 102.A N VAL 92.A O no hydrogen 2.789 N/A TRP 103.A N VAL 92.A O no hydrogen 3.049 N/A VAL 105.A N VAL 90.A O no hydrogen 3.014 N/A HIS 108.A N GLY 88.A O no hydrogen 2.714 N/A HIS 108.A NE2 SER 125.A OG no hydrogen 2.394 N/A ASN 110.A ND2 THR 128.A OG1 no hydrogen 3.209 N/A VAL 112.A N SER 85.A O no hydrogen 2.898 N/A GLY 114.A N CYS 126.A O no hydrogen 2.953 N/A THR 116.A N LEU 124.A O no hydrogen 2.919 N/A THR 116.A OG1 PHE 117.A O no hydrogen 3.131 N/A THR 118.A N LYS 122.A O no hydrogen 2.644 N/A THR 118.A OG1 LYS 122.A O no hydrogen 2.534 N/A ASN 119.A ND2 ARG 162.A O no hydrogen 3.253 N/A LYS 122.A N THR 118.A OG1 no hydrogen 2.926 N/A LEU 123.A N TRP 134.A O no hydrogen 2.938 N/A LEU 124.A N THR 116.A O no hydrogen 2.849 N/A SER 125.A N LYS 132.A O no hydrogen 2.942 N/A SER 125.A OG HIS 108.A NE2 no hydrogen 2.394 N/A CYS 126.A N GLY 114.A O no hydrogen 2.850 N/A CYS 126.A SG ALA 127.A O no hydrogen 3.925 N/A CYS 126.A SG TYR 155.A O no hydrogen 3.215 N/A CYS 126.A SG THR 156.A O no hydrogen 3.193 N/A ALA 127.A N GLY 130.A O no hydrogen 2.875 N/A GLY 130.A N ALA 127.A O no hydrogen 2.925 N/A ILE 131.A N TRP 149.A O no hydrogen 2.907 N/A LYS 132.A N SER 125.A O no hydrogen 2.960 N/A LYS 132.A NZ ALA 107.A O no hydrogen 2.926 N/A LYS 132.A NZ HIS 108.A ND1 no hydrogen 3.004 N/A LEU 133.A N ALA 147.A O no hydrogen 2.848 N/A TRP 134.A N LEU 123.A O no hydrogen 2.908 N/A ILE 146.A N LEU 133.A O no hydrogen 2.746 N/A ALA 147.A N LEU 133.A O no hydrogen 3.119 N/A TRP 149.A N ILE 131.A O no hydrogen 2.866 N/A TRP 149.A NE1 THR 185.A O no hydrogen 2.783 N/A THR 156.A N SER 170.A O no hydrogen 2.494 N/A THR 156.A OG1 SER 170.A O no hydrogen 3.445 N/A THR 156.A OG1 SER 171.A O no hydrogen 3.082 N/A THR 156.A OG1 ILE 199.A O no hydrogen 3.088 N/A SER 157.A N SER 170.A O no hydrogen 3.047 N/A SER 157.A OG THR 200.A O no hydrogen 2.346 N/A SER 159.A N ALA 168.A O no hydrogen 2.986 N/A HIS 161.A N THR 166.A O no hydrogen 2.907 N/A ALA 164.A N HIS 161.A ND1 no hydrogen 3.395 N/A PHE 167.A N TRP 179.A O no hydrogen 2.915 N/A ALA 168.A N SER 159.A O no hydrogen 2.877 N/A ALA 169.A N ARG 177.A O no hydrogen 2.905 N/A SER 170.A N SER 157.A O no hydrogen 2.943 N/A SER 170.A OG SER 171.A O no hydrogen 3.500 N/A SER 170.A OG THR 200.A O no hydrogen 3.280 N/A SER 171.A N CYS 175.A O no hydrogen 3.045 N/A SER 171.A OG GLY 152.A O no hydrogen 2.495 N/A SER 171.A OG PRO 154.A O no hydrogen 2.884 N/A GLN 173.A N SER 171.A OG no hydrogen 3.241 N/A CYS 175.A SG ILE 176.A O no hydrogen 4.034 N/A CYS 175.A SG ILE 190.A O no hydrogen 3.195 N/A ILE 176.A N ILE 190.A O no hydrogen 2.878 N/A ARG 177.A N ALA 169.A O no hydrogen 3.001 N/A ARG 177.A NH1 ALA 186.A O no hydrogen 3.322 N/A ILE 178.A N GLN 188.A O no hydrogen 2.893 N/A TRP 179.A N PHE 167.A O no hydrogen 2.891 N/A TRP 179.A NE1 THR 185.A O no hydrogen 2.441 N/A ASP 180.A N SER 184.A OG no hydrogen 2.683 N/A LEU 181.A N ASN 165.A O no hydrogen 2.898 N/A HIS 183.A N ASP 180.A O no hydrogen 3.487 N/A SER 184.A OG ASP 180.A O no hydrogen 2.477 N/A GLN 188.A N ILE 178.A O no hydrogen 2.895 N/A ILE 190.A N ILE 176.A O no hydrogen 2.815 N/A SER 194.A OG SER 194.A O no hydrogen 2.283 N/A THR 200.A N VAL 215.A O no hydrogen 2.684 N/A THR 200.A OG1 VAL 215.A O no hydrogen 3.300 N/A CYS 203.A SG GLY 213.A O no hydrogen 3.889 N/A CYS 203.A SG ILE 244.A O no hydrogen 3.635 N/A PHE 204.A N SER 159.A OG no hydrogen 2.545 N/A ASN 205.A N VAL 211.A O no hydrogen 3.164 N/A SER 210.A OG SER 210.A O no hydrogen 2.521 N/A SER 214.A N ILE 222.A O no hydrogen 2.680 N/A SER 214.A OG GLY 213.A O no hydrogen 2.660 N/A ALA 216.A N SER 220.A O no hydrogen 3.009 N/A THR 217.A N THR 198.A O no hydrogen 3.120 N/A THR 217.A OG1 THR 198.A O no hydrogen 3.451 N/A ARG 219.A NH1 HIS 238.A O no hydrogen 3.102 N/A SER 220.A OG ILE 221.A O no hydrogen 3.169 N/A SER 220.A OG THR 235.A O no hydrogen 2.519 N/A ILE 221.A N THR 235.A O no hydrogen 2.870 N/A ILE 222.A N SER 214.A O no hydrogen 2.704 N/A LEU 223.A N ILE 233.A O no hydrogen 2.833 N/A ASP 225.A N MET 230.A O no hydrogen 2.915 N/A LEU 226.A N SER 210.A O no hydrogen 2.973 N/A LEU 226.A N SER 210.A OG no hydrogen 3.134 N/A ARG 227.A N SER 210.A OG no hydrogen 2.819 N/A ARG 227.A NH1 ASP 225.A OD1 no hydrogen 3.167 N/A THR 228.A N ASP 225.A OD2 no hydrogen 2.642 N/A MET 230.A N ASP 225.A O no hydrogen 3.262 N/A VAL 232.A N LEU 223.A O no hydrogen 2.341 N/A ILE 233.A N LEU 223.A O no hydrogen 3.037 N/A LYS 234.A N GLN 444.A O no hydrogen 2.986 N/A THR 235.A N ILE 221.A O no hydrogen 2.912 N/A VAL 236.A N VAL 442.A O no hydrogen 2.882 N/A LEU 237.A N ARG 219.A O no hydrogen 2.807 N/A CYS 241.A SG ARG 243.A O no hydrogen 3.225 N/A CYS 241.A SG ALA 257.A O no hydrogen 3.187 N/A ASN 242.A N ALA 257.A O no hydrogen 2.352 N/A ARG 243.A N ALA 257.A O no hydrogen 3.113 N/A ARG 243.A NE ASP 287.A OD1 no hydrogen 3.134 N/A VAL 245.A N ALA 255.A O no hydrogen 2.902 N/A ASN 247.A N ASN 253.A O no hydrogen 2.811 N/A GLU 250.A N ASN 247.A O no hydrogen 3.107 N/A ASN 253.A N GLU 250.A O no hydrogen 2.946 N/A ASN 253.A ND2 GLU 250.A OE1 no hydrogen 2.533 N/A LEU 254.A N PHE 266.A O no hydrogen 2.931 N/A ALA 255.A N VAL 245.A O no hydrogen 2.807 N/A VAL 256.A N TYR 264.A O no hydrogen 2.909 N/A ALA 257.A N ARG 243.A O no hydrogen 2.831 N/A SER 258.A N ASN 262.A O no hydrogen 3.048 N/A SER 258.A OG ALA 240.A O no hydrogen 2.310 N/A SER 258.A OG ASP 260.A OD1 no hydrogen 3.226 N/A GLU 259.A N ALA 240.A O no hydrogen 2.936 N/A ASN 262.A N SER 258.A O no hydrogen 3.036 N/A ASN 262.A N ASP 260.A OD2 no hydrogen 3.143 N/A ASN 262.A ND2 TYR 264.A OH no hydrogen 3.503 N/A ILE 263.A N GLN 278.A O no hydrogen 2.976 N/A TYR 264.A N VAL 256.A O no hydrogen 2.968 N/A ILE 265.A N ASN 276.A O no hydrogen 2.842 N/A PHE 266.A N LEU 254.A O no hydrogen 2.859 N/A ALA 268.A N MET 252.A O no hydrogen 2.814 N/A ARG 269.A N ASP 267.A OD1 no hydrogen 2.869 N/A ASN 270.A N ASP 267.A O no hydrogen 3.176 N/A ASN 270.A ND2 ASP 272.A OD2 no hydrogen 2.257 N/A ASP 272.A N ASN 270.A OD1 no hydrogen 2.997 N/A ALA 274.A N ARG 436.A O no hydrogen 2.821 N/A LEU 275.A N ILE 265.A O no hydrogen 2.466 N/A ASN 276.A N ILE 265.A O no hydrogen 2.994 N/A GLN 278.A N ILE 263.A O no hydrogen 2.946 N/A GLN 278.A NE2 ARG 311.A O no hydrogen 3.510 N/A MET 286.A N GLY 300.A O no hydrogen 2.940 N/A ASP 287.A N GLY 300.A O no hydrogen 2.933 N/A GLU 289.A N VAL 298.A O no hydrogen 3.025 N/A SER 291.A N GLU 296.A O no hydrogen 2.815 N/A GLY 294.A N SER 291.A O no hydrogen 2.760 N/A GLY 294.A N SER 291.A OG no hydrogen 2.526 N/A GLU 296.A N SER 291.A OG no hydrogen 3.384 N/A VAL 298.A N GLU 289.A O no hydrogen 2.930 N/A SER 299.A N ARG 307.A O no hydrogen 2.980 N/A SER 299.A OG ARG 307.A O no hydrogen 2.682 N/A GLY 300.A N ASP 287.A O no hydrogen 2.893 N/A SER 301.A N THR 305.A O no hydrogen 3.518 N/A TYR 302.A N ALA 284.A O no hydrogen 2.481 N/A THR 305.A N ASP 303.A O no hydrogen 2.505 N/A ILE 306.A N TYR 320.A O no hydrogen 3.010 N/A ARG 307.A N SER 299.A O no hydrogen 2.886 N/A LEU 308.A N ASP 318.A O no hydrogen 2.903 N/A TRP 309.A N LEU 297.A O no hydrogen 2.909 N/A ARG 311.A NE ASP 312.A OD1 no hydrogen 2.509 N/A HIS 315.A ND1 LYS 279.A O no hydrogen 3.211 N/A SER 316.A OG ASP 318.A O no hydrogen 2.777 N/A ARG 317.A N LEU 308.A O no hydrogen 2.989 N/A ASP 318.A N LEU 308.A O no hydrogen 3.025 N/A TYR 320.A N ILE 306.A O no hydrogen 2.812 N/A TYR 320.A OH ASP 318.A OD2 no hydrogen 3.240 N/A TYR 320.A OH ARG 353.A O no hydrogen 3.009 N/A HIS 321.A NE2 HIS 395.A O no hydrogen 2.733 N/A ARG 327.A NH1 TYR 302.A O no hydrogen 3.171 N/A PHE 329.A N GLY 343.A O no hydrogen 2.791 N/A ARG 330.A N GLY 343.A O no hydrogen 3.153 N/A ARG 330.A NH1 ASP 287.A OD2 no hydrogen 2.303 N/A MET 332.A N LEU 341.A O no hydrogen 2.947 N/A TRP 333.A NE1 GLU 289.A O no hydrogen 2.971 N/A THR 334.A N TYR 339.A O no hydrogen 3.048 N/A THR 334.A OG1 TYR 339.A O no hydrogen 3.113 N/A SER 337.A N THR 334.A O no hydrogen 3.370 N/A SER 337.A OG SER 337.A O no hydrogen 2.240 N/A LYS 338.A NZ ASP 336.A O no hydrogen 2.428 N/A ILE 340.A N TRP 352.A O no hydrogen 2.965 N/A LEU 341.A N MET 332.A O no hydrogen 2.865 N/A THR 342.A N ARG 350.A O no hydrogen 2.924 N/A THR 342.A OG1 ARG 350.A O no hydrogen 3.225 N/A GLY 343.A N ARG 330.A O no hydrogen 2.780 N/A SER 344.A N ASN 348.A O no hydrogen 2.910 N/A SER 344.A OG ASN 348.A O no hydrogen 3.158 N/A ASP 345.A N ARG 327.A O no hydrogen 2.524 N/A ASN 348.A N SER 344.A OG no hydrogen 2.515 N/A ARG 350.A N THR 342.A O no hydrogen 2.928 N/A LEU 351.A N GLY 58.A O no hydrogen 2.837 N/A TRP 352.A N ILE 340.A O no hydrogen 2.929 N/A TRP 352.A NE1 THR 342.A OG1 no hydrogen 2.775 N/A ARG 353.A N PRO 55.A O no hydrogen 3.108 N/A ALA 354.A N LYS 338.A O no hydrogen 2.861 N/A SER 357.A N GLU 358.A OE1 no hydrogen 3.060 N/A SER 357.A OG GLU 49.A O no hydrogen 3.208 N/A GLU 358.A N ASN 355.A O no hydrogen 2.523 N/A ARG 359.A NH2 LYS 54.A O no hydrogen 3.563 N/A LYS 363.A NZ ARG 359.A O no hydrogen 3.125 N/A LYS 363.A NZ GLY 361.A O no hydrogen 3.561 N/A ARG 368.A N ALA 364.A O no hydrogen 3.035 N/A GLN 369.A N THR 365.A O no hydrogen 2.913 N/A ALA 370.A N ARG 366.A O no hydrogen 2.792 N/A LEU 371.A N GLN 367.A O no hydrogen 3.013 N/A GLU 372.A N ARG 368.A O no hydrogen 2.903 N/A TYR 373.A N GLN 369.A O no hydrogen 2.825 N/A ASN 374.A N ALA 370.A O no hydrogen 2.862 N/A ASN 375.A N LEU 371.A O no hydrogen 2.933 N/A ALA 376.A N GLU 372.A O no hydrogen 3.014 N/A LEU 377.A N TYR 373.A O no hydrogen 2.898 N/A LEU 378.A N ASN 374.A O no hydrogen 2.896 N/A ASP 379.A N ASN 375.A O no hydrogen 3.002 N/A ARG 380.A N ALA 376.A O no hydrogen 2.989 N/A ARG 380.A NH2 GLU 38.A OE2 no hydrogen 2.964 N/A TYR 381.A N LEU 377.A O no hydrogen 2.948 N/A TYR 381.A OH GLU 38.A OE2 no hydrogen 2.306 N/A ARG 388.A N LEU 384.A O no hydrogen 2.861 N/A ARG 389.A N PRO 385.A O no hydrogen 2.928 N/A ILE 390.A N GLU 386.A O no hydrogen 3.126 N/A ARG 391.A N ARG 388.A O no hydrogen 3.041 N/A ARG 392.A N ARG 388.A O no hydrogen 2.851 N/A LYS 401.A N PRO 397.A O no hydrogen 3.057 N/A LYS 402.A N LYS 398.A O no hydrogen 2.936 N/A ALA 403.A N VAL 399.A O no hydrogen 2.965 N/A THR 404.A N VAL 400.A O no hydrogen 2.947 N/A GLU 405.A N LYS 401.A O no hydrogen 3.041 N/A ILE 406.A N LYS 402.A O no hydrogen 2.970 N/A LYS 407.A N ALA 403.A O no hydrogen 2.870 N/A ARG 408.A N THR 404.A O no hydrogen 2.954 N/A ARG 408.A NE THR 404.A O no hydrogen 2.906 N/A GLU 409.A N GLU 405.A O no hydrogen 3.011 N/A GLU 410.A N ILE 406.A O no hydrogen 2.825 N/A LEU 411.A N LYS 407.A O no hydrogen 2.880 N/A ALA 412.A N ARG 408.A O no hydrogen 2.935 N/A ALA 413.A N GLU 409.A O no hydrogen 2.969 N/A ILE 414.A N GLU 410.A O no hydrogen 2.894 N/A LYS 415.A N LEU 411.A O no hydrogen 2.906 N/A ARG 416.A N ALA 412.A O no hydrogen 2.946 N/A ARG 417.A N ALA 413.A O no hydrogen 2.888 N/A GLU 418.A N ILE 414.A O no hydrogen 2.902 N/A GLU 419.A N LYS 415.A O no hydrogen 2.840 N/A ASN 420.A N ARG 416.A O no hydrogen 2.930 N/A GLU 421.A N ARG 417.A O no hydrogen 2.945 N/A ARG 422.A N GLU 418.A O no hydrogen 2.850 N/A ARG 422.A NH1 GLU 430.A O no hydrogen 2.326 N/A LYS 423.A N GLU 419.A O no hydrogen 2.886 N/A HIS 424.A N ASN 420.A O no hydrogen 2.894 N/A SER 425.A N ARG 422.A O no hydrogen 3.341 N/A SER 425.A OG GLU 421.A O no hydrogen 2.267 N/A SER 425.A OG ARG 422.A O no hydrogen 3.195 N/A LYS 427.A N SER 425.A OG no hydrogen 3.413 N/A LYS 428.A N SER 425.A O no hydrogen 3.467 N/A LYS 428.A NZ TYR 429.A OH no hydrogen 3.481 N/A LYS 433.A NZ GLU 437.A OE1 no hydrogen 2.830 N/A LYS 438.A N SER 434.A O no hydrogen 2.887 N/A ALA 439.A N GLU 435.A O no hydrogen 2.862 N/A VAL 440.A N GLU 437.A O no hydrogen 3.278 N/A VAL 442.A N VAL 236.A O no hydrogen 2.938 N/A LYS 443.A NZ ASP 272.A OD1 no hydrogen 2.355 N/A GLN 444.A N LYS 234.A O no hydrogen 2.896 N/A