Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1wcd_J.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 6.A N PRO 3.A O no hydrogen 2.568 N/A SER 7.A N PRO 3.A O no hydrogen 3.160 N/A SER 7.A OG GLY 14.A O no hydrogen 2.770 N/A SER 7.A OG SER 93.A OG no hydrogen 2.868 N/A LEU 8.A N PHE 4.A O no hydrogen 2.676 N/A LEU 9.A N ILE 5.A O no hydrogen 2.891 N/A MET 10.A N ARG 6.A O no hydrogen 2.822 N/A THR 13.A N MET 10.A O no hydrogen 2.917 N/A THR 13.A OG1 MET 10.A O no hydrogen 2.827 N/A GLY 14.A N PRO 11.A O no hydrogen 3.114 N/A SER 17.A OG HIS 26.A NE2 no hydrogen 3.128 N/A ILE 18.A N GLU 362.A OE2 no hydrogen 2.880 N/A ASP 21.A N ASP 164.A OD1 no hydrogen 2.694 N/A THR 22.A N ASP 20.A OD1 no hydrogen 3.016 N/A THR 22.A OG1 LEU 165.A O no hydrogen 3.304 N/A LEU 23.A N ASP 21.A O no hydrogen 2.920 N/A LYS 25.A NZ TYR 377.A OH no hydrogen 2.874 N/A HIS 26.A N GLU 376.A O no hydrogen 2.860 N/A HIS 26.A ND1 GLU 24.A O no hydrogen 2.846 N/A HIS 26.A NE2 SER 17.A OG no hydrogen 3.128 N/A THR 27.A N LEU 363.A O no hydrogen 2.835 N/A ARG 29.A N PHE 361.A O no hydrogen 3.042 N/A ARG 29.A NE TYR 86.A OH no hydrogen 3.110 N/A ARG 29.A NH2 GLN 80.A OE1 no hydrogen 3.059 N/A SER 30.A OG ASN 360.A OD1 no hydrogen 2.547 N/A GLU 31.A N SER 359.A O no hydrogen 2.700 N/A SER 33.A N GLY 357.A O no hydrogen 2.977 N/A SER 33.A OG LEU 77.A O no hydrogen 2.909 N/A TYR 35.A N VAL 355.A O no hydrogen 2.815 N/A TYR 35.A OH LEU 77.A O no hydrogen 3.331 N/A LEU 37.A N VAL 353.A O no hydrogen 2.851 N/A VAL 39.A N SER 351.A O no hydrogen 2.858 N/A THR 42.A OG1 SER 44.A O no hydrogen 3.538 N/A THR 42.A OG1 LEU 64.A O no hydrogen 2.492 N/A GLY 43.A N GLY 40.A O no hydrogen 3.091 N/A SER 44.A OG TYR 344.A O no hydrogen 2.862 N/A GLY 45.A N TYR 344.A O no hydrogen 3.013 N/A LEU 46.A N TYR 62.A O no hydrogen 2.790 N/A ILE 47.A N VAL 342.A O no hydrogen 2.877 N/A VAL 48.A N ALA 60.A O no hydrogen 2.839 N/A PHE 49.A N THR 340.A O no hydrogen 2.893 N/A PHE 50.A N VAL 58.A O no hydrogen 2.876 N/A PHE 53.A N PHE 50.A O no hydrogen 2.851 N/A GLY 55.A N PHE 53.A O no hydrogen 2.810 N/A SER 56.A OG GLN 80.A O no hydrogen 3.201 N/A VAL 58.A N LEU 76.A O no hydrogen 2.808 N/A GLY 59.A N LEU 76.A O no hydrogen 3.003 N/A ALA 60.A N VAL 48.A O no hydrogen 2.779 N/A HIS 61.A N GLN 74.A O no hydrogen 2.763 N/A HIS 61.A ND1 ASP 73.A OD2 no hydrogen 2.768 N/A HIS 61.A NE2 TYR 344.A OH no hydrogen 2.657 N/A TYR 62.A N LEU 46.A O no hydrogen 2.836 N/A THR 63.A N LYS 71.A O no hydrogen 3.112 N/A THR 63.A OG1 LYS 71.A O no hydrogen 3.376 N/A LEU 64.A N SER 44.A O no hydrogen 3.189 N/A GLY 68.A N GLN 65.A O no hydrogen 2.624 N/A TYR 70.A OH VAL 129.A O no hydrogen 3.029 N/A LYS 71.A N THR 63.A O no hydrogen 2.838 N/A PHE 72.A N ASP 257.A OD2 no hydrogen 2.954 N/A ASP 73.A N HIS 61.A O no hydrogen 2.691 N/A GLN 74.A N HIS 61.A O no hydrogen 3.425 N/A GLN 74.A NE2 ASP 73.A OD2 no hydrogen 3.292 N/A LEU 76.A N GLY 59.A O no hydrogen 2.531 N/A LEU 77.A N TYR 35.A OH no hydrogen 2.534 N/A THR 78.A N SER 56.A O no hydrogen 2.967 N/A ALA 79.A N THR 32.A O no hydrogen 2.722 N/A GLN 80.A N GLU 31.A OE1 no hydrogen 3.133 N/A LEU 82.A N SER 56.A OG no hydrogen 3.064 N/A ALA 84.A N ASN 81.A O no hydrogen 2.989 N/A SER 85.A N LEU 82.A O no hydrogen 2.721 N/A TYR 86.A N LEU 82.A O no hydrogen 2.825 N/A ASN 87.A N ILE 364.A O no hydrogen 2.952 N/A CYS 89.A N VAL 168.A O no hydrogen 2.814 N/A CYS 89.A SG PRO 54.A O no hydrogen 3.281 N/A ARG 90.A N GLU 362.A O no hydrogen 2.919 N/A ARG 90.A NE GLU 362.A OE1 no hydrogen 2.855 N/A ARG 90.A NH1 ASP 20.A OD1 no hydrogen 3.549 N/A ARG 90.A NH1 LEU 165.A O no hydrogen 2.694 N/A ARG 90.A NH2 ASP 20.A OD1 no hydrogen 3.223 N/A ARG 90.A NH2 GLU 362.A OE1 no hydrogen 2.792 N/A VAL 92.A N ASN 360.A O no hydrogen 2.783 N/A SER 93.A OG SER 7.A O no hydrogen 3.187 N/A SER 93.A OG SER 7.A OG no hydrogen 2.868 N/A ARG 94.A NE PRO 51.A O no hydrogen 3.016 N/A ARG 94.A NH1 SER 359.A OG no hydrogen 3.062 N/A ARG 94.A NH2 PRO 51.A O no hydrogen 3.308 N/A ARG 94.A NH2 PHE 53.A O no hydrogen 2.382 N/A SER 95.A N VAL 358.A O no hydrogen 3.068 N/A LEU 96.A N VAL 156.A O no hydrogen 2.934 N/A THR 97.A N ALA 356.A O no hydrogen 2.789 N/A VAL 98.A N VAL 154.A O no hydrogen 3.144 N/A ARG 99.A N THR 354.A O no hydrogen 2.990 N/A ARG 99.A NE GLY 151.A O no hydrogen 3.237 N/A SER 100.A N VAL 150.A O no hydrogen 3.176 N/A SER 101.A N VAL 352.A O no hydrogen 3.058 N/A SER 101.A OG THR 354.A OG1 no hydrogen 2.610 N/A VAL 107.A N PRO 104.A O no hydrogen 3.080 N/A THR 113.A N GLU 345.A O no hydrogen 3.242 N/A THR 113.A OG1 TYR 131.A OH no hydrogen 2.616 N/A ILE 114.A N VAL 148.A O no hydrogen 2.693 N/A ASN 115.A N ALA 343.A O no hydrogen 2.838 N/A ASN 115.A ND2 TYR 131.A O no hydrogen 3.050 N/A ALA 116.A N ILE 145.A O no hydrogen 3.091 N/A VAL 117.A N LEU 341.A O no hydrogen 3.073 N/A THR 118.A N ASP 143.A O no hydrogen 2.981 N/A THR 118.A OG1 THR 340.A OG1 no hydrogen 3.057 N/A THR 118.A OG1 THR 402.A OG1 no hydrogen 2.894 N/A PHE 119.A N VAL 339.A O no hydrogen 2.797 N/A SER 122.A N GLU 125.A OE1 no hydrogen 3.185 N/A SER 122.A OG GLU 125.A OE2 no hydrogen 3.444 N/A SER 124.A N ASP 225.A OD1 no hydrogen 2.697 N/A SER 124.A OG ASP 225.A OD1 no hydrogen 3.081 N/A SER 124.A OG ASP 225.A OD2 no hydrogen 2.538 N/A GLU 125.A N SER 122.A O no hydrogen 2.882 N/A LEU 126.A N LEU 123.A O no hydrogen 3.225 N/A SER 130.A N ASP 128.A OD1 no hydrogen 2.616 N/A SER 130.A OG ASP 128.A OD1 no hydrogen 2.707 N/A SER 130.A OG ASP 128.A OD2 no hydrogen 3.351 N/A TYR 131.A OH ASN 147.A OD1 no hydrogen 3.023 N/A LEU 134.A N SER 130.A O no hydrogen 3.063 N/A SER 136.A N GLY 133.A O no hydrogen 3.258 N/A SER 136.A OG GLY 133.A O no hydrogen 3.355 N/A ALA 137.A N LEU 134.A O no hydrogen 2.787 N/A THR 138.A OG1 THR 118.A O no hydrogen 3.441 N/A ASN 142.A ND2 ASP 396.A OD1 no hydrogen 2.606 N/A ASP 143.A N ASN 140.A O no hydrogen 3.223 N/A LYS 144.A NZ MET 135.A O no hydrogen 3.082 N/A ASN 147.A N ASN 115.A OD1 no hydrogen 2.817 N/A VAL 148.A N ILE 114.A O no hydrogen 2.961 N/A VAL 150.A N GLY 112.A O no hydrogen 3.065 N/A GLY 153.A N LEU 149.A O no hydrogen 3.001 N/A VAL 154.A N VAL 98.A O no hydrogen 2.915 N/A THR 155.A N TRP 404.A O no hydrogen 2.741 N/A THR 155.A OG1 THR 406.A OG1 no hydrogen 3.004 N/A VAL 156.A N LEU 96.A O no hydrogen 2.615 N/A LEU 157.A N THR 402.A O no hydrogen 2.711 N/A SER 158.A N ARG 94.A O no hydrogen 3.107 N/A SER 158.A OG PRO 51.A O no hydrogen 2.955 N/A SER 162.A OG TYR 163.A O no hydrogen 3.377 N/A ASP 164.A N ASP 20.A OD2 no hydrogen 3.003 N/A VAL 168.A N CYS 89.A O no hydrogen 2.852 N/A ARG 169.A NE TYR 88.A OH no hydrogen 3.251 N/A ARG 169.A NH1 ASP 172.A OD1 no hydrogen 2.637 N/A ARG 169.A NH2 TYR 88.A OH no hydrogen 3.502 N/A LEU 170.A N ASN 87.A O no hydrogen 2.823 N/A ILE 174.A N ALA 185.A O no hydrogen 2.847 N/A LYS 182.A N ASP 180.A OD1 no hydrogen 2.772 N/A THR 186.A OG1 ASP 188.A OD1 no hydrogen 3.193 N/A CYS 187.A N ASP 172.A O no hydrogen 2.769 N/A SER 190.A OG ASP 188.A O no hydrogen 3.180 N/A ARG 194.A N ILE 327.A O no hydrogen 2.992 N/A ARG 194.A NE ASN 331.A OD1 no hydrogen 3.236 N/A ARG 194.A NH1 SER 122.A OG no hydrogen 2.706 N/A ARG 194.A NH1 TYR 196.A OH no hydrogen 2.874 N/A ARG 194.A NH2 SER 122.A OG no hydrogen 3.022 N/A TYR 196.A N VAL 325.A O no hydrogen 2.764 N/A ILE 198.A N LEU 323.A O no hydrogen 2.915 N/A ALA 200.A N ILE 198.A O no hydrogen 3.087 N/A ALA 201.A N GLY 321.A O no hydrogen 3.348 N/A TYR 204.A N ALA 319.A O no hydrogen 2.860 N/A PHE 206.A N TRP 317.A O no hydrogen 2.705 N/A SER 207.A OG MET 315.A O no hydrogen 3.431 N/A SER 208.A N MET 315.A O no hydrogen 2.963 N/A GLY 214.A N GLN 211.A O no hydrogen 2.904 N/A VAL 215.A N THR 304.A O no hydrogen 3.150 N/A ILE 217.A N ILE 302.A O no hydrogen 3.141 N/A ALA 222.A N ILE 298.A O no hydrogen 2.821 N/A ILE 224.A N THR 296.A O no hydrogen 3.176 N/A ALA 226.A N ILE 295.A O no hydrogen 3.312 N/A SER 229.A N THR 288.A OG1 no hydrogen 3.065 N/A LEU 230.A N ILE 286.A O no hydrogen 3.118 N/A SER 231.A N THR 326.A O no hydrogen 2.979 N/A VAL 232.A N LEU 284.A O no hydrogen 3.060 N/A GLY 233.A N ALA 324.A O no hydrogen 3.252 N/A LEU 236.A N MET 280.A O no hydrogen 2.858 N/A VAL 237.A N ARG 320.A O no hydrogen 2.971 N/A PHE 238.A N ASN 278.A O no hydrogen 2.574 N/A ARG 239.A N SER 318.A O no hydrogen 2.926 N/A THR 240.A OG1 SER 316.A O no hydrogen 2.640 N/A VAL 246.A N SER 305.A O no hydrogen 2.580 N/A LEU 247.A N ASN 270.A O no hydrogen 2.511 N/A GLY 248.A N VAL 303.A O no hydrogen 2.830 N/A ALA 249.A N ALA 267.A O no hydrogen 2.677 N/A THR 250.A N GLU 301.A O no hydrogen 2.849 N/A ILE 251.A N ARG 264.A O no hydrogen 2.700 N/A TYR 252.A N LYS 299.A O no hydrogen 2.886 N/A LEU 253.A N ILE 262.A O no hydrogen 2.678 N/A ILE 254.A N SER 297.A O no hydrogen 2.882 N/A GLY 255.A N THR 259.A O no hydrogen 2.655 N/A GLY 258.A N GLY 255.A O no hydrogen 3.138 N/A THR 259.A N ASP 257.A OD1 no hydrogen 2.975 N/A THR 259.A OG1 ASP 257.A OD2 no hydrogen 3.541 N/A VAL 261.A N LEU 253.A O no hydrogen 2.707 N/A ILE 262.A N LEU 253.A O no hydrogen 3.015 N/A ARG 264.A N ILE 251.A O no hydrogen 2.826 N/A ARG 264.A NH2 VAL 285.A O no hydrogen 3.509 N/A ARG 264.A NH2 GLU 290.A OE1 no hydrogen 2.890 N/A ARG 264.A NH2 GLU 290.A OE2 no hydrogen 3.135 N/A ALA 267.A N ALA 249.A O no hydrogen 3.134 N/A ASN 270.A N LEU 247.A O no hydrogen 2.714 N/A LEU 272.A N LEU 245.A O no hydrogen 2.705 N/A THR 274.A OG1 SER 241.A O no hydrogen 3.467 N/A THR 274.A OG1 VAL 242.A O no hydrogen 2.450 N/A GLY 275.A N THR 240.A O no hydrogen 2.998 N/A THR 276.A N THR 274.A O no hydrogen 3.000 N/A ASN 278.A N PHE 238.A O no hydrogen 2.728 N/A ASN 278.A ND2 GLY 271.A O no hydrogen 3.504 N/A MET 280.A N LEU 236.A O no hydrogen 2.633 N/A PHE 282.A N GLY 234.A O no hydrogen 3.105 N/A LEU 284.A N VAL 232.A O no hydrogen 2.963 N/A ILE 286.A N LEU 230.A O no hydrogen 2.863 N/A GLU 290.A N PRO 287.A O no hydrogen 3.272 N/A ILE 291.A N THR 288.A O no hydrogen 2.705 N/A GLN 293.A NE2 ASP 257.A OD1 no hydrogen 3.411 N/A ILE 295.A N ALA 226.A O no hydrogen 2.945 N/A THR 296.A N ILE 254.A O no hydrogen 2.877 N/A SER 297.A N ILE 254.A O no hydrogen 3.342 N/A ILE 298.A N ALA 222.A O no hydrogen 2.809 N/A LYS 299.A N TYR 252.A O no hydrogen 3.000 N/A LEU 300.A N PHE 220.A O no hydrogen 3.117 N/A GLU 301.A N THR 250.A O no hydrogen 2.854 N/A ILE 302.A N ILE 217.A O no hydrogen 3.004 N/A VAL 303.A N GLY 248.A O no hydrogen 2.510 N/A THR 304.A N VAL 215.A O no hydrogen 3.126 N/A SER 305.A OG VAL 246.A O no hydrogen 2.971 N/A LYS 306.A NZ GLY 312.A O no hydrogen 3.250 N/A LYS 306.A NZ ASP 313.A OD1 no hydrogen 2.860 N/A SER 307.A N GLY 244.A O no hydrogen 2.910 N/A SER 307.A OG GLY 244.A O no hydrogen 3.358 N/A GLN 310.A N GLY 312.A O no hydrogen 3.484 N/A TRP 317.A N PHE 206.A O no hydrogen 3.060 N/A TRP 317.A NE1 THR 304.A OG1 no hydrogen 2.557 N/A SER 318.A N ARG 239.A O no hydrogen 2.898 N/A SER 318.A OG ASP 203.A OD1 no hydrogen 3.540 N/A ALA 319.A N TYR 204.A O no hydrogen 3.032 N/A ARG 320.A N VAL 237.A O no hydrogen 3.109 N/A ARG 320.A NH2 ASP 202.A OD2 no hydrogen 3.375 N/A LEU 323.A N ILE 198.A O no hydrogen 2.684 N/A ALA 324.A N GLY 233.A O no hydrogen 2.831 N/A VAL 325.A N TYR 196.A O no hydrogen 2.722 N/A THR 326.A N SER 231.A O no hydrogen 2.902 N/A ILE 327.A N ARG 194.A O no hydrogen 2.918 N/A GLY 329.A N SER 190.A O no hydrogen 3.015 N/A GLY 330.A N ILE 327.A O no hydrogen 2.920 N/A ASN 331.A N ARG 192.A O no hydrogen 2.623 N/A ASN 331.A ND2 PRO 193.A O no hydrogen 3.259 N/A TYR 332.A N GLY 329.A O no hydrogen 3.295 N/A TYR 332.A OH GLY 166.A O no hydrogen 2.688 N/A ALA 335.A N TYR 332.A O no hydrogen 2.988 N/A VAL 339.A N PHE 119.A O no hydrogen 3.099 N/A THR 340.A N PHE 49.A O no hydrogen 2.974 N/A THR 340.A OG1 THR 118.A OG1 no hydrogen 3.057 N/A LEU 341.A N VAL 117.A O no hydrogen 2.895 N/A VAL 342.A N ILE 47.A O no hydrogen 2.891 N/A ALA 343.A N ASN 115.A O no hydrogen 2.857 N/A TYR 344.A N GLY 45.A O no hydrogen 3.108 N/A TYR 344.A OH HIS 61.A NE2 no hydrogen 2.657 N/A GLU 345.A N THR 113.A O no hydrogen 3.204 N/A ARG 346.A NE GLU 345.A OE2 no hydrogen 3.516 N/A VAL 347.A N GLY 43.A O no hydrogen 2.944 N/A THR 349.A OG1 GLY 40.A O no hydrogen 3.000 N/A THR 349.A OG1 ASP 41.A O no hydrogen 3.299 N/A GLY 350.A N VAL 39.A O no hydrogen 2.876 N/A SER 351.A N ALA 348.A O no hydrogen 2.946 N/A SER 351.A OG ALA 348.A O no hydrogen 2.439 N/A VAL 353.A N LEU 37.A O no hydrogen 2.639 N/A THR 354.A N ARG 99.A O no hydrogen 2.704 N/A THR 354.A OG1 ASN 36.A OD1 no hydrogen 3.002 N/A VAL 355.A N TYR 35.A O no hydrogen 2.699 N/A ALA 356.A N THR 97.A O no hydrogen 3.158 N/A GLY 357.A N SER 33.A O no hydrogen 2.945 N/A VAL 358.A N SER 95.A O no hydrogen 2.942 N/A SER 359.A N GLU 31.A O no hydrogen 2.664 N/A ASN 360.A N SER 93.A O no hydrogen 2.831 N/A ASN 360.A ND2 PRO 11.A O no hydrogen 3.067 N/A ASN 360.A ND2 SER 93.A OG no hydrogen 2.807 N/A PHE 361.A N ARG 29.A O no hydrogen 2.848 N/A GLU 362.A N ARG 90.A O no hydrogen 2.803 N/A LEU 363.A N THR 27.A O no hydrogen 2.702 N/A ILE 364.A N TYR 88.A O no hydrogen 3.100 N/A ASN 366.A N SER 85.A O no hydrogen 2.942 N/A LEU 369.A N ASN 366.A OD1 no hydrogen 2.932 N/A ALA 370.A N ASN 366.A O no hydrogen 2.851 N/A LYS 371.A N GLU 368.A O no hydrogen 3.398 N/A LYS 371.A NZ GLU 368.A OE2 no hydrogen 3.140 N/A ASN 372.A N LEU 369.A O no hydrogen 3.005 N/A LEU 373.A N LEU 369.A O no hydrogen 2.976 N/A GLU 376.A N HIS 26.A O no hydrogen 2.848 N/A TYR 387.A N GLY 383.A O no hydrogen 3.026 N/A THR 388.A N ALA 384.A O no hydrogen 3.147 N/A THR 388.A OG1 ALA 384.A O no hydrogen 2.851 N/A LYS 389.A N MET 385.A O no hydrogen 2.691 N/A LEU 390.A N ASN 386.A O no hydrogen 2.618 N/A ILE 391.A N TYR 387.A O no hydrogen 2.656 N/A LEU 392.A N THR 388.A O no hydrogen 2.697 N/A SER 393.A N LYS 389.A O no hydrogen 2.648 N/A GLU 394.A N LEU 390.A O no hydrogen 2.858 N/A ARG 395.A N LEU 392.A O no hydrogen 2.820 N/A ARG 395.A NE ILE 400.A O no hydrogen 2.826 N/A ARG 395.A NH2 ASP 143.A OD2 no hydrogen 2.682 N/A ARG 395.A NH2 ILE 400.A O no hydrogen 3.518 N/A LEU 398.A N GLU 394.A O no hydrogen 3.121 N/A GLY 399.A N ASP 396.A O no hydrogen 3.268 N/A ILE 400.A N ARG 395.A O no hydrogen 3.026 N/A LYS 401.A NZ ASN 142.A OD1 no hydrogen 3.008 N/A THR 402.A N ASN 142.A O no hydrogen 3.170 N/A THR 402.A OG1 THR 118.A OG1 no hydrogen 2.894 N/A THR 402.A OG1 ASP 143.A OD2 no hydrogen 2.634 N/A TRP 404.A N THR 155.A O no hydrogen 2.708 N/A THR 406.A N GLY 153.A O no hydrogen 3.182 N/A THR 406.A OG1 THR 155.A OG1 no hydrogen 3.004 N/A TYR 409.A N PRO 405.A O no hydrogen 3.064 N/A TYR 409.A OH LEU 9.A O no hydrogen 2.583 N/A THR 410.A N THR 406.A O no hydrogen 2.802 N/A THR 410.A OG1 THR 406.A O no hydrogen 2.945 N/A ASP 411.A N ARG 407.A O no hydrogen 2.986 N/A PHE 412.A N GLU 408.A O no hydrogen 2.966 N/A PHE 412.A N TYR 409.A O no hydrogen 2.943 N/A ARG 413.A N TYR 409.A O no hydrogen 3.096 N/A ARG 413.A N THR 410.A O no hydrogen 3.040 N/A TYR 415.A N ASP 411.A O no hydrogen 3.121 N/A