Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3udq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 4.A N PHE 1.A O no hydrogen 3.093 N/A VAL 5.A N VAL 2.A O no hydrogen 2.958 N/A ASP 6.A N SER 169.A OG no hydrogen 2.727 N/A ASN 7.A N MET 4.A O no hydrogen 3.308 N/A ASN 7.A ND2 HIS 91.A O no hydrogen 3.099 N/A ASN 7.A ND2 MET 170.A O no hydrogen 2.937 N/A LEU 8.A N GLY 168.A O no hydrogen 2.888 N/A ARG 9.A N TYR 17.A O no hydrogen 3.234 N/A ARG 9.A NH1 ASP 6.A OD1 no hydrogen 3.154 N/A ARG 9.A NH2 ASP 6.A OD1 no hydrogen 2.892 N/A LYS 11.A NZ LEU 163.A O no hydrogen 2.748 N/A LYS 11.A NZ SER 165.A OG no hydrogen 3.406 N/A SER 12.A N ALA 164.A O no hydrogen 2.866 N/A GLN 14.A N LYS 11.A O no hydrogen 3.207 N/A GLN 14.A NE2 ASN 113.A O no hydrogen 3.422 N/A TYR 16.A OH CYS 157.A O no hydrogen 2.388 N/A TYR 16.A OH GLU 335.A OE1 no hydrogen 2.995 N/A TYR 17.A N ARG 9.A O no hydrogen 3.086 N/A VAL 18.A N ILE 31.A O no hydrogen 2.718 N/A MET 20.A N LEU 29.A O no hydrogen 2.973 N/A THR 21.A N SER 88.A O no hydrogen 2.900 N/A THR 21.A OG1 SER 88.A OG no hydrogen 3.115 N/A VAL 22.A N GLN 27.A O no hydrogen 2.846 N/A GLY 23.A N LEU 86.A O no hydrogen 2.784 N/A SER 24.A N SER 59.A OG no hydrogen 2.992 N/A SER 24.A OG THR 61.A OG1 no hydrogen 2.692 N/A GLN 27.A N VAL 22.A O no hydrogen 2.843 N/A GLN 27.A NE2 GLN 55.A O no hydrogen 2.608 N/A LEU 29.A N MET 20.A O no hydrogen 2.930 N/A ASN 30.A N GLU 118.A OE2 no hydrogen 2.974 N/A ASN 30.A ND2 ASN 116.A O no hydrogen 3.055 N/A ILE 31.A N VAL 18.A O no hydrogen 2.684 N/A LEU 32.A N GLY 119.A O no hydrogen 2.705 N/A VAL 33.A N TYR 16.A O no hydrogen 2.821 N/A ASP 34.A N LEU 121.A O no hydrogen 3.001 N/A THR 35.A N SER 225.A OG no hydrogen 3.164 N/A THR 35.A OG1 VAL 223.A O no hydrogen 3.057 N/A GLY 36.A N ASP 34.A OD2 no hydrogen 2.990 N/A SER 37.A OG ASP 34.A OD2 no hydrogen 2.700 N/A SER 38.A OG TYR 125.A O no hydrogen 2.556 N/A ASN 39.A ND2 ARG 130.A O no hydrogen 3.105 N/A ALA 41.A N ILE 120.A O no hydrogen 3.287 N/A VAL 42.A N ALA 102.A O no hydrogen 2.997 N/A GLY 43.A N GLU 118.A O no hydrogen 2.742 N/A ALA 44.A N ILE 104.A O no hydrogen 2.689 N/A PHE 49.A N HIS 47.A ND1 no hydrogen 2.860 N/A LEU 50.A N HIS 47.A O no hydrogen 3.063 N/A ARG 52.A NE GLU 118.A OE2 no hydrogen 2.925 N/A TYR 54.A N GLY 43.A O no hydrogen 2.676 N/A TYR 54.A OH ASP 85.A OD2 no hydrogen 2.329 N/A GLN 55.A N GLN 27.A OE1 no hydrogen 2.604 N/A ARG 56.A NH1 TYR 62.A OH no hydrogen 3.497 N/A GLN 57.A N GLN 57.A OE1 no hydrogen 2.865 N/A LEU 58.A N GLN 55.A O no hydrogen 3.444 N/A SER 59.A N ARG 56.A O no hydrogen 3.044 N/A SER 59.A OG ASP 85.A OD1 no hydrogen 3.190 N/A SER 59.A OG ASP 85.A OD2 no hydrogen 3.075 N/A SER 60.A N SER 24.A O no hydrogen 2.808 N/A SER 60.A OG SER 24.A O no hydrogen 3.055 N/A THR 61.A OG1 SER 24.A OG no hydrogen 2.692 N/A THR 61.A OG1 SER 59.A OG no hydrogen 3.216 N/A THR 61.A OG1 ASP 85.A OD1 no hydrogen 2.964 N/A TYR 62.A OH ASP 64.A OD2 no hydrogen 3.146 N/A ARG 63.A N THR 84.A O no hydrogen 3.010 N/A LEU 65.A N LEU 82.A O no hydrogen 2.951 N/A ARG 66.A N ASP 64.A OD1 no hydrogen 2.766 N/A LYS 67.A N GLU 81.A OE1 no hydrogen 3.059 N/A VAL 69.A N GLY 80.A O no hydrogen 2.677 N/A VAL 71.A N TRP 78.A O no hydrogen 2.730 N/A TYR 73.A N GLY 76.A O no hydrogen 2.576 N/A LYS 77.A N ASP 108.A O no hydrogen 2.931 N/A TRP 78.A N VAL 71.A O no hydrogen 3.004 N/A TRP 78.A NE1 TYR 73.A OH no hydrogen 2.790 N/A GLU 79.A N GLU 106.A O no hydrogen 2.860 N/A GLY 80.A N VAL 69.A O no hydrogen 2.774 N/A GLU 81.A N ALA 103.A O no hydrogen 3.144 N/A LEU 82.A N LYS 67.A O no hydrogen 2.804 N/A GLY 83.A N ILE 101.A O no hydrogen 2.973 N/A THR 84.A N ARG 63.A O no hydrogen 2.965 N/A ASP 85.A N ALA 99.A O no hydrogen 3.032 N/A LEU 86.A N ASP 85.A OD1 no hydrogen 2.824 N/A VAL 87.A N VAL 97.A O no hydrogen 2.688 N/A SER 88.A N THR 21.A O no hydrogen 3.165 N/A SER 88.A OG THR 21.A OG1 no hydrogen 3.115 N/A HIS 91.A ND1 GLU 3.A OE1 no hydrogen 2.936 N/A GLY 92.A N ILE 89.A O no hydrogen 2.793 N/A VAL 95.A N PRO 93.A O no hydrogen 2.709 N/A VAL 97.A N VAL 87.A O no hydrogen 2.691 N/A ARG 98.A N GLN 145.A OE1 no hydrogen 2.661 N/A ARG 98.A NH1 THR 61.A O no hydrogen 3.288 N/A ARG 98.A NH1 THR 84.A O no hydrogen 3.296 N/A ARG 98.A NH1 THR 84.A OG1 no hydrogen 2.779 N/A ARG 98.A NH2 THR 61.A O no hydrogen 2.634 N/A ALA 99.A N ASP 85.A O no hydrogen 2.942 N/A ILE 101.A N GLY 83.A O no hydrogen 2.802 N/A ALA 102.A N PHE 40.A O no hydrogen 2.815 N/A ALA 103.A N GLU 81.A O no hydrogen 2.998 N/A ILE 104.A N VAL 42.A O no hydrogen 2.697 N/A THR 105.A N GLU 79.A O no hydrogen 2.964 N/A THR 105.A OG1 GLU 79.A O no hydrogen 3.472 N/A GLU 106.A N GLU 79.A O no hydrogen 3.293 N/A ASP 108.A N LYS 77.A O no hydrogen 2.761 N/A LYS 109.A NZ ASP 108.A OD2 no hydrogen 2.663 N/A SER 115.A N ILE 112.A O no hydrogen 3.207 N/A SER 115.A OG ILE 112.A O no hydrogen 2.959 N/A ASN 116.A ND2 TYR 17.A OH no hydrogen 2.685 N/A TRP 117.A NE1 GLN 14.A O no hydrogen 2.771 N/A GLU 118.A N ASN 30.A O no hydrogen 2.729 N/A ILE 120.A N ALA 41.A O no hydrogen 2.824 N/A LEU 121.A N LEU 32.A O no hydrogen 2.688 N/A GLY 122.A N ASN 39.A O no hydrogen 2.842 N/A LEU 123.A N ASP 34.A O no hydrogen 2.807 N/A ALA 124.A N SER 37.A O no hydrogen 2.892 N/A TYR 125.A N TRP 193.A O no hydrogen 2.982 N/A ILE 128.A N TYR 125.A O no hydrogen 3.039 N/A ALA 129.A N ALA 126.A O no hydrogen 2.887 N/A ARG 130.A N ASN 39.A OD1 no hydrogen 2.978 N/A SER 134.A N ASP 132.A OD2 no hydrogen 3.003 N/A SER 134.A OG ASP 132.A OD2 no hydrogen 2.520 N/A LEU 135.A N ASP 132.A O no hydrogen 3.306 N/A SER 141.A N PRO 137.A O no hydrogen 2.997 N/A SER 141.A OG GLU 136.A OE2 no hydrogen 2.737 N/A SER 141.A OG PRO 137.A O no hydrogen 3.333 N/A LEU 142.A N PHE 138.A O no hydrogen 2.760 N/A VAL 143.A N PHE 139.A O no hydrogen 2.957 N/A LYS 144.A N ASP 140.A O no hydrogen 2.985 N/A GLN 145.A N SER 141.A O no hydrogen 2.934 N/A GLN 145.A NE2 ARG 98.A O no hydrogen 2.674 N/A THR 146.A N LEU 142.A O no hydrogen 3.164 N/A THR 146.A N VAL 143.A O no hydrogen 3.393 N/A THR 146.A OG1 LEU 142.A O no hydrogen 2.573 N/A VAL 148.A N THR 146.A OG1 no hydrogen 3.211 N/A LEU 151.A N PRO 149.A O no hydrogen 2.743 N/A PHE 152.A N PHE 341.A O no hydrogen 3.326 N/A SER 153.A N ILE 171.A O no hydrogen 2.895 N/A SER 153.A OG GLY 174.A O no hydrogen 2.924 N/A SER 153.A OG TYR 338.A OH no hydrogen 2.521 N/A LEU 154.A N VAL 339.A O no hydrogen 2.839 N/A GLN 155.A N SER 169.A O no hydrogen 2.878 N/A GLN 155.A NE2 LEU 179.A O no hydrogen 2.873 N/A CYS 157.A N GLY 167.A O no hydrogen 3.011 N/A CYS 157.A SG GLN 155.A OE1 no hydrogen 3.504 N/A SER 165.A OG GLY 10.A O no hydrogen 3.526 N/A VAL 166.A N GLY 10.A O no hydrogen 2.771 N/A SER 169.A N GLN 155.A O no hydrogen 2.821 N/A MET 170.A N ASN 7.A OD1 no hydrogen 2.741 N/A ILE 171.A N SER 153.A O no hydrogen 2.881 N/A GLY 173.A N LEU 151.A O no hydrogen 2.791 N/A ASP 176.A N TYR 338.A OH no hydrogen 2.815 N/A SER 178.A N ASP 176.A OD2 no hydrogen 3.118 N/A SER 178.A OG ASP 176.A OD2 no hydrogen 2.900 N/A LEU 179.A N ASP 176.A O no hydrogen 2.973 N/A THR 181.A N VAL 352.A O no hydrogen 3.028 N/A TRP 185.A N PHE 350.A O no hydrogen 2.979 N/A THR 187.A N ILE 348.A O no hydrogen 2.936 N/A THR 187.A OG1 MET 284.A O no hydrogen 2.882 N/A ILE 189.A N LYS 346.A O no hydrogen 2.957 N/A ARG 190.A N GLU 196.A O no hydrogen 2.802 N/A ARG 190.A NH1 TYR 380.A O no hydrogen 2.890 N/A ARG 190.A NH2 ASN 381.A OD1 no hydrogen 3.227 N/A TRP 193.A N ARG 191.A O no hydrogen 3.168 N/A TRP 193.A NE1 GLU 196.A OE1 no hydrogen 2.837 N/A TYR 195.A OH LEU 123.A O no hydrogen 2.546 N/A VAL 197.A N SER 221.A O no hydrogen 3.094 N/A ILE 199.A N ASN 217.A OD1 no hydrogen 2.815 N/A VAL 200.A N TYR 282.A O no hydrogen 2.702 N/A ARG 201.A N TYR 282.A O no hydrogen 3.478 N/A ARG 201.A NE GLU 203.A OE2 no hydrogen 2.759 N/A ARG 201.A NH2 GLU 203.A OE2 no hydrogen 3.033 N/A GLU 203.A N SER 280.A O no hydrogen 3.047 N/A ILE 204.A N GLN 207.A O no hydrogen 2.904 N/A ASN 205.A N VAL 278.A O no hydrogen 3.079 N/A GLN 207.A N ILE 204.A O no hydrogen 2.929 N/A LEU 209.A N VAL 202.A O no hydrogen 3.011 N/A LYS 210.A N ASP 208.A OD1 no hydrogen 2.901 N/A MET 211.A N TYR 216.A OH no hydrogen 3.409 N/A LYS 214.A N ASP 212.A OD2 no hydrogen 3.403 N/A LYS 214.A NZ ASP 377.A O no hydrogen 2.890 N/A GLU 215.A N ASP 212.A O no hydrogen 2.868 N/A TYR 216.A N CYS 213.A O no hydrogen 3.067 N/A ASN 217.A N LYS 214.A O no hydrogen 3.169 N/A ASN 217.A ND2 ILE 199.A O no hydrogen 2.704 N/A ASN 217.A ND2 CYS 378.A O no hydrogen 2.898 N/A ASP 219.A N ASP 219.A OD1 no hydrogen 2.694 N/A SER 221.A OG ASN 217.A OD1 no hydrogen 2.711 N/A ILE 222.A N THR 327.A O no hydrogen 2.874 N/A VAL 223.A N TYR 195.A O no hydrogen 2.987 N/A ASP 224.A N MET 329.A O no hydrogen 3.153 N/A SER 225.A N THR 35.A OG1 no hydrogen 3.087 N/A SER 225.A OG VAL 33.A O no hydrogen 2.823 N/A GLY 226.A N ASP 224.A OD1 no hydrogen 3.305 N/A THR 227.A OG1 ASP 224.A OD2 no hydrogen 2.404 N/A THR 228.A OG1 GLY 13.A O no hydrogen 3.203 N/A ASN 229.A ND2 SER 321.A OG no hydrogen 3.198 N/A LEU 230.A N ALA 319.A O no hydrogen 3.206 N/A ARG 231.A N VAL 328.A O no hydrogen 3.017 N/A ARG 231.A NH1 GLN 322.A O no hydrogen 3.517 N/A LEU 232.A N SER 321.A O no hydrogen 2.932 N/A LYS 234.A NZ GLU 238.A OE2 no hydrogen 3.473 N/A PHE 237.A N PRO 233.A O no hydrogen 2.925 N/A GLU 238.A N LYS 234.A O no hydrogen 3.006 N/A ALA 239.A N LYS 235.A O no hydrogen 3.090 N/A ALA 240.A N VAL 236.A O no hydrogen 2.779 N/A VAL 241.A N PHE 237.A O no hydrogen 2.875 N/A LYS 242.A N GLU 238.A O no hydrogen 3.038 N/A SER 243.A N ALA 239.A O no hydrogen 3.066 N/A ILE 244.A N ALA 240.A O no hydrogen 2.833 N/A LYS 245.A N VAL 241.A O no hydrogen 2.841 N/A ALA 246.A N LYS 242.A O no hydrogen 3.209 N/A ALA 247.A N SER 243.A O no hydrogen 3.158 N/A SER 248.A N ILE 244.A O no hydrogen 3.007 N/A SER 248.A OG ILE 244.A O no hydrogen 3.075 N/A SER 248.A OG LYS 245.A O no hydrogen 3.356 N/A SER 249.A OG ALA 246.A O no hydrogen 3.019 N/A LYS 252.A NZ LYS 245.A O no hydrogen 3.550 N/A PHE 257.A N PRO 254.A O no hydrogen 3.357 N/A LEU 259.A N ASP 255.A O no hydrogen 3.387 N/A GLY 260.A N PHE 257.A O no hydrogen 2.919 N/A GLU 261.A N GLY 256.A O no hydrogen 2.810 N/A VAL 264.A N TYR 316.A O no hydrogen 3.092 N/A TRP 266.A N ASP 314.A O no hydrogen 3.116 N/A TRP 266.A NE1 GLU 251.A OE2 no hydrogen 3.020 N/A ALA 268.A N GLN 312.A O no hydrogen 3.346 N/A GLY 269.A N ASP 314.A OD1 no hydrogen 3.230 N/A THR 270.A N GLN 267.A O no hydrogen 2.855 N/A THR 270.A OG1 GLN 267.A O no hydrogen 2.646 N/A THR 271.A OG1 TYR 316.A OH no hydrogen 2.883 N/A ILE 275.A N PRO 272.A O no hydrogen 3.018 N/A PHE 276.A N TRP 273.A O no hydrogen 2.982 N/A VAL 278.A N ASN 205.A OD1 no hydrogen 3.032 N/A ILE 279.A N ILE 296.A O no hydrogen 3.006 N/A SER 280.A N GLU 203.A O no hydrogen 2.996 N/A SER 280.A OG THR 295.A OG1 no hydrogen 2.848 N/A LEU 281.A N ILE 294.A O no hydrogen 2.878 N/A TYR 282.A N ARG 201.A O no hydrogen 2.782 N/A TYR 282.A OH GLU 203.A OE1 no hydrogen 3.015 N/A LEU 283.A N PHE 292.A O no hydrogen 2.844 N/A MET 284.A N ILE 198.A O no hydrogen 2.991 N/A GLY 285.A N GLN 290.A O no hydrogen 2.774 N/A GLN 290.A N VAL 287.A O no hydrogen 3.055 N/A SER 291.A OG PHE 370.A O no hydrogen 3.189 N/A PHE 292.A N LEU 283.A O no hydrogen 3.135 N/A ARG 293.A N GLU 367.A O no hydrogen 2.717 N/A ARG 293.A NE GLU 367.A OE2 no hydrogen 2.815 N/A ARG 293.A NH1 TYR 282.A OH no hydrogen 2.867 N/A ARG 293.A NH2 GLU 367.A OE2 no hydrogen 2.815 N/A ILE 294.A N LEU 281.A O no hydrogen 2.895 N/A THR 295.A N ALA 365.A O no hydrogen 2.788 N/A THR 295.A OG1 SER 280.A OG no hydrogen 2.848 N/A ILE 296.A N ILE 279.A O no hydrogen 2.637 N/A GLN 299.A N GLN 299.A OE1 no hydrogen 2.748 N/A GLN 299.A NE2 ASP 359.A OD1 no hydrogen 2.792 N/A GLN 300.A N LEU 297.A O no hydrogen 2.698 N/A TYR 301.A OH PRO 277.A O no hydrogen 2.637 N/A LEU 302.A N PRO 298.A O no hydrogen 2.972 N/A ARG 303.A N LYS 317.A O no hydrogen 2.833 N/A VAL 305.A N CYS 315.A O no hydrogen 2.639 N/A THR 310.A OG1 ASP 307.A OD2 no hydrogen 3.307 N/A GLN 312.A NE2 ASP 313.A OD2 no hydrogen 3.295 N/A ASP 313.A N THR 310.A O no hydrogen 3.402 N/A ASP 314.A N TRP 266.A O no hydrogen 2.675 N/A TYR 316.A N VAL 264.A O no hydrogen 3.008 N/A TYR 316.A OH THR 271.A OG1 no hydrogen 2.883 N/A LYS 317.A N ARG 303.A O no hydrogen 2.691 N/A LYS 317.A NZ PHE 318.A O no hydrogen 3.392 N/A ALA 319.A N TYR 301.A O no hydrogen 2.668 N/A SER 321.A N LEU 230.A O no hydrogen 3.071 N/A SER 323.A OG GLY 326.A O no hydrogen 2.765 N/A THR 325.A OG1 SER 323.A OG no hydrogen 3.378 N/A THR 327.A N LYS 220.A O no hydrogen 2.816 N/A THR 327.A OG1 TYR 216.A O no hydrogen 2.513 N/A VAL 328.A N ARG 231.A O no hydrogen 2.578 N/A MET 329.A N ILE 222.A O no hydrogen 2.798 N/A ALA 331.A N THR 227.A O no hydrogen 2.718 N/A VAL 332.A N THR 228.A O no hydrogen 2.892 N/A MET 334.A N GLY 330.A O no hydrogen 3.039 N/A GLU 335.A N ALA 331.A O no hydrogen 2.734 N/A GLY 336.A N ILE 333.A O no hydrogen 3.377 N/A PHE 337.A N MET 334.A O no hydrogen 2.964 N/A TYR 338.A N ALA 351.A O no hydrogen 2.926 N/A VAL 339.A N LEU 154.A O no hydrogen 2.993 N/A VAL 340.A N GLY 349.A O no hydrogen 2.682 N/A PHE 341.A N PHE 152.A O no hydrogen 2.675 N/A ASP 342.A N ARG 347.A O no hydrogen 2.977 N/A ARG 343.A NE ASN 150.A OD1 no hydrogen 2.926 N/A ARG 343.A NH1 TYR 195.A OH no hydrogen 2.928 N/A ARG 343.A NH2 ASP 140.A OD2 no hydrogen 2.521 N/A ALA 344.A N ASN 150.A O no hydrogen 2.929 N/A ARG 345.A N ASP 342.A OD1 no hydrogen 3.234 N/A LYS 346.A N ARG 343.A O no hydrogen 3.029 N/A ARG 347.A N ASP 342.A O no hydrogen 3.023 N/A ARG 347.A NE ASP 342.A OD2 no hydrogen 2.716 N/A ARG 347.A NH1 GLU 286.A OE1 no hydrogen 3.476 N/A ARG 347.A NH1 GLU 286.A OE2 no hydrogen 3.052 N/A ARG 347.A NH2 ASP 342.A OD2 no hydrogen 2.973 N/A ILE 348.A N THR 187.A O no hydrogen 2.776 N/A GLY 349.A N VAL 340.A O no hydrogen 2.927 N/A PHE 350.A N TRP 185.A O no hydrogen 2.855 N/A ALA 351.A N TYR 338.A O no hydrogen 3.180 N/A SER 353.A N GLY 336.A O no hydrogen 3.106 N/A ALA 354.A N LEU 179.A O no hydrogen 2.866 N/A CYS 355.A N SER 353.A OG no hydrogen 3.319 N/A CYS 355.A SG LEU 156.A O no hydrogen 3.995 N/A CYS 355.A SG SER 353.A OG no hydrogen 3.159 N/A HIS 356.A ND1 SER 353.A O no hydrogen 3.372 N/A PHE 361.A N ASP 359.A OD2 no hydrogen 2.924 N/A ARG 362.A N ASP 359.A OD2 no hydrogen 2.940 N/A ARG 362.A NH1 PHE 276.A O no hydrogen 2.935 N/A ARG 362.A NH2 PHE 276.A O no hydrogen 2.715 N/A ALA 364.A N HIS 356.A NE2 no hydrogen 3.364 N/A GLU 367.A N ARG 293.A O no hydrogen 2.966 N/A PHE 370.A N SER 291.A O no hydrogen 2.811 N/A THR 372.A N ASN 289.A O no hydrogen 2.937 N/A CYS 378.A SG GLU 376.A O no hydrogen 3.820 N/A ARG 389.A N THR 385.A O no hydrogen 3.078 N/A ARG 389.A NE ASP 386.A OD2 no hydrogen 3.152 N/A ARG 389.A NH1 GLN 384.A O no hydrogen 2.813 N/A ARG 389.A NH1 GLN 384.A OE1 no hydrogen 2.800 N/A ARG 389.A NH2 ASP 386.A OD2 no hydrogen 2.758 N/A SER 390.A N ASP 386.A O no hydrogen 3.055 N/A SER 390.A OG ASP 386.A O no hydrogen 3.406 N/A SER 390.A OG GLU 387.A O no hydrogen 2.637 N/A HIS 391.A NE2 GLU 387.A OE2 no hydrogen 3.024 N/A