Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5cyk_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 4.A N PRO 1.A O no hydrogen 3.009 N/A THR 9.A N MET 350.A O no hydrogen 2.766 N/A THR 9.A OG1 MET 350.A O no hydrogen 3.308 N/A VAL 10.A N MET 350.A O no hydrogen 2.934 N/A GLN 12.A N LEU 348.A O no hydrogen 2.887 N/A THR 13.A N LEU 348.A O no hydrogen 3.439 N/A THR 13.A OG1 LEU 49.A O no hydrogen 2.871 N/A PHE 15.A N ALA 346.A O no hydrogen 2.698 N/A HIS 18.A ND1 ASP 40.A OD1 no hydrogen 3.011 N/A HIS 18.A NE2 THR 36.A OG1 no hydrogen 2.826 N/A ARG 21.A NE ASP 39.A OD2 no hydrogen 2.998 N/A VAL 22.A N GLY 341.A O no hydrogen 3.113 N/A ARG 23.A N GLY 37.A O no hydrogen 2.935 N/A SER 24.A OG ASP 327.A OD2 no hydrogen 3.267 N/A VAL 25.A N ASP 327.A OD2 no hydrogen 2.913 N/A ALA 26.A N ALA 35.A O no hydrogen 3.033 N/A ILE 27.A N ASP 329.A OD2 no hydrogen 3.291 N/A ASP 28.A N ALA 33.A O no hydrogen 2.971 N/A THR 30.A N ASP 28.A OD1 no hydrogen 2.409 N/A THR 30.A OG1 ASP 28.A OD1 no hydrogen 2.847 N/A THR 30.A OG1 ASP 28.A OD2 no hydrogen 3.438 N/A GLY 31.A N ASP 28.A O no hydrogen 2.715 N/A LEU 34.A N TRP 46.A O no hydrogen 2.891 N/A ALA 35.A N ALA 26.A O no hydrogen 2.943 N/A THR 36.A N ARG 44.A O no hydrogen 2.904 N/A THR 36.A OG1 HIS 18.A NE2 no hydrogen 2.826 N/A GLY 38.A N THR 42.A O no hydrogen 2.905 N/A ASP 39.A N ARG 21.A O no hydrogen 3.039 N/A ASP 40.A N ASP 40.A OD1 no hydrogen 2.433 N/A GLY 41.A N GLY 38.A O no hydrogen 3.410 N/A THR 42.A OG1 ASP 40.A OD2 no hydrogen 2.891 N/A VAL 43.A N VAL 57.A O no hydrogen 2.887 N/A ARG 44.A N THR 36.A O no hydrogen 2.942 N/A ARG 44.A NE GLN 53.A OE1 no hydrogen 2.916 N/A ARG 44.A NH2 GLN 53.A OE1 no hydrogen 3.553 N/A VAL 45.A N TRP 55.A O no hydrogen 2.861 N/A TRP 46.A N LEU 34.A O no hydrogen 2.902 N/A GLU 47.A N GLU 52.A O no hydrogen 2.811 N/A LEU 48.A N VAL 32.A O no hydrogen 3.397 N/A THR 50.A OG1 GLU 47.A OE1 no hydrogen 2.436 N/A GLY 51.A N GLU 47.A O no hydrogen 2.915 N/A GLU 52.A N THR 50.A OG1 no hydrogen 3.308 N/A VAL 54.A N VAL 45.A O no hydrogen 3.033 N/A TRP 55.A N VAL 45.A O no hydrogen 2.984 N/A VAL 57.A N VAL 43.A O no hydrogen 2.917 N/A LEU 59.A N GLY 41.A O no hydrogen 3.332 N/A VAL 65.A N GLY 38.A O no hydrogen 2.708 N/A ASN 66.A N ALA 82.A O no hydrogen 2.879 N/A THR 67.A OG1 LYS 141.A O no hydrogen 2.605 N/A VAL 68.A N SER 24.A OG no hydrogen 3.175 N/A ARG 69.A N ALA 80.A O no hydrogen 2.859 N/A ARG 69.A NH1 VAL 68.A O no hydrogen 3.242 N/A TRP 70.A NE1 ALA 26.A O no hydrogen 2.598 N/A ARG 71.A N ILE 78.A O no hydrogen 2.865 N/A ARG 71.A NH1 THR 73.A OG1 no hydrogen 2.869 N/A THR 73.A N ARG 71.A O no hydrogen 2.619 N/A THR 73.A OG1 THR 76.A OG1 no hydrogen 2.879 N/A LYS 74.A NZ PRO 29.A O no hydrogen 3.162 N/A ASP 75.A N ASP 75.A OD1 no hydrogen 2.336 N/A THR 76.A OG1 THR 73.A O no hydrogen 2.915 N/A THR 76.A OG1 THR 73.A OG1 no hydrogen 2.879 N/A LEU 79.A N MET 90.A O no hydrogen 2.906 N/A ALA 80.A N ARG 69.A O no hydrogen 3.019 N/A ALA 81.A N PHE 88.A O no hydrogen 2.935 N/A ALA 82.A N THR 67.A O no hydrogen 2.838 N/A ALA 83.A N ASP 86.A O no hydrogen 2.866 N/A ASP 86.A N ALA 83.A O no hydrogen 2.911 N/A ILE 87.A N ILE 134.A O no hydrogen 2.876 N/A PHE 88.A N ALA 81.A O no hydrogen 2.859 N/A LEU 89.A N LEU 132.A O no hydrogen 2.911 N/A MET 90.A N LEU 79.A O no hydrogen 2.913 N/A ILE 91.A N GLY 129.A O no hydrogen 3.011 N/A SER 96.A N HIS 94.A ND1 no hydrogen 3.122 N/A VAL 97.A N HIS 94.A O no hydrogen 2.989 N/A LEU 101.A N THR 98.A OG1 no hydrogen 3.223 N/A ASP 102.A N THR 98.A O no hydrogen 2.949 N/A GLN 103.A N PRO 99.A O no hydrogen 2.925 N/A GLN 103.A NE2 ASP 107.A OD1 no hydrogen 3.486 N/A ALA 104.A N ALA 100.A O no hydrogen 2.897 N/A SER 105.A N LEU 101.A O no hydrogen 2.946 N/A SER 105.A OG THR 76.A O no hydrogen 2.246 N/A SER 105.A OG LEU 101.A O no hydrogen 2.634 N/A ARG 106.A N ASP 102.A O no hydrogen 2.886 N/A ARG 106.A NH1 ASP 102.A OD1 no hydrogen 3.205 N/A ARG 106.A NH1 ASP 102.A OD2 no hydrogen 3.471 N/A ASP 107.A N GLN 103.A O no hydrogen 2.900 N/A ILE 108.A N ALA 104.A O no hydrogen 2.952 N/A LEU 109.A N SER 105.A O no hydrogen 2.918 N/A ASN 110.A N ARG 106.A O no hydrogen 2.887 N/A ALA 111.A N ASP 107.A O no hydrogen 3.167 N/A PHE 113.A N ASN 110.A O no hydrogen 3.283 N/A LYS 117.A N THR 135.A O no hydrogen 2.919 N/A ALA 119.A N ARG 133.A O no hydrogen 2.906 N/A ARG 124.A NH2 LYS 58.A O no hydrogen 3.119 N/A LEU 125.A N GLY 122.A O no hydrogen 2.895 N/A ASP 127.A N THR 123.A O no hydrogen 2.954 N/A GLU 128.A N ARG 124.A O no hydrogen 3.238 N/A VAL 130.A N LEU 125.A O no hydrogen 2.478 N/A LEU 132.A N LEU 89.A O no hydrogen 2.948 N/A ARG 133.A N ALA 119.A O no hydrogen 2.881 N/A ILE 134.A N ILE 87.A O no hydrogen 2.907 N/A THR 135.A N LYS 117.A O no hydrogen 2.943 N/A THR 135.A OG1 ASP 86.A OD1 no hydrogen 2.655 N/A VAL 136.A N GLU 85.A O no hydrogen 3.226 N/A SER 138.A OG SER 158.A OG no hydrogen 2.977 N/A ILE 140.A N GLY 84.A O no hydrogen 2.721 N/A LYS 141.A N VAL 155.A O no hydrogen 2.795 N/A LYS 141.A NZ GLN 186.A OE1 no hydrogen 3.170 N/A ALA 142.A N VAL 155.A O no hydrogen 3.025 N/A SER 144.A N ALA 153.A O no hydrogen 2.921 N/A TRP 145.A NE1 ARG 69.A O no hydrogen 2.952 N/A HIS 146.A N HIS 151.A O no hydrogen 3.020 N/A ARG 148.A N HIS 146.A ND1 no hydrogen 3.435 N/A GLY 149.A N HIS 146.A O no hydrogen 2.739 N/A PHE 152.A N HIS 167.A O no hydrogen 2.936 N/A ALA 153.A N SER 144.A O no hydrogen 2.848 N/A THR 154.A N ALA 165.A O no hydrogen 2.886 N/A THR 154.A OG1 HIS 167.A NE2 no hydrogen 3.233 N/A VAL 155.A N ALA 142.A O no hydrogen 2.901 N/A SER 156.A N SER 163.A O no hydrogen 2.807 N/A SER 156.A OG SER 138.A O no hydrogen 3.024 N/A SER 158.A OG SER 138.A OG no hydrogen 2.977 N/A SER 162.A OG SER 162.A O no hydrogen 2.659 N/A SER 163.A N GLN 160.A O no hydrogen 3.206 N/A SER 163.A OG SER 156.A O no hydrogen 3.358 N/A SER 163.A OG GLY 159.A O no hydrogen 2.698 N/A SER 163.A OG GLN 160.A O no hydrogen 3.326 N/A ALA 165.A N THR 154.A O no hydrogen 2.944 N/A ILE 166.A N GLN 175.A O no hydrogen 2.880 N/A HIS 167.A N PHE 152.A O no hydrogen 2.852 N/A HIS 167.A NE2 THR 154.A OG1 no hydrogen 3.233 N/A THR 168.A N LEU 173.A O no hydrogen 2.845 N/A LEU 169.A N ASP 150.A O no hydrogen 2.901 N/A SER 170.A OG ASP 150.A OD1 no hydrogen 2.417 N/A SER 170.A OG ASP 150.A OD2 no hydrogen 2.998 N/A LEU 173.A N THR 168.A O no hydrogen 2.940 N/A THR 174.A OG1 GLY 116.A O no hydrogen 3.425 N/A GLN 175.A N ILE 166.A O no hydrogen 2.913 N/A ARG 179.A NH2 ARG 161.A O no hydrogen 3.225 N/A LEU 184.A N GLN 202.A OE1 no hydrogen 3.071 N/A GLN 186.A N ALA 200.A O no hydrogen 2.869 N/A GLN 186.A NE2 LEU 184.A O no hydrogen 3.161 N/A THR 187.A N ALA 200.A O no hydrogen 3.367 N/A SER 189.A N PHE 198.A O no hydrogen 2.896 N/A SER 189.A OG PHE 190.A O no hydrogen 3.515 N/A HIS 191.A N LEU 196.A O no hydrogen 3.397 N/A LEU 193.A N HIS 191.A ND1 no hydrogen 3.067 N/A ARG 194.A N HIS 191.A ND1 no hydrogen 3.131 N/A LEU 196.A N ARG 194.A O no hydrogen 2.629 N/A PHE 197.A N TYR 208.A O no hydrogen 2.929 N/A PHE 198.A N SER 189.A O no hydrogen 2.755 N/A VAL 199.A N ARG 206.A O no hydrogen 2.896 N/A ALA 200.A N THR 187.A O no hydrogen 2.886 N/A THR 201.A N SER 204.A O no hydrogen 2.970 N/A THR 201.A OG1 SER 204.A O no hydrogen 3.048 N/A GLN 202.A N LEU 184.A O no hydrogen 3.098 N/A GLN 202.A N GLN 202.A OE1 no hydrogen 2.893 N/A SER 204.A N THR 201.A OG1 no hydrogen 3.354 N/A ILE 205.A N VAL 219.A O no hydrogen 2.955 N/A ARG 206.A N VAL 199.A O no hydrogen 2.892 N/A ARG 206.A NH1 LEU 181.A O no hydrogen 2.767 N/A ARG 206.A NH2 LEU 181.A O no hydrogen 2.216 N/A CYS 207.A N LYS 217.A O no hydrogen 2.881 N/A CYS 207.A SG PHE 197.A O no hydrogen 3.445 N/A CYS 207.A SG TYR 208.A O no hydrogen 3.851 N/A TYR 208.A N PHE 197.A O no hydrogen 2.874 N/A ASP 209.A N GLU 214.A O no hydrogen 2.862 N/A VAL 216.A N CYS 207.A O no hydrogen 2.891 N/A LYS 217.A N CYS 207.A O no hydrogen 2.974 N/A VAL 219.A N ILE 205.A O no hydrogen 2.870 N/A GLN 220.A NE2 ARG 203.A O no hydrogen 2.560 N/A LYS 224.A N ASP 244.A OD2 no hydrogen 2.713 N/A ILE 226.A N GLN 202.A O no hydrogen 3.208 N/A SER 227.A N GLY 241.A O no hydrogen 2.901 N/A SER 227.A OG SER 228.A OG no hydrogen 3.235 N/A SER 227.A OG GLY 241.A O no hydrogen 2.560 N/A SER 227.A OG ILE 269.A O no hydrogen 2.387 N/A SER 228.A N GLY 241.A O no hydrogen 2.976 N/A SER 228.A OG SER 227.A OG no hydrogen 3.235 N/A SER 228.A OG ARG 270.A O no hydrogen 3.448 N/A ASP 230.A N VAL 239.A O no hydrogen 2.928 N/A HIS 232.A N ASN 237.A O no hydrogen 3.037 N/A GLY 234.A N HIS 232.A ND1 no hydrogen 2.816 N/A GLY 235.A N HIS 232.A O no hydrogen 2.922 N/A LEU 238.A N HIS 250.A O no hydrogen 2.973 N/A VAL 239.A N ASP 230.A O no hydrogen 2.933 N/A VAL 240.A N LEU 248.A O no hydrogen 2.896 N/A GLY 241.A N SER 228.A O no hydrogen 2.890 N/A SER 242.A OG ARG 246.A O no hydrogen 3.157 N/A ASP 244.A N SER 242.A OG no hydrogen 3.197 N/A LYS 245.A NZ THR 266.A O no hydrogen 3.112 N/A LEU 247.A N MET 262.A O no hydrogen 2.889 N/A LEU 248.A N VAL 240.A O no hydrogen 2.898 N/A TRP 249.A N LYS 260.A O no hydrogen 2.896 N/A TRP 249.A NE1 ASN 237.A OD1 no hydrogen 3.011 N/A HIS 250.A N LEU 238.A O no hydrogen 2.896 N/A LEU 252.A N ASP 236.A O no hydrogen 3.301 N/A ASP 253.A N ASP 251.A OD1 no hydrogen 3.063 N/A SER 255.A N ASP 251.A O no hydrogen 3.310 N/A ARG 257.A N SER 255.A OG no hydrogen 2.851 N/A LYS 260.A N TRP 249.A O no hydrogen 3.029 N/A MET 262.A N LEU 247.A O no hydrogen 2.882 N/A HIS 265.A NE2 ASP 284.A OD1 no hydrogen 2.484 N/A GLU 267.A N ASP 288.A OD1 no hydrogen 3.331 N/A ILE 269.A N SER 242.A O no hydrogen 2.906 N/A ARG 270.A N ALA 285.A O no hydrogen 2.875 N/A ARG 273.A N ALA 283.A O no hydrogen 3.188 N/A PHE 274.A N ASP 230.A OD2 no hydrogen 2.699 N/A HIS 275.A N LEU 281.A O no hydrogen 2.917 N/A LEU 281.A N LEU 279.A O no hydrogen 2.670 N/A PHE 282.A N PHE 294.A O no hydrogen 2.943 N/A ALA 283.A N ARG 273.A O no hydrogen 3.317 N/A ASP 284.A N GLN 292.A O no hydrogen 2.973 N/A ALA 285.A N ALA 271.A O no hydrogen 2.749 N/A SER 286.A N SER 290.A O no hydrogen 3.321 N/A SER 286.A OG GLU 267.A O no hydrogen 3.226 N/A SER 286.A OG ALA 268.A O no hydrogen 3.272 N/A SER 286.A OG ASP 288.A OD1 no hydrogen 2.227 N/A ASP 287.A N ALA 268.A O no hydrogen 2.877 N/A SER 290.A OG ASP 288.A OD2 no hydrogen 2.491 N/A LEU 291.A N LEU 314.A O no hydrogen 2.891 N/A GLN 292.A N ASP 284.A O no hydrogen 2.946 N/A GLN 292.A NE2 ILE 293.A O no hydrogen 3.446 N/A ILE 293.A N LYS 312.A O no hydrogen 2.856 N/A PHE 294.A N PHE 282.A O no hydrogen 2.873 N/A HIS 295.A N VAL 309.A O no hydrogen 2.667 N/A GLY 296.A N PRO 280.A O no hydrogen 2.974 N/A LYS 297.A N THR 307.A O no hydrogen 3.235 N/A LEU 303.A N ASP 253.A OD2 no hydrogen 3.362 N/A ASN 305.A N GLU 304.A OE1 no hydrogen 2.541 N/A VAL 309.A N HIS 295.A O no hydrogen 2.727 N/A VAL 311.A N ILE 293.A O no hydrogen 2.808 N/A LYS 312.A N ILE 293.A O no hydrogen 3.027 N/A LEU 314.A N LEU 291.A O no hydrogen 2.907 N/A HIS 317.A ND1 ASP 343.A OD2 no hydrogen 2.394 N/A HIS 317.A NE2 SER 339.A OG no hydrogen 2.648 N/A LYS 318.A N ASP 343.A OD1 no hydrogen 3.142 N/A LYS 318.A N ASP 343.A OD2 no hydrogen 3.165 N/A VAL 320.A N LEU 323.A O no hydrogen 3.162 N/A GLY 324.A N ASP 287.A OD1 no hydrogen 3.116 N/A LEU 326.A N ALA 340.A O no hydrogen 2.499 N/A ASP 327.A N ALA 340.A O no hydrogen 2.992 N/A ASP 329.A N VAL 338.A O no hydrogen 2.929 N/A TRP 330.A NE1 ARG 273.A O no hydrogen 2.887 N/A HIS 331.A N TRP 336.A O no hydrogen 3.012 N/A ARG 333.A N HIS 331.A ND1 no hydrogen 3.040 N/A ARG 333.A NH1 THR 30.A O no hydrogen 2.877 N/A GLU 334.A N HIS 331.A ND1 no hydrogen 2.925 N/A CYS 337.A N TRP 349.A O no hydrogen 2.999 N/A VAL 338.A N ASP 329.A O no hydrogen 2.896 N/A SER 339.A N ARG 347.A O no hydrogen 2.923 N/A SER 339.A OG HIS 317.A NE2 no hydrogen 2.648 N/A ALA 340.A N ASP 327.A O no hydrogen 2.898 N/A GLY 341.A N THR 345.A O no hydrogen 3.264 N/A THR 345.A OG1 ASP 343.A OD2 no hydrogen 3.012 N/A ALA 346.A N PHE 15.A O no hydrogen 2.978 N/A ARG 347.A N SER 339.A O no hydrogen 2.925 N/A ARG 347.A NE ASP 343.A OD2 no hydrogen 3.234 N/A ARG 347.A NE THR 345.A OG1 no hydrogen 3.139 N/A ARG 347.A NH1 GLN 11.A OE1 no hydrogen 3.096 N/A ARG 347.A NH2 ASP 343.A OD2 no hydrogen 2.972 N/A LEU 348.A N THR 13.A O no hydrogen 2.816 N/A TRP 349.A N CYS 337.A O no hydrogen 2.848 N/A TRP 349.A NE1 SER 339.A OG no hydrogen 3.336 N/A MET 350.A N VAL 10.A O no hydrogen 2.942 N/A