Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8ru0_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 3.A N PRO 96.A O no hydrogen 2.781 N/A VAL 4.A N GLY 15.A O no hydrogen 3.246 N/A CYS 5.A N LEU 98.A O no hydrogen 2.954 N/A ASP 6.A N LYS 13.A O no hydrogen 2.665 N/A GLY 8.A N LEU 11.A O no hydrogen 3.047 N/A VAL 12.A N PHE 26.A O no hydrogen 2.974 N/A LYS 13.A NZ LEU 11.A O no hydrogen 3.239 N/A ALA 14.A N ALA 24.A O no hydrogen 3.268 N/A GLY 15.A N VAL 4.A O no hydrogen 3.233 N/A ALA 17.A N ALA 2.A O no hydrogen 2.995 N/A ALA 24.A N ALA 14.A O no hydrogen 3.341 N/A PHE 26.A N VAL 12.A O no hydrogen 3.331 N/A SER 28.A N GLY 10.A O no hydrogen 2.794 N/A VAL 30.A N LYS 63.A O no hydrogen 3.107 N/A GLY 31.A N TYR 48.A O no hydrogen 2.859 N/A ARG 32.A NH2 ASP 75.A OD1 no hydrogen 2.780 N/A TYR 48.A N GLY 31.A O no hydrogen 2.987 N/A GLY 50.A N ILE 29.A O no hydrogen 3.367 N/A GLN 54.A N GLY 50.A O no hydrogen 3.242 N/A SER 55.A N ASP 51.A O no hydrogen 2.967 N/A SER 55.A OG ASP 51.A O no hydrogen 3.301 N/A SER 55.A OG GLU 52.A O no hydrogen 2.793 N/A LYS 56.A N GLU 52.A O no hydrogen 3.257 N/A LYS 56.A NZ TYR 48.A OH no hydrogen 3.438 N/A ARG 57.A N GLN 54.A O no hydrogen 3.348 N/A ARG 57.A NH1 GLN 54.A OE1 no hydrogen 3.467 N/A LYS 63.A N VAL 30.A O no hydrogen 3.137 N/A TYR 64.A OH GLU 201.A OE2 no hydrogen 3.182 N/A GLU 67.A N ILE 69.A O no hydrogen 2.927 N/A ILE 69.A N GLU 67.A O no hydrogen 2.985 N/A THR 71.A N PRO 65.A O no hydrogen 2.895 N/A ASN 72.A N PRO 65.A O no hydrogen 3.314 N/A ASP 74.A N ASN 72.A OD1 no hydrogen 3.338 N/A LYS 78.A N ASP 74.A O no hydrogen 3.299 N/A ILE 79.A N ASP 75.A O no hydrogen 2.947 N/A TRP 80.A N MET 76.A O no hydrogen 2.991 N/A HIS 81.A N GLU 77.A O no hydrogen 2.890 N/A HIS 82.A N LYS 78.A O no hydrogen 2.927 N/A THR 83.A N ILE 79.A O no hydrogen 2.780 N/A THR 83.A OG1 ILE 79.A O no hydrogen 2.450 N/A PHE 84.A N TRP 80.A O no hydrogen 2.911 N/A TYR 85.A N HIS 81.A O no hydrogen 3.019 N/A ASN 86.A N HIS 82.A O no hydrogen 3.014 N/A GLU 87.A N HIS 82.A O no hydrogen 3.102 N/A LEU 88.A N THR 83.A O no hydrogen 3.233 N/A ARG 89.A NE ASN 86.A O no hydrogen 3.246 N/A ARG 89.A NH2 ASN 86.A O no hydrogen 3.549 N/A VAL 90.A N PHE 84.A O no hydrogen 3.113 N/A GLU 93.A N GLU 93.A OE1 no hydrogen 2.620 N/A GLU 94.A N ALA 91.A O no hydrogen 3.204 N/A THR 97.A N ALA 125.A O no hydrogen 3.301 N/A LEU 98.A N LEU 3.A O no hydrogen 2.916 N/A LEU 99.A N TYR 127.A O no hydrogen 2.839 N/A THR 100.A OG1 ASP 6.A OD1 no hydrogen 3.103 N/A GLU 101.A N ALA 129.A O no hydrogen 3.099 N/A ASN 105.A ND2 GLY 68.A O no hydrogen 2.839 N/A ASN 109.A N PRO 106.A O no hydrogen 3.117 N/A ARG 110.A NH1 PHE 369.A OXT no hydrogen 3.521 N/A ARG 110.A NH2 PHE 369.A OXT no hydrogen 3.234 N/A LYS 112.A N ALA 108.A O no hydrogen 3.206 N/A MET 113.A N ASN 109.A O no hydrogen 3.141 N/A THR 114.A N ARG 110.A O no hydrogen 2.764 N/A THR 114.A OG1 ARG 110.A O no hydrogen 2.976 N/A GLN 115.A N GLU 111.A O no hydrogen 2.915 N/A ILE 116.A N LYS 112.A O no hydrogen 2.942 N/A MET 117.A N MET 113.A O no hydrogen 3.065 N/A PHE 118.A N THR 114.A O no hydrogen 3.185 N/A GLU 119.A N GLN 115.A O no hydrogen 3.125 N/A GLU 119.A N ILE 116.A O no hydrogen 3.374 N/A THR 120.A N ILE 116.A O no hydrogen 2.765 N/A THR 120.A OG1 ILE 116.A O no hydrogen 3.273 N/A PHE 121.A N ILE 116.A O no hydrogen 3.431 N/A VAL 123.A N MET 117.A O no hydrogen 3.184 N/A MET 126.A N ILE 351.A O no hydrogen 3.179 N/A ALA 129.A N LEU 99.A O no hydrogen 2.954 N/A LEU 134.A N ILE 130.A O no hydrogen 3.269 N/A SER 135.A N GLN 131.A O no hydrogen 3.072 N/A SER 135.A OG GLN 131.A O no hydrogen 2.841 N/A SER 135.A OG ASP 148.A OD2 no hydrogen 2.948 N/A SER 135.A OG SER 294.A OG no hydrogen 3.288 N/A LEU 136.A N ALA 132.A O no hydrogen 3.283 N/A TYR 137.A N VAL 133.A O no hydrogen 3.129 N/A ALA 138.A N LEU 134.A O no hydrogen 3.246 N/A SER 139.A N LEU 136.A O no hydrogen 3.241 N/A GLY 140.A N TYR 137.A O no hydrogen 3.432 N/A THR 143.A OG1 THR 142.A O no hydrogen 2.813 N/A THR 143.A OG1 GLU 161.A OE1 no hydrogen 2.724 N/A GLY 144.A N ILE 159.A O no hydrogen 2.808 N/A ILE 145.A N ASN 290.A O no hydrogen 3.307 N/A VAL 146.A N VAL 157.A O no hydrogen 3.318 N/A LEU 147.A N VAL 292.A O no hydrogen 2.871 N/A ASP 148.A N HIS 155.A O no hydrogen 3.104 N/A SER 149.A N SER 294.A O no hydrogen 3.137 N/A SER 149.A OG THR 154.A OG1 no hydrogen 2.852 N/A THR 154.A N LEU 172.A O no hydrogen 2.724 N/A THR 154.A OG1 SER 149.A OG no hydrogen 2.852 N/A THR 154.A OG1 LEU 174.A O no hydrogen 2.806 N/A HIS 155.A N ASP 148.A O no hydrogen 3.288 N/A ASN 156.A N MET 170.A O no hydrogen 2.761 N/A ASN 156.A ND2 THR 272.A OG1 no hydrogen 3.105 N/A VAL 157.A N VAL 146.A O no hydrogen 3.369 N/A ILE 159.A N GLY 144.A O no hydrogen 3.092 N/A TYR 160.A N TYR 163.A O no hydrogen 2.917 N/A TYR 160.A OH ASP 286.A OD2 no hydrogen 3.330 N/A GLU 161.A N THR 143.A OG1 no hydrogen 2.803 N/A GLY 162.A N THR 142.A O no hydrogen 3.088 N/A TYR 163.A N TYR 160.A O no hydrogen 2.920 N/A LEU 165.A N PRO 158.A O no hydrogen 3.409 N/A ALA 168.A N LEU 165.A O no hydrogen 3.292 N/A ILE 169.A N PRO 166.A O no hydrogen 3.447 N/A MET 170.A N ASN 156.A O no hydrogen 3.120 N/A ARG 171.A NH1 ASN 105.A OD1 no hydrogen 2.899 N/A LEU 172.A N THR 154.A O no hydrogen 2.602 N/A GLY 176.A N GLY 150.A O no hydrogen 2.877 N/A ARG 177.A N ASP 151.A O no hydrogen 3.384 N/A ARG 177.A NE ASP 151.A OD2 no hydrogen 2.911 N/A ARG 177.A NH1 ILE 66.A O no hydrogen 3.374 N/A ARG 177.A NH2 SER 9.A O no hydrogen 2.868 N/A ARG 177.A NH2 ASP 151.A OD2 no hydrogen 2.870 N/A LEU 179.A N ALA 175.A O no hydrogen 3.310 N/A THR 180.A N GLY 176.A O no hydrogen 2.932 N/A THR 180.A OG1 GLY 176.A O no hydrogen 3.019 N/A ASP 181.A N ARG 177.A O no hydrogen 3.112 N/A TYR 182.A N ASP 178.A O no hydrogen 2.922 N/A LEU 183.A N LEU 179.A O no hydrogen 2.955 N/A MET 184.A N THR 180.A O no hydrogen 2.912 N/A LYS 185.A N ASP 181.A O no hydrogen 2.930 N/A ILE 186.A N TYR 182.A O no hydrogen 2.990 N/A LEU 187.A N LEU 183.A O no hydrogen 2.986 N/A THR 188.A N LYS 185.A O no hydrogen 3.271 N/A THR 188.A OG1 LYS 185.A O no hydrogen 2.575 N/A GLU 189.A N ILE 186.A O no hydrogen 3.258 N/A GLY 191.A N THR 188.A O no hydrogen 3.336 N/A TYR 192.A OH THR 243.A O no hydrogen 3.285 N/A ARG 200.A N THR 196.A O no hydrogen 2.893 N/A GLU 201.A N THR 197.A O no hydrogen 3.340 N/A ILE 202.A N ALA 198.A O no hydrogen 3.433 N/A VAL 203.A N GLU 199.A O no hydrogen 2.964 N/A ARG 204.A N ARG 200.A O no hydrogen 2.948 N/A ARG 204.A NE GLU 201.A OE1 no hydrogen 3.190 N/A ARG 204.A NH2 GLU 201.A OE1 no hydrogen 2.762 N/A ASP 205.A N GLU 201.A O no hydrogen 2.994 N/A ILE 206.A N ILE 202.A O no hydrogen 3.020 N/A LYS 207.A N VAL 203.A O no hydrogen 2.962 N/A LYS 207.A NZ GLY 176.A O no hydrogen 3.173 N/A LYS 207.A NZ THR 180.A OG1 no hydrogen 2.840 N/A GLU 208.A N ARG 204.A O no hydrogen 3.029 N/A LYS 209.A N ASP 205.A O no hydrogen 3.147 N/A LYS 209.A N ILE 206.A O no hydrogen 3.241 N/A LEU 210.A N ILE 206.A O no hydrogen 2.982 N/A CYS 211.A SG LEU 210.A O no hydrogen 3.063 N/A CYS 211.A SG ARG 248.A O no hydrogen 3.489 N/A TYR 212.A N ARG 248.A O no hydrogen 3.336 N/A VAL 213.A N PRO 301.A O no hydrogen 3.381 N/A ASP 216.A N GLU 220.A OE1 no hydrogen 2.850 N/A GLU 220.A N ASP 216.A O no hydrogen 2.974 N/A MET 221.A N PHE 217.A O no hydrogen 3.177 N/A ALA 222.A N GLU 218.A O no hydrogen 3.201 N/A THR 223.A N ASN 219.A O no hydrogen 3.087 N/A THR 223.A OG1 ASN 219.A O no hydrogen 3.301 N/A THR 223.A OG1 GLU 220.A O no hydrogen 2.670 N/A ALA 224.A N GLU 220.A O no hydrogen 3.144 N/A ALA 225.A N MET 221.A O no hydrogen 3.206 N/A SER 226.A N ALA 222.A O no hydrogen 3.038 N/A SER 226.A OG ALA 222.A O no hydrogen 3.404 N/A SER 226.A OG THR 223.A O no hydrogen 2.876 N/A SER 227.A N THR 223.A O no hydrogen 2.995 N/A SER 227.A OG THR 223.A O no hydrogen 3.396 N/A SER 227.A OG SER 229.A OG no hydrogen 3.213 N/A SER 229.A OG SER 227.A OG no hydrogen 3.213 N/A GLU 231.A N SER 228.A O no hydrogen 3.254 N/A LYS 232.A N ILE 244.A O no hydrogen 3.481 N/A TYR 234.A N ILE 242.A O no hydrogen 3.048 N/A LEU 236.A N GLN 240.A O no hydrogen 2.570 N/A ILE 242.A N TYR 234.A O no hydrogen 2.908 N/A THR 243.A N TYR 192.A OH no hydrogen 3.393 N/A ILE 244.A N LYS 232.A O no hydrogen 3.353 N/A GLY 245.A N GLU 247.A OE1 no hydrogen 2.853 N/A GLU 247.A N GLU 247.A OE1 no hydrogen 2.727 N/A ARG 248.A N GLY 245.A O no hydrogen 3.201 N/A CYS 251.A N GLU 247.A O no hydrogen 3.456 N/A CYS 251.A SG LEU 179.A O no hydrogen 3.241 N/A GLU 253.A N ARG 250.A O no hydrogen 3.283 N/A THR 254.A N CYS 251.A O no hydrogen 3.485 N/A THR 254.A OG1 CYS 251.A O no hydrogen 3.112 N/A LEU 255.A N PRO 252.A O no hydrogen 3.388 N/A PHE 256.A N GLU 253.A O no hydrogen 3.050 N/A GLN 257.A N GLU 253.A O no hydrogen 2.869 N/A GLN 257.A NE2 GLU 253.A OE2 no hydrogen 3.260 N/A PHE 260.A N GLN 257.A O no hydrogen 3.254 N/A GLY 262.A N SER 259.A O no hydrogen 3.173 N/A MET 263.A N PRO 258.A O no hydrogen 3.191 N/A ILE 268.A N LEU 255.A O no hydrogen 3.329 N/A THR 271.A N GLY 267.A O no hydrogen 2.835 N/A THR 271.A OG1 GLY 267.A O no hydrogen 2.900 N/A THR 272.A N ILE 268.A O no hydrogen 2.887 N/A THR 272.A OG1 ILE 268.A O no hydrogen 2.651 N/A TYR 273.A N HIS 269.A O no hydrogen 3.089 N/A ASN 274.A N GLU 270.A O no hydrogen 2.863 N/A SER 275.A N THR 271.A O no hydrogen 2.967 N/A SER 275.A OG ALA 168.A O no hydrogen 2.782 N/A ILE 276.A N THR 272.A O no hydrogen 3.124 N/A MET 277.A N TYR 273.A O no hydrogen 3.001 N/A LYS 278.A N ASN 274.A O no hydrogen 3.146 N/A LYS 278.A N SER 275.A O no hydrogen 3.294 N/A CYS 279.A N ILE 276.A O no hydrogen 3.104 N/A CYS 279.A SG SER 275.A O no hydrogen 3.356 N/A ILE 283.A N ASP 280.A O no hydrogen 3.314 N/A ARG 284.A NE CYS 279.A O no hydrogen 3.254 N/A ARG 284.A NH2 CYS 279.A O no hydrogen 3.099 N/A LYS 285.A NZ ASP 286.A OD1 no hydrogen 3.375 N/A LEU 287.A N ILE 283.A O no hydrogen 3.099 N/A TYR 288.A N ARG 284.A O no hydrogen 2.998 N/A ASN 290.A N ASP 286.A O no hydrogen 3.223 N/A ASN 290.A ND2 THR 143.A O no hydrogen 2.809 N/A VAL 292.A N ILE 145.A O no hydrogen 3.078 N/A MET 293.A N ILE 324.A O no hydrogen 2.857 N/A SER 294.A N LEU 147.A O no hydrogen 3.332 N/A SER 294.A OG SER 135.A OG no hydrogen 3.288 N/A SER 294.A OG ASP 148.A OD2 no hydrogen 2.970 N/A GLY 295.A N ARG 329.A O no hydrogen 2.826 N/A THR 297.A OG1 GLY 150.A O no hydrogen 2.257 N/A THR 298.A OG1 GLY 295.A O no hydrogen 2.653 N/A MET 299.A N GLY 296.A O no hydrogen 3.276 N/A ILE 303.A N TYR 300.A O no hydrogen 3.456 N/A ARG 306.A N GLY 302.A O no hydrogen 2.941 N/A ARG 306.A NH1 GLU 253.A OE1 no hydrogen 2.839 N/A ARG 306.A NH1 GLU 253.A OE2 no hydrogen 3.107 N/A ARG 306.A NH2 GLU 253.A OE2 no hydrogen 2.443 N/A MET 307.A N ILE 303.A O no hydrogen 2.854 N/A GLN 308.A N ALA 304.A O no hydrogen 3.053 N/A GLN 308.A NE2 ILE 321.A O no hydrogen 2.916 N/A LYS 309.A N ASP 305.A O no hydrogen 3.141 N/A GLU 310.A N ARG 306.A O no hydrogen 2.979 N/A ILE 311.A N MET 307.A O no hydrogen 3.004 N/A THR 312.A N GLN 308.A O no hydrogen 3.181 N/A THR 312.A OG1 GLN 308.A O no hydrogen 2.711 N/A ALA 313.A N LYS 309.A O no hydrogen 3.297 N/A LEU 314.A N GLU 310.A O no hydrogen 3.392 N/A ALA 315.A N ILE 311.A O no hydrogen 2.769 N/A MET 319.A N PRO 316.A O no hydrogen 3.281 N/A LYS 322.A N TYR 288.A O no hydrogen 3.528 N/A ILE 324.A N ASN 291.A O no hydrogen 2.769 N/A ARG 329.A N PRO 326.A O no hydrogen 3.168 N/A ARG 329.A NE THR 298.A O no hydrogen 3.170 N/A ARG 329.A NH1 PRO 326.A O no hydrogen 3.182 N/A ARG 329.A NH2 THR 298.A O no hydrogen 3.512 N/A TYR 331.A N GLU 328.A O no hydrogen 3.329 N/A SER 332.A OG GLU 328.A O no hydrogen 3.502 N/A TRP 334.A NE1 VAL 4.A O no hydrogen 2.859 N/A ILE 335.A N TYR 331.A O no hydrogen 3.080 N/A GLY 336.A N SER 332.A O no hydrogen 3.044 N/A GLY 337.A N VAL 333.A O no hydrogen 3.069 N/A SER 338.A N TRP 334.A O no hydrogen 2.960 N/A SER 338.A OG ILE 335.A O no hydrogen 2.724 N/A ILE 339.A N ILE 335.A O no hydrogen 3.116 N/A LEU 340.A N GLY 336.A O no hydrogen 2.874 N/A ALA 341.A N GLY 337.A O no hydrogen 3.047 N/A SER 342.A N SER 338.A O no hydrogen 3.123 N/A SER 342.A OG SER 338.A O no hydrogen 2.728 N/A LEU 343.A N LEU 340.A O no hydrogen 3.184 N/A GLN 347.A N SER 344.A O no hydrogen 3.476 N/A GLN 347.A NE2 LEU 343.A O no hydrogen 3.612 N/A GLN 348.A N THR 345.A O no hydrogen 3.496 N/A MET 349.A N PHE 346.A O no hydrogen 3.265 N/A ILE 351.A N MET 126.A O no hydrogen 2.915 N/A THR 352.A N GLU 355.A OE1 no hydrogen 2.344 N/A THR 352.A OG1 GLU 355.A OE1 no hydrogen 2.873 N/A LYS 353.A NZ PHE 118.A O no hydrogen 3.527 N/A TYR 356.A N THR 352.A O no hydrogen 3.403 N/A TYR 356.A OH GLU 119.A OE2 no hydrogen 2.388 N/A ASP 357.A N LYS 353.A O no hydrogen 2.853 N/A GLU 358.A N GLN 354.A O no hydrogen 3.125 N/A ALA 359.A N GLU 355.A O no hydrogen 3.180 N/A GLY 360.A N TYR 356.A O no hydrogen 2.913 N/A LYS 367.A N ILE 363.A O no hydrogen 3.116 N/A LYS 367.A NZ TRP 350.A O no hydrogen 3.520 N/A LYS 367.A NZ GLU 355.A OE2 no hydrogen 2.419 N/A CYS 368.A N VAL 364.A O no hydrogen 3.061 N/A CYS 368.A SG VAL 128.A O no hydrogen 3.476 N/A