Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8kd6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A NH2 ILE 287.A O no hydrogen 2.854 N/A ARG 4.A NE LYS 122.A O no hydrogen 2.625 N/A ARG 4.A NH2 GLY 121.A O no hydrogen 2.806 N/A ALA 6.A N VAL 125.A O no hydrogen 2.911 N/A TYR 7.A N GLU 46.A O no hydrogen 3.340 N/A PHE 8.A N VAL 127.A O no hydrogen 2.900 N/A ASP 12.A N ASP 10.A OD1 no hydrogen 3.393 N/A TYR 18.A OH TYR 103.A OH no hydrogen 2.986 N/A LYS 25.A NZ HIS 22.A O no hydrogen 3.036 N/A ARG 28.A NH1 LYS 25.A O no hydrogen 2.385 N/A ARG 28.A NH2 GLY 295.A O no hydrogen 3.350 N/A ARG 30.A N HIS 27.A O no hydrogen 3.474 N/A ALA 32.A N ARG 28.A O no hydrogen 2.966 N/A HIS 33.A N ILE 29.A O no hydrogen 2.897 N/A SER 34.A N ARG 30.A O no hydrogen 2.907 N/A SER 34.A OG GLU 326.A OE1 no hydrogen 2.679 N/A SER 34.A OG GLU 326.A OE2 no hydrogen 3.362 N/A SER 34.A OG ALA 386.A O no hydrogen 3.522 N/A LEU 35.A N MET 31.A O no hydrogen 2.874 N/A ILE 36.A N ALA 32.A O no hydrogen 2.878 N/A MET 37.A N HIS 33.A O no hydrogen 3.042 N/A ASN 38.A N SER 34.A O no hydrogen 2.868 N/A ASN 38.A ND2 SER 34.A O no hydrogen 2.440 N/A ASN 38.A ND2 ALA 386.A O no hydrogen 3.475 N/A TYR 39.A N LEU 35.A O no hydrogen 3.148 N/A GLY 40.A N MET 37.A O no hydrogen 3.327 N/A LEU 41.A N ILE 36.A O no hydrogen 3.499 N/A GLU 46.A N GLU 46.A OE1 no hydrogen 2.774 N/A ARG 49.A NE ASP 10.A OD1 no hydrogen 3.110 N/A ARG 49.A NE ASP 10.A OD2 no hydrogen 3.177 N/A ARG 49.A NH2 ASP 10.A OD1 no hydrogen 3.135 N/A ARG 49.A NH2 ASP 10.A OD2 no hydrogen 3.542 N/A LYS 51.A NZ GLU 375.A OE1 no hydrogen 2.430 N/A ALA 53.A N SER 105.A O no hydrogen 2.981 N/A LYS 55.A N THR 54.A OG1 no hydrogen 2.572 N/A LYS 55.A NZ SER 71.A OG no hydrogen 3.303 N/A MET 58.A N LYS 55.A O no hydrogen 3.440 N/A CYS 59.A N GLN 56.A O no hydrogen 3.114 N/A CYS 59.A SG ASP 64.A OD1 no hydrogen 3.162 N/A GLN 60.A N GLN 60.A OE1 no hydrogen 2.817 N/A GLU 65.A N GLU 65.A OE1 no hydrogen 2.746 N/A TYR 66.A N THR 63.A OG1 no hydrogen 3.320 N/A ILE 67.A N THR 63.A O no hydrogen 3.212 N/A ASP 68.A N ASP 64.A O no hydrogen 2.901 N/A PHE 69.A N GLU 65.A O no hydrogen 2.877 N/A LEU 70.A N TYR 66.A O no hydrogen 2.916 N/A SER 71.A N ILE 67.A O no hydrogen 2.875 N/A SER 71.A OG ILE 67.A O no hydrogen 3.444 N/A SER 71.A OG ASP 68.A O no hydrogen 2.418 N/A ARG 72.A N ASP 68.A O no hydrogen 2.955 N/A ARG 72.A NE ASP 68.A OD2 no hydrogen 2.478 N/A ARG 72.A NH2 ASP 68.A OD2 no hydrogen 2.984 N/A SER 85.A OG PHE 81.A O no hydrogen 2.687 N/A LYS 87.A N ARG 83.A O no hydrogen 3.260 N/A ASN 89.A N VAL 86.A O no hydrogen 2.953 N/A ASN 89.A ND2 ASP 93.A OD2 no hydrogen 3.507 N/A ASN 89.A ND2 GLU 140.A OE2 no hydrogen 2.947 N/A VAL 90.A N SER 85.A O no hydrogen 2.649 N/A GLY 91.A N CYS 94.A O no hydrogen 2.494 N/A CYS 94.A SG ALA 141.A O no hydrogen 3.917 N/A TYR 103.A OH TYR 18.A OH no hydrogen 2.986 N/A CYS 104.A N LEU 100.A O no hydrogen 2.956 N/A CYS 104.A SG LEU 100.A O no hydrogen 3.136 N/A CYS 104.A SG TYR 101.A O no hydrogen 3.224 N/A SER 105.A N TYR 101.A O no hydrogen 2.937 N/A SER 105.A OG TYR 101.A O no hydrogen 3.370 N/A SER 105.A OG GLU 102.A O no hydrogen 2.701 N/A SER 105.A OG GLU 102.A OE1 no hydrogen 3.009 N/A ILE 106.A N GLU 102.A O no hydrogen 2.913 N/A SER 107.A N TYR 103.A O no hydrogen 2.927 N/A SER 107.A OG ASP 149.A OD1 no hydrogen 2.776 N/A GLY 108.A N CYS 104.A O no hydrogen 2.929 N/A GLY 109.A N SER 105.A O no hydrogen 2.885 N/A GLY 110.A N ILE 106.A O no hydrogen 2.892 N/A SER 111.A N SER 107.A O no hydrogen 2.970 N/A SER 111.A OG ASP 149.A O no hydrogen 2.892 N/A MET 112.A N GLY 108.A O no hydrogen 2.945 N/A GLU 113.A N GLY 109.A O no hydrogen 2.868 N/A GLY 114.A N GLY 110.A O no hydrogen 2.910 N/A ALA 115.A N SER 111.A O no hydrogen 2.973 N/A ALA 116.A N MET 112.A O no hydrogen 2.849 N/A ARG 117.A N GLU 113.A O no hydrogen 2.894 N/A ARG 117.A NH2 ASP 378.A OD1 no hydrogen 3.222 N/A ARG 117.A NH2 ASP 378.A OD2 no hydrogen 2.910 N/A LEU 118.A N GLY 114.A O no hydrogen 2.915 N/A ASN 119.A N ALA 115.A O no hydrogen 2.900 N/A ASN 119.A ND2 GLU 156.A O no hydrogen 2.529 N/A ARG 120.A N ALA 116.A O no hydrogen 2.890 N/A GLY 121.A N ARG 117.A O no hydrogen 3.294 N/A CYS 123.A SG GLU 46.A OE2 no hydrogen 3.310 N/A ASP 124.A N ARG 4.A O no hydrogen 3.034 N/A VAL 125.A N ARG 4.A O no hydrogen 3.336 N/A ALA 126.A N MET 289.A O no hydrogen 2.986 N/A VAL 127.A N ALA 6.A O no hydrogen 2.747 N/A ASN 128.A N VAL 291.A O no hydrogen 2.782 N/A HIS 135.A NE2 HIS 172.A O no hydrogen 2.676 N/A LYS 137.A N GLU 140.A O no hydrogen 2.969 N/A LYS 137.A NZ GLU 179.A OE1 no hydrogen 2.979 N/A LYS 138.A NZ PHE 61.A O no hydrogen 3.246 N/A ALA 141.A N PHE 88.A O no hydrogen 2.640 N/A CYS 145.A SG GLY 143.A O no hydrogen 3.433 N/A TYR 146.A OH PRO 95.A O no hydrogen 2.962 N/A ASN 148.A N HIS 62.A NE2 no hydrogen 3.234 N/A ASN 148.A ND2 ALA 136.A O no hydrogen 3.115 N/A VAL 151.A N ASN 148.A O no hydrogen 3.284 N/A VAL 151.A N ASN 148.A OD1 no hydrogen 3.155 N/A GLY 153.A N ASP 149.A O no hydrogen 2.955 N/A ILE 154.A N ILE 150.A O no hydrogen 2.834 N/A ILE 155.A N VAL 151.A O no hydrogen 2.965 N/A GLU 156.A N LEU 152.A O no hydrogen 2.897 N/A LEU 157.A N GLY 153.A O no hydrogen 2.929 N/A LEU 158.A N ILE 154.A O no hydrogen 2.856 N/A ARG 159.A N ILE 155.A O no hydrogen 2.924 N/A TYR 160.A N LEU 157.A O no hydrogen 3.144 N/A HIS 161.A N LEU 157.A O no hydrogen 2.595 N/A LEU 165.A N ALA 250.A O no hydrogen 2.827 N/A TYR 166.A N MET 188.A O no hydrogen 2.974 N/A ILE 167.A N VAL 252.A O no hydrogen 3.069 N/A HIS 173.A NE2 THR 202.A O no hydrogen 2.566 N/A ASP 175.A N ASP 175.A OD1 no hydrogen 2.356 N/A GLU 179.A N ASP 175.A O no hydrogen 2.914 N/A ALA 180.A N GLY 176.A O no hydrogen 2.877 N/A PHE 181.A N VAL 177.A O no hydrogen 2.922 N/A TYR 182.A OH ASP 207.A OD1 no hydrogen 2.379 N/A ARG 186.A N THR 184.A OG1 no hydrogen 3.347 N/A ARG 186.A NE PRO 162.A O no hydrogen 3.309 N/A ARG 186.A NH2 LEU 158.A O no hydrogen 3.160 N/A THR 189.A N TYR 216.A O no hydrogen 3.322 N/A CYS 190.A N TYR 166.A O no hydrogen 2.755 N/A SER 191.A OG HIS 173.A ND1 no hydrogen 3.234 N/A SER 191.A OG HIS 193.A ND1 no hydrogen 2.463 N/A PHE 192.A N ASP 168.A O no hydrogen 2.744 N/A HIS 193.A ND1 SER 191.A OG no hydrogen 2.463 N/A HIS 193.A NE2 THR 202.A O no hydrogen 3.124 N/A LYS 194.A NZ ASP 224.A OD1 no hydrogen 2.428 N/A THR 202.A OG1 HIS 173.A NE2 no hydrogen 3.266 N/A ASP 207.A N GLU 204.A O no hydrogen 3.378 N/A GLY 213.A N VAL 210.A O no hydrogen 3.244 N/A LYS 214.A N GLY 211.A O no hydrogen 3.368 N/A TYR 216.A N ILE 208.A O no hydrogen 3.128 N/A TYR 216.A N GLY 213.A O no hydrogen 3.302 N/A VAL 218.A N THR 189.A O no hydrogen 2.969 N/A ARG 223.A N ASN 348.A OD1 no hydrogen 2.969 N/A GLY 225.A N CYS 267.A O no hydrogen 2.451 N/A ASP 227.A N ASP 227.A OD1 no hydrogen 2.608 N/A THR 230.A OG1 ASP 227.A O no hydrogen 3.157 N/A THR 230.A OG1 ASP 227.A OD1 no hydrogen 2.323 N/A TYR 231.A N ASP 227.A O no hydrogen 3.049 N/A ARG 232.A N ASP 228.A O no hydrogen 2.886 N/A SER 233.A N ALA 229.A O no hydrogen 2.930 N/A SER 233.A OG THR 230.A O no hydrogen 2.700 N/A VAL 234.A N THR 230.A O no hydrogen 2.891 N/A PHE 235.A N ARG 232.A O no hydrogen 3.218 N/A GLU 236.A N ARG 232.A O no hydrogen 2.959 N/A ILE 239.A N PHE 235.A O no hydrogen 2.995 N/A LYS 240.A N GLU 236.A O no hydrogen 2.964 N/A LYS 241.A N PRO 237.A O no hydrogen 2.928 N/A ILE 242.A N VAL 238.A O no hydrogen 2.892 N/A MET 243.A N ILE 239.A O no hydrogen 2.913 N/A GLU 244.A N LYS 240.A O no hydrogen 2.928 N/A TRP 245.A N LYS 241.A O no hydrogen 2.898 N/A TYR 246.A N ILE 242.A O no hydrogen 3.207 N/A SER 249.A N ARG 163.A O no hydrogen 2.739 N/A VAL 251.A N PRO 288.A O no hydrogen 3.253 N/A VAL 252.A N LEU 165.A O no hydrogen 2.973 N/A LEU 253.A N MET 290.A O no hydrogen 2.452 N/A CYS 255.A N VAL 292.A O no hydrogen 2.851 N/A LEU 260.A N GLY 257.A O no hydrogen 3.295 N/A SER 261.A OG ARG 340.A O no hydrogen 3.343 N/A SER 261.A OG SER 342.A OG no hydrogen 2.952 N/A ARG 264.A NH2 TYR 297.A O no hydrogen 2.554 N/A CYS 267.A SG GLY 266.A O no hydrogen 3.395 N/A ASN 269.A ND2 SER 342.A O no hydrogen 2.809 N/A SER 271.A N ASP 228.A OD1 no hydrogen 3.462 N/A SER 271.A OG GLU 273.A OE1 no hydrogen 3.510 N/A GLU 273.A N GLU 273.A OE1 no hydrogen 2.862 N/A HIS 275.A N SER 271.A O no hydrogen 3.225 N/A HIS 275.A ND1 GLU 309.A OE2 no hydrogen 2.906 N/A ALA 276.A N GLU 273.A O no hydrogen 3.272 N/A ASN 277.A N GLU 273.A O no hydrogen 2.902 N/A CYS 278.A SG GLY 274.A O no hydrogen 4.028 N/A CYS 278.A SG HIS 275.A O no hydrogen 3.321 N/A ASN 280.A N ALA 276.A O no hydrogen 2.905 N/A TYR 281.A N ASN 277.A O no hydrogen 2.894 N/A VAL 282.A N CYS 278.A O no hydrogen 2.953 N/A LYS 283.A N VAL 279.A O no hydrogen 2.861 N/A LYS 283.A NZ LEU 312.A O no hydrogen 3.448 N/A LYS 283.A NZ ASN 315.A OD1 no hydrogen 2.772 N/A SER 284.A N ASN 280.A O no hydrogen 2.916 N/A SER 284.A OG ASN 280.A O no hydrogen 2.611 N/A GLY 286.A N LYS 283.A O no hydrogen 3.177 N/A MET 289.A N ASP 124.A O no hydrogen 3.345 N/A MET 290.A N VAL 251.A O no hydrogen 2.447 N/A VAL 291.A N ALA 126.A O no hydrogen 2.645 N/A VAL 292.A N LEU 253.A O no hydrogen 2.627 N/A TYR 297.A N ASP 263.A OD1 no hydrogen 3.279 N/A THR 298.A OG1 ASN 301.A OD1 no hydrogen 2.569 N/A ALA 303.A N MET 299.A O no hydrogen 3.015 N/A ARG 304.A N ARG 300.A O no hydrogen 2.915 N/A THR 305.A N ASN 301.A O no hydrogen 2.950 N/A TRP 306.A N VAL 302.A O no hydrogen 2.934 N/A CYS 307.A N ALA 303.A O no hydrogen 2.975 N/A CYS 307.A SG LEU 35.A O no hydrogen 3.886 N/A PHE 308.A N ARG 304.A O no hydrogen 2.969 N/A GLU 309.A N THR 305.A O no hydrogen 2.839 N/A THR 310.A N TRP 306.A O no hydrogen 2.975 N/A THR 310.A OG1 TRP 306.A O no hydrogen 3.554 N/A THR 310.A OG1 CYS 307.A O no hydrogen 2.598 N/A GLY 311.A N CYS 307.A O no hydrogen 2.940 N/A LEU 312.A N PHE 308.A O no hydrogen 2.871 N/A LEU 313.A N GLU 309.A O no hydrogen 2.884 N/A ASN 314.A N THR 310.A O no hydrogen 2.913 N/A ASN 315.A N LEU 312.A O no hydrogen 2.980 N/A ASN 315.A ND2 ASP 1.A O no hydrogen 2.650 N/A VAL 316.A N GLY 311.A O no hydrogen 3.306 N/A GLU 326.A N GLU 326.A OE1 no hydrogen 2.445 N/A TYR 328.A N ASN 325.A O no hydrogen 3.303 N/A TYR 330.A N TYR 327.A O no hydrogen 3.228 N/A TYR 335.A N GLY 332.A O no hydrogen 3.196 N/A LYS 336.A NZ ASP 321.A OD1 no hydrogen 2.425 N/A LEU 337.A N LYS 320.A O no hydrogen 3.095 N/A SER 338.A OG ASP 334.A OD2 no hydrogen 2.930 N/A ARG 340.A NE ASP 334.A OD2 no hydrogen 2.755 N/A ARG 340.A NH2 ASP 334.A OD2 no hydrogen 3.188 N/A SER 342.A N ASN 269.A OD1 no hydrogen 2.918 N/A SER 342.A OG SER 261.A OG no hydrogen 2.952 N/A GLU 351.A N GLU 351.A OE2 no hydrogen 2.936 N/A TYR 352.A N THR 349.A OG1 no hydrogen 3.314 N/A LEU 353.A N THR 349.A O no hydrogen 3.303 N/A ASP 354.A N PRO 350.A O no hydrogen 2.887 N/A LYS 355.A N GLU 351.A O no hydrogen 2.908 N/A VAL 356.A N TYR 352.A O no hydrogen 2.943 N/A MET 357.A N LEU 353.A O no hydrogen 2.874 N/A THR 358.A N ASP 354.A O no hydrogen 2.956 N/A THR 358.A OG1 LYS 355.A O no hydrogen 3.018 N/A ASN 359.A N LYS 355.A O no hydrogen 2.967 N/A ILE 360.A N VAL 356.A O no hydrogen 2.856 N/A PHE 361.A N MET 357.A O no hydrogen 2.884 N/A ALA 362.A N THR 358.A O no hydrogen 2.927 N/A ASN 363.A N ASN 359.A O no hydrogen 2.925 N/A ASN 363.A ND2 LEU 205.A O no hydrogen 3.586 N/A LEU 364.A N ILE 360.A O no hydrogen 2.855 N/A GLU 365.A N PHE 361.A O no hydrogen 2.913 N/A THR 367.A N LEU 364.A O no hydrogen 3.274 N/A THR 367.A OG1 LEU 364.A O no hydrogen 2.881 N/A GLU 370.A N GLN 56.A OE1 no hydrogen 3.197 N/A ASP 372.A N VAL 369.A O no hydrogen 2.772 N/A SER 373.A OG GLU 370.A O no hydrogen 2.266 N/A LYS 377.A N GLU 113.A OE2 no hydrogen 3.225 N/A THR 379.A N ARG 49.A O no hydrogen 2.999 N/A ARG 387.A NE TYR 42.A OH no hydrogen 3.280 N/A ASP 388.A N ASN 38.A OD1 no hydrogen 3.197 N/A