Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1fml_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 5.A OH SER 162.A O no hydrogen 3.232 N/A ARG 8.A N LYS 31.A O no hydrogen 3.266 N/A ARG 8.A NH1 GLU 9.A O no hydrogen 2.960 N/A ARG 8.A NH1 GLU 14.A OE1 no hydrogen 2.875 N/A ARG 8.A NH2 GLU 14.A OE1 no hydrogen 3.188 N/A ARG 8.A NH2 GLU 14.A OE2 no hydrogen 2.889 N/A ASN 11.A N GLU 14.A OE1 no hydrogen 3.040 N/A GLU 14.A N ASN 11.A OD1 no hydrogen 2.867 N/A ASP 15.A N ASN 11.A O no hydrogen 2.910 N/A LYS 16.A N PRO 12.A O no hydrogen 2.839 N/A LEU 17.A N GLU 13.A O no hydrogen 3.220 N/A VAL 18.A N GLU 14.A O no hydrogen 3.089 N/A LYS 19.A N ASP 15.A O no hydrogen 2.996 N/A ALA 20.A N LEU 17.A O no hydrogen 2.867 N/A ASN 21.A N VAL 18.A O no hydrogen 2.818 N/A LEU 22.A N VAL 18.A O no hydrogen 2.814 N/A ALA 24.A N ASN 199.A OD1 no hydrogen 2.787 N/A PHE 25.A N LEU 22.A O no hydrogen 3.280 N/A THR 27.A OG1 ILE 105.A O no hydrogen 2.882 N/A THR 27.A OG1 TYR 114.A OH no hydrogen 2.630 N/A TYR 29.A OH THR 217.A OG1 no hydrogen 2.629 N/A VAL 30.A N VAL 39.A O no hydrogen 2.999 N/A LYS 31.A N ARG 8.A O no hydrogen 3.224 N/A LYS 31.A NZ GLU 14.A OE2 no hydrogen 3.386 N/A LYS 31.A NZ GLY 214.A O no hydrogen 3.322 N/A LEU 32.A N TYR 37.A O no hydrogen 2.837 N/A GLY 33.A N GLU 6.A O no hydrogen 3.152 N/A LYS 35.A NZ GLU 227.A OE2 no hydrogen 3.265 N/A GLY 36.A N GLY 33.A O no hydrogen 2.919 N/A TYR 37.A N LEU 32.A O no hydrogen 2.910 N/A TYR 37.A OH GLU 227.A OE2 no hydrogen 2.406 N/A MET 38.A N THR 219.A O no hydrogen 2.740 N/A VAL 39.A N VAL 30.A O no hydrogen 3.024 N/A ARG 41.A N THR 28.A O no hydrogen 2.930 N/A ARG 41.A NE THR 28.A OG1 no hydrogen 3.094 N/A ARG 41.A NH1 GLU 9.A OE2 no hydrogen 3.379 N/A ARG 41.A NH2 GLU 9.A OE1 no hydrogen 2.665 N/A ARG 41.A NH2 GLU 9.A OE2 no hydrogen 3.208 N/A TYR 43.A N TYR 40.A O no hydrogen 2.797 N/A LEU 44.A N ARG 41.A O no hydrogen 2.997 N/A LYS 45.A N PRO 42.A O no hydrogen 2.996 N/A ASP 46.A N TYR 43.A O no hydrogen 3.043 N/A ALA 47.A N TYR 43.A O no hydrogen 2.972 N/A ALA 47.A N LEU 44.A O no hydrogen 3.187 N/A ASN 49.A ND2 ASP 46.A OD1 no hydrogen 2.790 N/A ILE 50.A N ASP 46.A O no hydrogen 3.033 N/A TYR 51.A N ALA 47.A O no hydrogen 3.022 N/A ASN 52.A N ALA 48.A O no hydrogen 3.172 N/A ASN 52.A N ASN 49.A O no hydrogen 2.981 N/A ASN 52.A ND2 LEU 1.A O no hydrogen 2.913 N/A ASN 52.A ND2 ALA 48.A O no hydrogen 2.947 N/A MET 53.A N ILE 50.A O no hydrogen 3.084 N/A ARG 56.A N ASP 59.A OD2 no hydrogen 2.721 N/A ARG 56.A NH1 VAL 147.A O no hydrogen 2.966 N/A ARG 56.A NH1 PRO 148.A O no hydrogen 3.007 N/A ARG 56.A NH2 VAL 147.A O no hydrogen 2.533 N/A ASP 59.A N ARG 56.A O no hydrogen 2.990 N/A VAL 60.A N ARG 153.A O no hydrogen 3.125 N/A PHE 61.A N LYS 173.A O no hydrogen 2.953 N/A VAL 62.A N VAL 155.A O no hydrogen 2.935 N/A ALA 63.A N VAL 175.A O no hydrogen 2.891 N/A SER 64.A OG TYR 65.A O no hydrogen 3.091 N/A SER 64.A OG THR 70.A OG1 no hydrogen 2.905 N/A SER 64.A OG HIS 158.A ND1 no hydrogen 3.327 N/A TYR 65.A OH THR 217.A O no hydrogen 3.013 N/A ARG 67.A NE SER 187.A OG no hydrogen 2.868 N/A ARG 67.A NH1 PHE 304.A O no hydrogen 3.513 N/A ARG 67.A NH2 SER 187.A OG no hydrogen 3.246 N/A ARG 67.A NH2 PHE 304.A O no hydrogen 3.108 N/A SER 68.A OG TYR 65.A O no hydrogen 2.910 N/A THR 70.A OG1 SER 64.A OG no hydrogen 2.905 N/A THR 73.A N GLY 69.A O no hydrogen 3.076 N/A THR 73.A OG1 GLY 69.A O no hydrogen 2.690 N/A THR 73.A OG1 TYR 245.A OH no hydrogen 2.903 N/A GLN 74.A N THR 70.A O no hydrogen 2.820 N/A GLU 75.A N THR 71.A O no hydrogen 3.097 N/A LEU 76.A N MET 72.A O no hydrogen 3.111 N/A VAL 77.A N THR 73.A O no hydrogen 2.775 N/A TRP 78.A N GLN 74.A O no hydrogen 2.861 N/A LEU 79.A N GLU 75.A O no hydrogen 3.137 N/A ILE 80.A N LEU 76.A O no hydrogen 2.936 N/A GLU 81.A N VAL 77.A O no hydrogen 3.287 N/A ASN 82.A N TRP 78.A O no hydrogen 2.970 N/A ASN 82.A ND2 TRP 78.A O no hydrogen 3.006 N/A LEU 84.A N LEU 79.A O no hydrogen 2.733 N/A ASN 85.A N ASN 82.A O no hydrogen 2.893 N/A ALA 88.A N ASN 85.A OD1 no hydrogen 3.017 N/A ALA 89.A N ASN 85.A O no hydrogen 3.261 N/A ALA 89.A N PHE 86.A O no hydrogen 3.136 N/A LYS 90.A N GLU 87.A O no hydrogen 3.206 N/A LYS 90.A NZ GLU 87.A OE1 no hydrogen 2.817 N/A LYS 90.A NZ GLU 87.A OE2 no hydrogen 2.833 N/A THR 91.A OG1 ALA 88.A O no hydrogen 3.331 N/A MET 93.A N ALA 286.A O no hydrogen 2.907 N/A LEU 95.A N TYR 92.A O no hydrogen 2.967 N/A ARG 96.A N TYR 92.A O no hydrogen 3.142 N/A ARG 96.A N MET 93.A O no hydrogen 2.780 N/A ARG 96.A NE THR 91.A O no hydrogen 2.749 N/A ARG 96.A NH1 GLU 75.A OE2 no hydrogen 2.783 N/A ARG 96.A NH2 GLU 75.A OE2 no hydrogen 3.484 N/A ARG 96.A NH2 THR 91.A O no hydrogen 3.140 N/A TYR 97.A N MET 93.A O no hydrogen 2.944 N/A TYR 97.A OH GLN 74.A O no hydrogen 2.481 N/A ILE 98.A N PHE 154.A O no hydrogen 2.773 N/A LEU 100.A N LYS 156.A O no hydrogen 2.796 N/A GLY 102.A N TYR 99.A O no hydrogen 3.057 N/A TYR 106.A N PHE 103.A O no hydrogen 2.973 N/A ASP 107.A N TYR 114.A OH no hydrogen 2.738 N/A GLU 109.A N ASP 107.A OD2 no hydrogen 3.061 N/A LYS 110.A N ASP 107.A O no hydrogen 2.704 N/A LYS 110.A NZ PRO 26.A O no hydrogen 2.713 N/A GLN 111.A N PRO 108.A O no hydrogen 3.056 N/A GLU 112.A N GLU 112.A OE2 no hydrogen 2.547 N/A TYR 114.A N GLN 111.A O no hydrogen 2.972 N/A TYR 114.A OH THR 27.A OG1 no hydrogen 2.630 N/A ILE 117.A N TYR 114.A O no hydrogen 3.104 N/A LEU 118.A N ASN 115.A O no hydrogen 2.840 N/A LEU 124.A N PRO 121.A O no hydrogen 3.325 N/A ASP 125.A N ILE 295.A O no hydrogen 2.997 N/A ARG 128.A N ASP 125.A O no hydrogen 2.913 N/A ARG 128.A N ASP 125.A OD1 no hydrogen 3.351 N/A ARG 128.A NH1 GLU 294.A OE1 no hydrogen 2.988 N/A TYR 129.A N ASP 125.A O no hydrogen 2.957 N/A LEU 130.A N MET 126.A O no hydrogen 3.122 N/A LEU 132.A N ARG 128.A O no hydrogen 2.788 N/A LEU 133.A N TYR 129.A O no hydrogen 3.021 N/A GLU 134.A N LEU 130.A O no hydrogen 3.010 N/A TYR 135.A N GLY 131.A O no hydrogen 3.142 N/A SER 136.A N LEU 132.A O no hydrogen 2.928 N/A SER 136.A OG LEU 132.A O no hydrogen 2.838 N/A SER 137.A N GLU 134.A O no hydrogen 2.727 N/A SER 137.A OG LEU 133.A O no hydrogen 2.933 N/A ARG 138.A N TYR 135.A O no hydrogen 3.033 N/A SER 141.A N ASP 46.A OD2 no hydrogen 3.208 N/A SER 141.A OG ASP 46.A OD1 no hydrogen 2.876 N/A SER 141.A OG ASP 46.A OD2 no hydrogen 3.273 N/A LEU 143.A N PRO 139.A O no hydrogen 3.435 N/A LEU 143.A N GLY 140.A O no hydrogen 2.953 N/A LEU 144.A N GLY 140.A O no hydrogen 3.289 N/A LEU 144.A N SER 141.A O no hydrogen 2.812 N/A ALA 145.A N SER 141.A O no hydrogen 2.882 N/A VAL 147.A N LEU 144.A O no hydrogen 3.081 N/A GLU 151.A N PRO 148.A O no hydrogen 3.268 N/A LYS 152.A NZ THR 58.A O no hydrogen 2.688 N/A ARG 153.A NE ASP 59.A OD1 no hydrogen 2.942 N/A ARG 153.A NH1 LEU 144.A O no hydrogen 3.107 N/A ARG 153.A NH2 PRO 54.A O no hydrogen 3.155 N/A ARG 153.A NH2 ASP 59.A OD2 no hydrogen 2.499 N/A VAL 155.A N VAL 60.A O no hydrogen 2.894 N/A LYS 156.A N ILE 98.A O no hydrogen 2.819 N/A THR 157.A N VAL 62.A O no hydrogen 3.317 N/A THR 157.A OG1 ASP 101.A OD1 no hydrogen 2.729 N/A HIS 158.A N ASP 101.A OD1 no hydrogen 2.925 N/A HIS 158.A ND1 SER 64.A O no hydrogen 2.668 N/A LEU 159.A N THR 157.A OG1 no hydrogen 2.965 N/A SER 162.A N GLU 227.A OE1 no hydrogen 2.562 N/A SER 162.A OG GLU 227.A OE1 no hydrogen 3.294 N/A SER 162.A OG GLU 227.A OE2 no hydrogen 2.805 N/A LEU 163.A N PRO 160.A O no hydrogen 3.247 N/A MET 164.A N LEU 161.A O no hydrogen 2.691 N/A MET 168.A N PRO 165.A O no hydrogen 3.104 N/A ASP 170.A N ASN 167.A O no hydrogen 2.813 N/A THR 171.A N MET 168.A O no hydrogen 2.771 N/A VAL 172.A N MET 168.A O no hydrogen 3.034 N/A LYS 173.A N ASP 59.A O no hydrogen 3.356 N/A LYS 173.A NZ ASN 236.A OD1 no hydrogen 2.915 N/A MET 174.A N ASN 236.A O no hydrogen 2.838 N/A VAL 175.A N PHE 61.A O no hydrogen 2.810 N/A TYR 176.A N LEU 238.A O no hydrogen 2.906 N/A TYR 176.A OH HIS 224.A ND1 no hydrogen 2.568 N/A LEU 177.A N ALA 63.A O no hydrogen 2.926 N/A ALA 178.A N LEU 240.A O no hydrogen 2.885 N/A ARG 179.A NH1 ARG 67.A O no hydrogen 2.855 N/A ARG 179.A NH2 LYS 309.A O no hydrogen 3.260 N/A ASP 180.A N GLU 243.A OE2 no hydrogen 3.002 N/A ARG 182.A N ASP 180.A OD1 no hydrogen 2.785 N/A ARG 182.A NE ASP 180.A OD1 no hydrogen 3.034 N/A ARG 182.A NH2 ASP 180.A OD2 no hydrogen 2.710 N/A VAL 184.A N ASP 180.A O no hydrogen 2.944 N/A ALA 185.A N PRO 181.A O no hydrogen 2.604 N/A VAL 186.A N ARG 182.A O no hydrogen 3.207 N/A SER 187.A N ASP 183.A O no hydrogen 2.971 N/A SER 188.A N VAL 184.A O no hydrogen 2.934 N/A SER 188.A OG GLN 66.A OE1 no hydrogen 3.141 N/A SER 188.A OG VAL 184.A O no hydrogen 3.099 N/A PHE 189.A N ALA 185.A O no hydrogen 2.917 N/A HIS 190.A N VAL 186.A O no hydrogen 3.234 N/A HIS 190.A ND1 GLU 302.A OE2 no hydrogen 3.089 N/A HIS 190.A NE2 TYR 316.A OH no hydrogen 2.654 N/A HIS 191.A N SER 187.A O no hydrogen 3.013 N/A ALA 192.A N SER 188.A O no hydrogen 2.914 N/A ARG 193.A N PHE 189.A O no hydrogen 3.233 N/A ARG 193.A NH1 ASN 199.A O no hydrogen 3.011 N/A ARG 193.A NH2 SER 202.A O no hydrogen 2.789 N/A LEU 194.A N HIS 190.A O no hydrogen 2.870 N/A LEU 195.A N HIS 191.A O no hydrogen 3.347 N/A TYR 196.A N ARG 193.A O no hydrogen 2.923 N/A TYR 196.A OH LEU 298.A O no hydrogen 3.322 N/A LEU 197.A N ALA 192.A O no hydrogen 2.792 N/A ASN 199.A N ASN 21.A O no hydrogen 2.773 N/A ASN 199.A ND2 LYS 19.A O no hydrogen 3.294 N/A SER 202.A OG ASN 199.A O no hydrogen 3.504 N/A ASN 203.A N ASP 206.A OD2 no hydrogen 3.052 N/A LYS 205.A NZ GLU 320.A OE1 no hydrogen 3.310 N/A LYS 205.A NZ GLU 320.A OE2 no hydrogen 3.337 N/A ASP 206.A N ASN 203.A OD1 no hydrogen 3.064 N/A PHE 207.A N ASN 203.A O no hydrogen 3.289 N/A TRP 208.A N PHE 204.A O no hydrogen 2.692 N/A GLU 209.A N LYS 205.A O no hydrogen 2.779 N/A MET 210.A N ASP 206.A O no hydrogen 3.116 N/A PHE 211.A N PHE 207.A O no hydrogen 2.787 N/A HIS 212.A N TRP 208.A O no hydrogen 3.080 N/A HIS 212.A ND1 TRP 208.A O no hydrogen 3.012 N/A GLY 214.A N PHE 211.A O no hydrogen 3.084 N/A LEU 215.A N MET 210.A O no hydrogen 2.936 N/A TYR 216.A N THR 219.A OG1 no hydrogen 3.236 N/A THR 217.A OG1 TYR 29.A OH no hydrogen 2.629 N/A LEU 218.A N MET 38.A O no hydrogen 2.550 N/A THR 219.A N TYR 216.A O no hydrogen 2.923 N/A THR 219.A OG1 TYR 216.A O no hydrogen 2.797 N/A TYR 221.A OH TYR 340.A OH no hydrogen 2.846 N/A HIS 224.A N PRO 220.A O no hydrogen 3.350 N/A HIS 224.A ND1 TYR 176.A OH no hydrogen 2.568 N/A HIS 224.A NE2 HIS 158.A O no hydrogen 2.992 N/A VAL 225.A N TYR 221.A O no hydrogen 3.298 N/A LYS 226.A N PHE 222.A O no hydrogen 2.783 N/A LYS 226.A NZ ASN 332.A O no hydrogen 2.680 N/A GLU 227.A N GLU 223.A O no hydrogen 2.938 N/A TRP 229.A N VAL 225.A O no hydrogen 2.911 N/A TRP 229.A NE1 ASP 337.A OD1 no hydrogen 3.303 N/A ALA 230.A N LYS 226.A O no hydrogen 3.068 N/A LYS 231.A N ALA 228.A O no hydrogen 2.756 N/A ARG 232.A N TRP 229.A O no hydrogen 2.870 N/A ARG 232.A NE TRP 229.A O no hydrogen 3.229 N/A ASP 234.A N LYS 231.A O no hydrogen 3.003 N/A ASN 236.A N ASP 234.A OD1 no hydrogen 2.593 N/A ASN 236.A ND2 LEU 169.A O no hydrogen 2.564 N/A LEU 238.A N MET 174.A O no hydrogen 2.954 N/A LEU 240.A N TYR 176.A O no hydrogen 2.837 N/A TYR 242.A N ALA 178.A O no hydrogen 2.836 N/A GLU 243.A N GLU 243.A OE1 no hydrogen 2.669 N/A ASP 244.A N PHE 241.A O no hydrogen 2.890 N/A TYR 245.A OH THR 73.A OG1 no hydrogen 2.903 N/A LEU 246.A N GLU 243.A O no hydrogen 3.052 N/A LYS 247.A N GLU 243.A O no hydrogen 2.946 N/A ASP 248.A N ASP 244.A O no hydrogen 2.702 N/A GLY 251.A N ASP 248.A OD1 no hydrogen 3.166 N/A CYS 252.A N ASP 248.A O no hydrogen 2.967 N/A CYS 252.A SG ASP 248.A O no hydrogen 3.325 N/A ILE 253.A N LEU 249.A O no hydrogen 2.915 N/A ALA 254.A N PRO 250.A O no hydrogen 3.270 N/A ARG 255.A N GLY 251.A O no hydrogen 3.212 N/A ILE 256.A N CYS 252.A O no hydrogen 3.079 N/A ALA 257.A N ILE 253.A O no hydrogen 2.898 N/A ASP 258.A N ALA 254.A O no hydrogen 2.879 N/A PHE 259.A N ARG 255.A O no hydrogen 2.800 N/A LEU 260.A N ILE 256.A O no hydrogen 2.692 N/A GLY 261.A N ASP 258.A O no hydrogen 3.182 N/A LYS 262.A N ALA 257.A O no hydrogen 2.756 N/A LYS 262.A NZ GLU 81.A OE2 no hydrogen 2.845 N/A SER 265.A N GLN 268.A OE1 no hydrogen 2.776 N/A GLN 268.A N SER 265.A OG no hydrogen 3.095 N/A ILE 269.A N SER 265.A O no hydrogen 2.953 N/A GLN 270.A N GLU 266.A O no hydrogen 3.019 N/A ARG 271.A N GLU 267.A O no hydrogen 2.681 N/A LEU 272.A N GLN 268.A O no hydrogen 2.913 N/A CYS 273.A N ILE 269.A O no hydrogen 3.051 N/A CYS 273.A SG ILE 269.A O no hydrogen 3.089 N/A GLU 274.A N GLN 270.A O no hydrogen 3.205 N/A HIS 275.A NE2 GLU 75.A OE1 no hydrogen 2.872 N/A LEU 276.A N CYS 273.A O no hydrogen 3.129 N/A ASN 277.A N GLU 274.A O no hydrogen 3.177 N/A LYS 280.A N ASN 277.A OD1 no hydrogen 3.332 N/A PHE 281.A N ASN 277.A O no hydrogen 2.797 N/A LYS 282.A N PHE 278.A O no hydrogen 2.675 N/A LYS 282.A NZ ILE 305.A O no hydrogen 3.183 N/A ASN 283.A N GLU 279.A O no hydrogen 3.187 N/A ASN 283.A ND2 GLU 279.A O no hydrogen 2.737 N/A ASN 284.A N PHE 281.A O no hydrogen 2.641 N/A ALA 286.A N ASN 284.A OD1 no hydrogen 2.987 N/A VAL 287.A N ASN 284.A O no hydrogen 3.217 N/A ASN 288.A N ASN 284.A O no hydrogen 3.037 N/A ASN 288.A ND2 LYS 282.A O no hydrogen 3.252 N/A GLU 290.A N ASN 288.A OD1 no hydrogen 3.127 N/A TYR 292.A N MET 289.A O no hydrogen 3.110 N/A ARG 293.A N GLU 290.A O no hydrogen 3.021 N/A ARG 293.A NE GLU 290.A OE2 no hydrogen 2.627 N/A ARG 293.A NH1 ALA 299.A O no hydrogen 3.159 N/A ARG 293.A NH2 GLU 290.A OE1 no hydrogen 3.159 N/A ARG 293.A NH2 GLU 302.A O no hydrogen 2.504 N/A GLU 294.A N ASP 291.A O no hydrogen 3.035 N/A GLY 296.A N TYR 292.A O no hydrogen 3.278 N/A ALA 299.A N LEU 194.A O no hydrogen 2.677 N/A GLU 302.A N ALA 299.A O no hydrogen 3.265 N/A HIS 303.A ND1 GLU 290.A OE1 no hydrogen 3.228 N/A GLY 311.A N ASP 183.A OD2 no hydrogen 2.797 N/A ASP 315.A N CYS 312.A O no hydrogen 3.213 N/A TYR 316.A N TRP 313.A O no hydrogen 2.957 N/A TYR 316.A OH HIS 190.A NE2 no hydrogen 2.654 N/A PHE 317.A N TRP 313.A O no hydrogen 3.102 N/A MET 321.A N ASP 318.A OD2 no hydrogen 2.469 N/A THR 322.A N ASP 318.A O no hydrogen 2.880 N/A THR 322.A OG1 ASP 318.A O no hydrogen 2.841 N/A LYS 323.A N GLU 319.A O no hydrogen 3.175 N/A LYS 323.A N GLU 320.A O no hydrogen 3.091 N/A GLN 324.A N GLU 320.A O no hydrogen 3.256 N/A ALA 325.A N MET 321.A O no hydrogen 2.753 N/A GLU 326.A N THR 322.A O no hydrogen 3.029 N/A LYS 327.A N LYS 323.A O no hydrogen 2.945 N/A LYS 327.A NZ ASP 331.A OD2 no hydrogen 2.729 N/A TRP 328.A N GLN 324.A O no hydrogen 3.148 N/A ILE 329.A N ALA 325.A O no hydrogen 2.946 N/A LYS 330.A N GLU 326.A O no hydrogen 2.799 N/A ASP 331.A N LYS 327.A O no hydrogen 2.719 N/A ASN 332.A N TRP 328.A O no hydrogen 3.151 N/A LEU 333.A N LYS 330.A O no hydrogen 3.283 N/A LYS 334.A NZ ASP 335.A OD2 no hydrogen 2.607 N/A ASP 337.A N ASP 337.A OD1 no hydrogen 2.547 N/A TYR 340.A OH TYR 221.A OH no hydrogen 2.846 N/A