Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3fkd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N ASN 280.A O no hydrogen 3.182 N/A PHE 5.A N LEU 281.A O no hydrogen 2.727 N/A SER 6.A N ASN 4.A OD1 no hydrogen 2.900 N/A SER 6.A OG ASN 4.A OD1 no hydrogen 2.790 N/A THR 8.A OG1 TYR 151.A OH no hydrogen 2.705 N/A VAL 9.A N THR 7.A OG1 no hydrogen 3.426 N/A TRP 10.A N HIS 178.A O no hydrogen 2.814 N/A LYS 15.A NZ TYR 180.A O no hydrogen 2.374 N/A ASP 16.A N ASP 14.A OD1 no hydrogen 3.263 N/A GLU 19.A N LYS 15.A O no hydrogen 2.890 N/A LYS 20.A N ASP 16.A O no hydrogen 2.790 N/A HIS 21.A N HIS 17.A O no hydrogen 3.037 N/A LEU 22.A N LEU 18.A O no hydrogen 3.162 N/A VAL 23.A N GLU 19.A O no hydrogen 3.225 N/A GLU 24.A N LYS 20.A O no hydrogen 3.011 N/A ASN 25.A N HIS 21.A O no hydrogen 3.099 N/A ASN 25.A ND2 HIS 21.A O no hydrogen 2.910 N/A CYS 28.A N ASN 25.A O no hydrogen 3.144 N/A CYS 28.A SG ASN 25.A O no hydrogen 3.424 N/A ILE 29.A N LEU 26.A O no hydrogen 3.140 N/A ARG 30.A N ASN 27.A O no hydrogen 2.892 N/A HIS 31.A N CYS 28.A O no hydrogen 3.315 N/A ALA 37.A N GLU 34.A O no hydrogen 3.074 N/A THR 39.A N GLU 34.A OE1 no hydrogen 2.762 N/A THR 39.A OG1 GLU 34.A OE1 no hydrogen 3.304 N/A THR 39.A OG1 GLU 34.A OE2 no hydrogen 2.747 N/A ARG 41.A N ALA 37.A O no hydrogen 2.960 N/A ARG 41.A NE ASN 51.A OD1 no hydrogen 2.622 N/A ARG 41.A NH1 ASP 36.A OD2 no hydrogen 2.712 N/A ARG 41.A NH2 ASN 51.A OD1 no hydrogen 2.828 N/A GLN 42.A N GLY 38.A O no hydrogen 2.919 N/A ALA 44.A N ARG 41.A O no hydrogen 2.991 N/A LYS 45.A N GLN 42.A O no hydrogen 3.246 N/A ASN 47.A N LEU 43.A O no hydrogen 2.839 N/A SER 48.A N LYS 45.A O no hydrogen 3.318 N/A VAL 49.A N ALA 44.A O no hydrogen 2.768 N/A ALA 53.A N ASP 50.A O no hydrogen 2.842 N/A LEU 55.A N ILE 190.A O no hydrogen 3.000 N/A THR 57.A N GLY 188.A O no hydrogen 2.795 N/A PHE 64.A N PRO 60.A O no hydrogen 3.322 N/A PHE 64.A N THR 61.A O no hydrogen 2.806 N/A TYR 65.A N THR 61.A O no hydrogen 3.338 N/A TYR 65.A OH GLU 85.A OE1 no hydrogen 2.840 N/A GLN 66.A N ALA 62.A O no hydrogen 2.836 N/A GLN 66.A NE2 VAL 199.A O no hydrogen 2.552 N/A GLN 66.A NE2 SER 203.A OG no hydrogen 3.405 N/A ILE 67.A N ALA 63.A O no hydrogen 3.099 N/A ALA 68.A N PHE 64.A O no hydrogen 3.027 N/A GLN 69.A N TYR 65.A O no hydrogen 2.842 N/A ALA 70.A N GLN 66.A O no hydrogen 3.122 N/A PHE 71.A N ALA 68.A O no hydrogen 3.101 N/A ARG 72.A N GLN 69.A O no hydrogen 3.234 N/A ARG 72.A NE GLU 93.A OE1 no hydrogen 3.247 N/A ARG 72.A NH2 GLU 93.A OE1 no hydrogen 2.905 N/A SER 74.A N PHE 71.A O no hydrogen 2.737 N/A SER 74.A OG PHE 71.A O no hydrogen 2.851 N/A ARG 75.A N ASP 113.A OD2 no hydrogen 3.013 N/A ARG 75.A NE GLU 95.A OE1 no hydrogen 3.313 N/A ARG 75.A NH2 GLU 95.A OE1 no hydrogen 3.478 N/A SER 76.A N GLU 95.A O no hydrogen 2.909 N/A LEU 77.A N PHE 114.A O no hydrogen 2.863 N/A ILE 78.A N CYS 97.A O no hydrogen 2.748 N/A ILE 80.A N TYR 99.A O no hydrogen 2.768 N/A SER 82.A OG ALA 79.A O no hydrogen 2.672 N/A TYR 86.A N PHE 83.A O no hydrogen 3.179 N/A TYR 86.A OH ASP 148.A OD2 no hydrogen 2.532 N/A ASP 88.A N ALA 84.A O no hydrogen 2.958 N/A ALA 89.A N GLU 85.A O no hydrogen 3.085 N/A CYS 90.A N TYR 86.A O no hydrogen 3.078 N/A CYS 90.A SG SER 76.A OG no hydrogen 3.405 N/A CYS 90.A SG TYR 86.A O no hydrogen 3.628 N/A ARG 91.A N GLU 87.A O no hydrogen 2.870 N/A GLU 93.A N ARG 91.A O no hydrogen 2.602 N/A HIS 94.A N CYS 90.A O no hydrogen 2.694 N/A GLU 95.A N SER 74.A O no hydrogen 2.977 N/A CYS 97.A N SER 76.A O no hydrogen 2.744 N/A TYR 99.A OH ASP 104.A O no hydrogen 2.972 N/A SER 101.A N ILE 80.A O no hydrogen 2.887 N/A SER 101.A OG ILE 80.A O no hydrogen 3.199 N/A SER 101.A OG ASP 124.A OD2 no hydrogen 2.382 N/A GLU 103.A N PRO 100.A O no hydrogen 3.231 N/A GLY 106.A N ASP 104.A OD1 no hydrogen 2.773 N/A GLU 107.A N ASP 104.A O no hydrogen 3.233 N/A ALA 108.A N ILE 105.A O no hydrogen 3.101 N/A SER 111.A OG ASP 109.A OD1 no hydrogen 2.432 N/A ASP 113.A N ARG 75.A O no hydrogen 2.813 N/A PHE 114.A N ARG 75.A O no hydrogen 3.033 N/A CYS 115.A N THR 144.A O no hydrogen 2.915 N/A CYS 115.A SG LEU 77.A O no hydrogen 3.974 N/A TRP 116.A N LEU 77.A O no hydrogen 3.011 N/A TRP 116.A NE1 SER 76.A OG no hydrogen 3.035 N/A LEU 117.A N VAL 146.A O no hydrogen 2.856 N/A CYS 118.A SG PRO 120.A O no hydrogen 3.550 N/A CYS 118.A SG ASP 148.A O no hydrogen 3.778 N/A ASN 119.A ND2 LEU 128.A O no hydrogen 3.050 N/A ASN 121.A N ARG 126.A O no hydrogen 2.871 N/A ASN 121.A ND2 PRO 81.A O no hydrogen 2.917 N/A GLY 125.A N ASN 121.A O no hydrogen 2.611 N/A ARG 126.A NH1 SER 101.A O no hydrogen 2.786 N/A LEU 128.A N ASN 119.A OD1 no hydrogen 2.889 N/A ARG 130.A NH1 VAL 159.A O no hydrogen 2.985 N/A ARG 130.A NH1 ASP 164.A OD2 no hydrogen 2.918 N/A ARG 130.A NH2 ASP 164.A OD1 no hydrogen 2.986 N/A ILE 133.A N GLN 129.A O no hydrogen 3.076 N/A LEU 134.A N ARG 130.A O no hydrogen 3.140 N/A ARG 135.A N THR 131.A O no hydrogen 3.348 N/A ARG 135.A NE THR 131.A O no hydrogen 3.433 N/A LEU 136.A N GLU 132.A O no hydrogen 3.407 N/A LEU 137.A N ILE 133.A O no hydrogen 3.086 N/A ASN 138.A N LEU 134.A O no hydrogen 3.084 N/A ASP 139.A N ARG 135.A O no hydrogen 2.636 N/A HIS 140.A N LEU 136.A O no hydrogen 2.958 N/A THR 143.A N HIS 140.A O no hydrogen 3.023 N/A THR 144.A N ASP 113.A O no hydrogen 2.791 N/A PHE 145.A N ASN 170.A O no hydrogen 2.630 N/A VAL 146.A N CYS 115.A O no hydrogen 2.678 N/A LEU 147.A N VAL 172.A O no hydrogen 2.839 N/A ASP 148.A N LEU 117.A O no hydrogen 2.906 N/A GLN 149.A N VAL 173.A O no hydrogen 2.959 N/A GLN 149.A NE2 ILE 160.A O no hydrogen 3.115 N/A GLN 149.A NE2 TYR 174.A OH no hydrogen 3.140 N/A SER 150.A N ASP 148.A OD1 no hydrogen 3.007 N/A SER 150.A OG ASP 148.A OD1 no hydrogen 2.651 N/A TYR 151.A OH THR 8.A OG1 no hydrogen 2.705 N/A VAL 152.A N GLN 149.A O no hydrogen 3.084 N/A PHE 154.A N TYR 151.A O no hydrogen 2.787 N/A GLU 157.A N THR 155.A OG1 no hydrogen 3.150 N/A ARG 161.A N ASP 164.A OD2 no hydrogen 2.769 N/A ASP 164.A N ARG 161.A O no hydrogen 2.957 N/A ILE 165.A N PRO 162.A O no hydrogen 3.230 N/A LYS 166.A NZ SER 48.A O no hydrogen 2.569 N/A ARG 168.A N ILE 165.A O no hydrogen 3.239 N/A ARG 168.A NE ASP 164.A O no hydrogen 2.822 N/A LYS 169.A NZ ASN 193.A O no hydrogen 3.446 N/A ASN 170.A ND2 LEU 137.A O no hydrogen 2.755 N/A ASN 170.A ND2 HIS 140.A O no hydrogen 3.325 N/A ASN 170.A ND2 THR 143.A O no hydrogen 3.328 N/A VAL 172.A N PHE 145.A O no hydrogen 2.976 N/A TYR 174.A N TYR 189.A O no hydrogen 2.757 N/A PHE 176.A N ILE 187.A O no hydrogen 3.232 N/A SER 177.A N SER 175.A OG no hydrogen 3.120 N/A LEU 185.A N ILE 182.A O no hydrogen 3.245 N/A ARG 186.A NH1 PRO 183.A O no hydrogen 3.035 N/A GLY 188.A N THR 57.A O no hydrogen 3.303 N/A TYR 189.A N TYR 174.A O no hydrogen 3.051 N/A TYR 189.A OH ASN 47.A OD1 no hydrogen 3.204 N/A ILE 190.A N LEU 55.A O no hydrogen 2.776 N/A ALA 192.A N ALA 53.A O no hydrogen 3.102 N/A VAL 199.A N PHE 196.A O no hydrogen 3.280 N/A PHE 202.A N VAL 199.A O no hydrogen 3.140 N/A SER 203.A N ALA 200.A O no hydrogen 2.972 N/A SER 203.A OG ALA 200.A O no hydrogen 3.371 N/A TRP 206.A N PRO 35.A O no hydrogen 3.068 N/A ASN 209.A ND2 LEU 185.A O no hydrogen 3.136 N/A ALA 212.A N ASN 209.A OD1 no hydrogen 3.162 N/A ILE 213.A N ASN 209.A O no hydrogen 3.118 N/A GLU 214.A N ALA 210.A O no hydrogen 3.136 N/A ALA 215.A N LEU 211.A O no hydrogen 2.830 N/A ALA 216.A N ALA 212.A O no hydrogen 3.012 N/A LYS 217.A N ILE 213.A O no hydrogen 3.039 N/A PHE 218.A N GLU 214.A O no hydrogen 3.229 N/A ILE 219.A N ALA 215.A O no hydrogen 2.987 N/A LEU 220.A N ALA 216.A O no hydrogen 2.953 N/A ILE 221.A N LYS 217.A O no hydrogen 3.201 N/A ILE 221.A N PHE 218.A O no hydrogen 3.216 N/A HIS 222.A N ILE 219.A O no hydrogen 3.243 N/A PHE 226.A N HIS 222.A O no hydrogen 3.292 N/A PHE 226.A N PRO 223.A O no hydrogen 3.283 N/A THR 227.A N ALA 224.A O no hydrogen 3.136 N/A THR 227.A OG1 PRO 223.A O no hydrogen 2.702 N/A TRP 233.A N PRO 229.A O no hydrogen 3.157 N/A TRP 233.A NE1 THR 300.A O no hydrogen 2.770 N/A GLN 234.A N ILE 230.A O no hydrogen 2.932 N/A GLN 234.A NE2 THR 156.A OG1 no hydrogen 2.641 N/A ARG 235.A N ARG 231.A O no hydrogen 2.866 N/A ASN 236.A N LYS 232.A O no hydrogen 3.029 N/A THR 237.A N TRP 233.A O no hydrogen 3.069 N/A THR 237.A N GLN 234.A O no hydrogen 3.055 N/A THR 237.A OG1 TRP 233.A O no hydrogen 2.770 N/A THR 237.A OG1 THR 300.A OG1 no hydrogen 2.815 N/A VAL 238.A N GLN 234.A O no hydrogen 3.153 N/A ASP 239.A N ARG 235.A O no hydrogen 3.247 N/A PHE 240.A N ASN 236.A O no hydrogen 3.018 N/A ILE 241.A N THR 237.A O no hydrogen 2.782 N/A THR 242.A N VAL 238.A O no hydrogen 3.014 N/A THR 242.A OG1 VAL 238.A O no hydrogen 2.935 N/A ALA 243.A N ASP 239.A O no hydrogen 3.508 N/A LEU 244.A N PHE 240.A O no hydrogen 2.970 N/A ASN 245.A N ILE 241.A O no hydrogen 2.930 N/A ARG 246.A N THR 242.A O no hydrogen 3.204 N/A LEU 247.A N LEU 244.A O no hydrogen 3.074 N/A GLU 251.A N ARG 263.A O no hydrogen 2.937 N/A VAL 252.A N ASN 245.A OD1 no hydrogen 3.002 N/A HIS 253.A N LEU 261.A O no hydrogen 2.920 N/A HIS 253.A ND1 PRO 254.A O no hydrogen 2.809 N/A SER 255.A OG THR 257.A O no hydrogen 3.546 N/A SER 255.A OG PHE 259.A O no hydrogen 2.783 N/A GLY 256.A N GLY 125.A O no hydrogen 2.976 N/A THR 257.A N SER 255.A OG no hydrogen 3.367 N/A THR 257.A OG1 PHE 154.A O no hydrogen 2.514 N/A PHE 260.A N ILE 298.A O no hydrogen 3.001 N/A LEU 262.A N VAL 296.A O no hydrogen 2.929 N/A ARG 263.A N GLU 251.A O no hydrogen 2.702 N/A ARG 263.A NE TYR 295.A OH no hydrogen 2.829 N/A ARG 263.A NH1 TYR 295.A OH no hydrogen 3.555 N/A LEU 264.A N SER 294.A O no hydrogen 2.851 N/A LYS 265.A N GLY 249.A O no hydrogen 2.714 N/A THR 268.A N GLU 271.A OE1 no hydrogen 3.464 N/A ALA 269.A N GLU 293.A O no hydrogen 2.561 N/A GLU 271.A N THR 268.A OG1 no hydrogen 3.263 N/A LEU 272.A N THR 268.A O no hydrogen 2.806 N/A LYS 273.A N ALA 269.A O no hydrogen 2.867 N/A LYS 274.A N ALA 270.A O no hydrogen 3.234 N/A TYR 275.A N GLU 271.A O no hydrogen 3.436 N/A GLU 277.A N LYS 274.A O no hydrogen 2.840 N/A GLU 278.A N TYR 275.A O no hydrogen 2.543 N/A ASN 280.A N LEU 276.A O no hydrogen 2.968 N/A ARG 283.A N ARG 297.A O no hydrogen 3.414 N/A ARG 283.A NH1 ASP 284.A O no hydrogen 2.803 N/A ARG 283.A NH1 ASN 287.A OD1 no hydrogen 2.700 N/A ALA 285.A N TYR 295.A O no hydrogen 2.956 N/A SER 286.A N ASP 284.A OD1 no hydrogen 2.691 N/A PHE 288.A N ALA 285.A O no hydrogen 3.085 N/A LEU 291.A N PHE 288.A O no hydrogen 3.080 N/A SER 294.A N ASP 292.A OD1 no hydrogen 3.274 N/A SER 294.A OG ASP 292.A OD1 no hydrogen 2.663 N/A TYR 295.A N ASP 292.A O no hydrogen 3.491 N/A VAL 296.A N LEU 262.A O no hydrogen 3.032 N/A ARG 297.A N ARG 283.A O no hydrogen 2.847 N/A ARG 297.A NH1 ASN 122.A OD1 no hydrogen 2.603 N/A ARG 297.A NH2 SER 6.A O no hydrogen 2.823 N/A ILE 298.A N PHE 260.A O no hydrogen 2.884 N/A THR 299.A N PHE 5.A O no hydrogen 2.969 N/A THR 299.A OG1 THR 7.A O no hydrogen 2.498 N/A THR 300.A N THR 258.A O no hydrogen 3.107 N/A THR 300.A OG1 THR 237.A OG1 no hydrogen 2.815 N/A THR 300.A OG1 THR 258.A O no hydrogen 3.259 N/A GLN 301.A N ASN 306.A OD1 no hydrogen 3.037 N/A GLN 301.A NE2 THR 299.A O no hydrogen 2.917 N/A ARG 302.A N GLN 305.A OE1 no hydrogen 3.170 N/A ARG 302.A NE ASP 12.A OD2 no hydrogen 2.927 N/A ARG 302.A NH1 ASP 12.A OD1 no hydrogen 3.325 N/A ARG 302.A NH1 ASP 12.A OD2 no hydrogen 3.486 N/A ASN 306.A N ARG 302.A O no hydrogen 2.668 N/A ASN 306.A ND2 GLN 301.A O no hydrogen 3.143 N/A GLN 307.A N PRO 303.A O no hydrogen 2.656 N/A LEU 308.A N ALA 304.A O no hydrogen 3.122 N/A PHE 309.A N GLN 305.A O no hydrogen 2.900 N/A PHE 309.A N ASN 306.A O no hydrogen 3.006 N/A ILE 310.A N ASN 306.A O no hydrogen 3.056 N/A LYS 311.A N GLN 307.A O no hydrogen 3.459 N/A ALA 312.A N LEU 308.A O no hydrogen 3.315 N/A LEU 313.A N PHE 309.A O no hydrogen 2.896 N/A GLU 314.A N ILE 310.A O no hydrogen 2.927 N/A THR 315.A N LYS 311.A O no hydrogen 2.760 N/A THR 315.A OG1 LYS 311.A O no hydrogen 3.080 N/A PHE 316.A N ALA 312.A O no hydrogen 3.263 N/A LEU 317.A N LEU 313.A O no hydrogen 2.878 N/A GLU 318.A N GLU 314.A O no hydrogen 3.206 N/A LYS 319.A N PHE 316.A O no hydrogen 2.661 N/A