Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3tkq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A N ASP 111.A O no hydrogen 2.849 N/A LYS 2.A NZ ASP 111.A OD1 no hydrogen 3.480 N/A SER 6.A N LEU 135.A O no hydrogen 2.596 N/A SER 6.A OG ILE 5.A O no hydrogen 2.693 N/A LYS 7.A N LYS 4.A O no hydrogen 3.031 N/A ALA 9.A N GLY 133.A O no hydrogen 2.908 N/A TYR 11.A OH GLU 13.A OE1 no hydrogen 2.769 N/A GLY 14.A N LEU 25.A O no hydrogen 2.992 N/A THR 15.A OG1 GLU 24.A OE2 no hydrogen 2.871 N/A ALA 16.A N LYS 23.A O no hydrogen 2.835 N/A VAL 17.A N LEU 100.A O no hydrogen 3.023 N/A ILE 18.A N GLU 21.A O no hydrogen 2.818 N/A GLU 21.A N ILE 18.A O no hydrogen 3.261 N/A LYS 23.A N ALA 16.A O no hydrogen 2.813 N/A LEU 25.A N GLY 14.A O no hydrogen 2.804 N/A LYS 26.A N ASP 29.A OD2 no hydrogen 2.979 N/A LEU 27.A N TRP 12.A O no hydrogen 2.928 N/A ASP 29.A N LYS 26.A O no hydrogen 3.115 N/A TYR 30.A N LEU 27.A O no hydrogen 3.125 N/A ARG 31.A N THR 28.A O no hydrogen 3.268 N/A GLY 32.A N ASP 131.A O no hydrogen 2.911 N/A LYS 33.A N TYR 30.A O no hydrogen 3.004 N/A LYS 33.A NZ GLU 68.A OE2 no hydrogen 3.277 N/A TYR 34.A N ASN 66.A O no hydrogen 2.978 N/A TYR 34.A OH ASP 163.A OD2 no hydrogen 2.576 N/A LEU 35.A N ILE 129.A O no hydrogen 2.691 N/A VAL 36.A N GLU 68.A O no hydrogen 2.856 N/A PHE 37.A N PHE 127.A O no hydrogen 2.857 N/A PHE 38.A N VAL 70.A O no hydrogen 2.953 N/A PHE 39.A N GLY 125.A O no hydrogen 2.715 N/A TYR 40.A N CYS 72.A O no hydrogen 2.946 N/A TYR 40.A OH ASP 43.A OD1 no hydrogen 2.782 N/A ASP 43.A N ASP 75.A OD2 no hydrogen 2.731 N/A THR 45.A OG1.B LEU 42.A O no hydrogen 2.231 N/A CYS 48.A SG.A THR 50.A OG1.A no hydrogen 3.502 N/A CYS 48.A SG.B LEU 42.A O no hydrogen 3.509 N/A CYS 48.A SG.B THR 45.A OG1.B no hydrogen 2.988 N/A THR 50.A N.A CYS 48.A O.A no hydrogen 2.707 N/A THR 50.A OG1.B VAL 47.A O.B no hydrogen 2.662 N/A ILE 52.A N CYS 48.A O.B no hydrogen 3.340 N/A ILE 53.A N PRO 49.A O.A no hydrogen 3.278 N/A ILE 53.A N PRO 49.A O.B no hydrogen 2.887 N/A ALA 54.A N THR 50.A O.A no hydrogen 3.004 N/A ALA 54.A N THR 50.A O.B no hydrogen 2.944 N/A PHE 55.A N GLU 51.A O no hydrogen 3.067 N/A GLY 56.A N ILE 52.A O no hydrogen 2.978 N/A ASP 57.A N ILE 53.A O no hydrogen 2.749 N/A ARG 58.A N ALA 54.A O no hydrogen 3.238 N/A ARG 58.A NE GLU 61.A OE2 no hydrogen 2.748 N/A ARG 58.A NH1 ASP 150.A OD1 no hydrogen 2.790 N/A ARG 58.A NH2 GLU 61.A OE1 no hydrogen 2.836 N/A ARG 58.A NH2 GLU 61.A OE2 no hydrogen 3.496 N/A ARG 58.A NH2 ASP 150.A OD1 no hydrogen 2.691 N/A GLU 61.A N ARG 58.A O no hydrogen 3.001 N/A PHE 62.A N LEU 59.A O no hydrogen 2.978 N/A ARG 63.A N LEU 59.A O no hydrogen 3.053 N/A ARG 63.A NE GLU 68.A OE1 no hydrogen 3.162 N/A ARG 63.A NE GLU 68.A OE2 no hydrogen 3.246 N/A ARG 63.A NH2 GLU 68.A OE1 no hydrogen 3.480 N/A SER 64.A N GLU 60.A O no hydrogen 2.970 N/A SER 64.A OG.A GLU 60.A O no hydrogen 2.633 N/A SER 64.A OG.B GLU 60.A O no hydrogen 3.371 N/A SER 64.A OG.B GLU 61.A O no hydrogen 2.866 N/A ILE 65.A N PHE 62.A O no hydrogen 2.957 N/A ASN 66.A N ARG 63.A O no hydrogen 3.256 N/A ASN 66.A ND2 GLY 32.A O no hydrogen 3.112 N/A THR 67.A N PHE 62.A O no hydrogen 3.014 N/A THR 67.A OG1 ILE 65.A O no hydrogen 3.131 N/A GLU 68.A N TYR 34.A O no hydrogen 2.938 N/A VAL 70.A N VAL 36.A O no hydrogen 2.910 N/A ALA 71.A N PRO 99.A O no hydrogen 3.261 N/A CYS 72.A SG SER 73.A O no hydrogen 3.914 N/A CYS 72.A SG LEU 101.A O no hydrogen 3.646 N/A SER 73.A N LEU 101.A O no hydrogen 3.252 N/A SER 73.A OG ASP 75.A OD2 no hydrogen 2.913 N/A ASP 75.A N SER 73.A OG no hydrogen 3.218 N/A SER 76.A OG THR 79.A OG1 no hydrogen 3.316 N/A GLN 77.A N GLN 77.A OE1 no hydrogen 2.698 N/A THR 79.A N SER 76.A OG no hydrogen 2.899 N/A THR 79.A OG1 SER 76.A OG no hydrogen 3.316 N/A HIS 80.A N SER 76.A O no hydrogen 3.029 N/A HIS 80.A ND1 ASP 43.A OD2 no hydrogen 2.633 N/A HIS 80.A NE2 LEU 101.A O no hydrogen 3.064 N/A LEU 81.A N GLN 77.A O no hydrogen 2.878 N/A ALA 82.A N PHE 78.A O no hydrogen 2.993 N/A TRP 83.A N THR 79.A O no hydrogen 2.855 N/A TRP 83.A NE1 GLY 91.A O no hydrogen 3.174 N/A ILE 84.A N HIS 80.A O no hydrogen 3.057 N/A ASN 85.A N LEU 81.A O no hydrogen 2.939 N/A THR 86.A N TRP 83.A O no hydrogen 3.042 N/A THR 86.A OG1 ALA 82.A O no hydrogen 2.773 N/A ARG 88.A NE LEU 93.A O no hydrogen 3.186 N/A GLN 90.A N PRO 87.A O no hydrogen 2.806 N/A GLY 91.A N ARG 88.A O no hydrogen 3.078 N/A GLY 92.A N PRO 87.A O no hydrogen 3.107 N/A LEU 93.A N TRP 83.A O no hydrogen 2.995 N/A GLY 94.A N THR 86.A O no hydrogen 2.952 N/A ARG 97.A NH1 GLU 60.A OE2 no hydrogen 3.152 N/A ARG 97.A NH2 GLU 60.A OE2 no hydrogen 3.191 N/A LEU 100.A N VAL 17.A O no hydrogen 3.130 N/A LEU 101.A N ALA 71.A O no hydrogen 2.778 N/A SER 102.A N THR 15.A O no hydrogen 2.965 N/A SER 102.A OG ASP 75.A O no hydrogen 2.684 N/A ASP 103.A N SER 73.A O no hydrogen 2.826 N/A HIS 106.A N ASP 103.A O no hydrogen 2.992 N/A GLN 107.A N THR 105.A OG1 no hydrogen 3.407 N/A GLN 107.A NE2 GLN 107.A O no hydrogen 3.286 N/A GLN 107.A NE2 ASP 111.A OD1 no hydrogen 2.940 N/A ILE 108.A N ASP 103.A OD1 no hydrogen 3.110 N/A SER 109.A N ASP 103.A OD2 no hydrogen 2.912 N/A SER 109.A OG ASP 103.A OD2 no hydrogen 2.573 N/A LYS 110.A N HIS 106.A O no hydrogen 2.968 N/A ASP 111.A N GLN 107.A O no hydrogen 2.887 N/A TYR 112.A N ILE 108.A O no hydrogen 3.001 N/A TYR 112.A N SER 109.A O no hydrogen 3.216 N/A TYR 112.A OH PRO 10.A O no hydrogen 2.681 N/A GLY 113.A N LYS 110.A O no hydrogen 3.036 N/A VAL 114.A N SER 109.A O no hydrogen 3.051 N/A TYR 115.A OH HIS 106.A ND1 no hydrogen 3.169 N/A LEU 116.A N HIS 121.A O no hydrogen 2.881 N/A SER 119.A N LEU 116.A O no hydrogen 2.990 N/A SER 119.A OG ASP 118.A OD2 no hydrogen 3.308 N/A GLY 120.A N LEU 116.A O no hydrogen 2.818 N/A HIS 121.A ND1 THR 122.A O no hydrogen 2.868 N/A THR 122.A OG1 TYR 40.A O no hydrogen 3.344 N/A THR 122.A OG1 LEU 123.A O no hydrogen 2.884 N/A LEU 123.A N VAL 114.A O no hydrogen 3.050 N/A ARG 124.A N ASN 141.A O no hydrogen 3.283 N/A ARG 124.A NE LEU 143.A O no hydrogen 2.559 N/A ARG 124.A NH1 GLU 51.A OE1 no hydrogen 2.514 N/A ARG 124.A NH2 LEU 143.A O no hydrogen 3.384 N/A LEU 126.A N THR 139.A O no hydrogen 2.818 N/A PHE 127.A N PHE 37.A O no hydrogen 2.771 N/A ILE 128.A N GLN 137.A O no hydrogen 3.033 N/A ILE 129.A N LEU 35.A O no hydrogen 2.844 N/A ASP 130.A N ILE 134.A O no hydrogen 2.890 N/A LYS 132.A N ASP 130.A OD1 no hydrogen 2.884 N/A GLY 133.A N ASP 130.A O no hydrogen 3.000 N/A ILE 134.A N ASP 130.A OD1 no hydrogen 2.874 N/A LEU 135.A N LYS 7.A O no hydrogen 2.864 N/A ARG 136.A N ILE 128.A O no hydrogen 2.847 N/A ARG 136.A NH1 ASP 130.A OD2 no hydrogen 3.329 N/A ARG 136.A NH1 ASP 163.A OD1 no hydrogen 2.991 N/A GLN 137.A NE2 THR 139.A OG1 no hydrogen 3.101 N/A THR 139.A N LEU 126.A O no hydrogen 2.944 N/A THR 139.A OG1 GLN 137.A OE1 no hydrogen 2.900 N/A ASN 141.A N ARG 124.A O no hydrogen 2.730 N/A ASN 141.A ND2 VAL 145.A O no hydrogen 2.850 N/A LEU 143.A N ASP 142.A OD1 no hydrogen 2.744 N/A VAL 145.A N ASP 142.A O no hydrogen 3.123 N/A ARG 147.A N GLU 51.A OE2 no hydrogen 3.052 N/A ARG 147.A NE GLU 51.A OE2 no hydrogen 2.961 N/A ARG 147.A NH1 PHE 39.A O no hydrogen 2.768 N/A ARG 147.A NH2 PHE 39.A O no hydrogen 2.892 N/A ARG 147.A NH2 GLU 51.A OE1 no hydrogen 2.591 N/A GLU 151.A N SER 148.A OG no hydrogen 3.078 N/A THR 152.A N SER 148.A O no hydrogen 3.099 N/A THR 152.A OG1 SER 148.A O no hydrogen 2.935 N/A LEU 153.A N VAL 149.A O no hydrogen 2.792 N/A ARG 154.A N ASP 150.A O no hydrogen 2.808 N/A ARG 154.A NE GLU 151.A OE1 no hydrogen 2.869 N/A ARG 154.A NH1 TRP 173.A O no hydrogen 3.321 N/A ARG 154.A NH2 GLU 151.A OE2 no hydrogen 3.182 N/A LEU 155.A N GLU 151.A O no hydrogen 3.005 N/A VAL 156.A N THR 152.A O no hydrogen 3.032 N/A GLN 157.A N LEU 153.A O no hydrogen 2.995 N/A ALA 158.A N ARG 154.A O no hydrogen 2.924 N/A PHE 159.A N LEU 155.A O no hydrogen 3.023 N/A GLN 160.A N VAL 156.A O no hydrogen 3.093 N/A GLN 160.A NE2 ILE 65.A O no hydrogen 2.811 N/A TYR 161.A N GLN 157.A O no hydrogen 2.860 N/A THR 162.A N ALA 158.A O no hydrogen 2.953 N/A THR 162.A OG1 ALA 158.A O no hydrogen 3.189 N/A THR 162.A OG1 PHE 159.A O no hydrogen 3.305 N/A ASP 163.A N PHE 159.A O no hydrogen 2.810 N/A LYS 164.A N TYR 161.A O no hydrogen 2.940 N/A HIS 165.A N TYR 161.A O no hydrogen 2.870 N/A GLY 166.A N THR 162.A O no hydrogen 2.961 N/A GLU 167.A N HIS 165.A O no hydrogen 2.553 N/A VAL 168.A N ILE 180.A O no hydrogen 2.905 N/A TRP 173.A N PRO 170.A O no hydrogen 3.106 N/A LYS 174.A N SER 177.A OG no hydrogen 3.353 N/A SER 177.A N LYS 174.A O no hydrogen 3.026 N/A SER 177.A OG LYS 174.A O no hydrogen 3.044 N/A THR 179.A OG1 GLU 167.A OE1 no hydrogen 2.782 N/A ILE 180.A N VAL 168.A O no hydrogen 3.013 N/A ASP 183.A N ILE 181.A O no hydrogen 2.703 N/A ALA 185.A N ASP 183.A OD2 no hydrogen 2.780 N/A GLY 186.A N ASP 183.A OD2 no hydrogen 2.813 N/A LYS 187.A N ASP 183.A O no hydrogen 2.928 N/A LEU 188.A N ALA 185.A O no hydrogen 3.110 N/A TYR 190.A N LYS 187.A O no hydrogen 3.056 N/A PHE 191.A N LYS 187.A O no hydrogen 3.118 N/A