Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1kdk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 5.A N LEU 154.A O no hydrogen 2.870 N/A HIS 6.A N ARG 175.A O no hydrogen 2.845 N/A LEU 7.A N GLY 152.A O no hydrogen 2.943 N/A SER 8.A OG LEU 150.A O no hydrogen 2.839 N/A ASN 9.A ND2 SER 173.A O no hydrogen 3.402 N/A ILE 16.A N LEU 132.A O no hydrogen 2.954 N/A VAL 18.A N SER 169.A O no hydrogen 2.817 N/A MET 19.A N ILE 130.A O no hydrogen 2.746 N/A THR 20.A N SER 167.A O no hydrogen 2.844 N/A PHE 21.A N MET 128.A O no hydrogen 2.784 N/A ASP 22.A N ALA 164.A O no hydrogen 2.923 N/A LEU 23.A N PRO 126.A O no hydrogen 2.896 N/A THR 24.A N ASP 22.A OD1 no hydrogen 2.947 N/A THR 24.A OG1 ASP 22.A OD1 no hydrogen 2.770 N/A LYS 25.A N ASP 22.A O no hydrogen 3.088 N/A LYS 25.A NZ ASP 22.A OD2 no hydrogen 3.313 N/A ILE 26.A N ASP 22.A O no hydrogen 3.229 N/A THR 27.A N ASP 161.A OD2 no hydrogen 2.836 N/A THR 27.A OG1 ASP 161.A OD2 no hydrogen 2.536 N/A LYS 28.A N ASP 161.A OD2 no hydrogen 3.217 N/A THR 29.A OG1 MET 96.A O no hydrogen 3.078 N/A SER 31.A N VAL 94.A O no hydrogen 2.863 N/A SER 32.A N SER 158.A O no hydrogen 2.901 N/A PHE 33.A N VAL 92.A O no hydrogen 2.986 N/A GLU 34.A N ARG 155.A O no hydrogen 2.936 N/A VAL 35.A N HIS 90.A O no hydrogen 3.023 N/A ARG 36.A N CYS 153.A O no hydrogen 2.978 N/A THR 37.A OG1 ASP 39.A O no hydrogen 3.565 N/A THR 37.A OG1 ASP 151.A O no hydrogen 2.567 N/A ASP 39.A N THR 37.A OG1 no hydrogen 2.913 N/A GLU 41.A N ASP 39.A OD1 no hydrogen 3.308 N/A GLY 42.A N LEU 60.A O no hydrogen 2.978 N/A VAL 43.A N PRO 148.A O no hydrogen 2.786 N/A ILE 44.A N LEU 58.A O no hydrogen 2.824 N/A PHE 45.A N LEU 58.A O no hydrogen 3.084 N/A TYR 46.A N ALA 131.A O no hydrogen 2.833 N/A TYR 46.A OH ASP 48.A OD2 no hydrogen 2.575 N/A GLY 47.A N PHE 56.A O no hydrogen 2.765 N/A ASP 48.A N ARG 129.A O no hydrogen 2.817 N/A THR 49.A N ASP 54.A O no hydrogen 2.975 N/A THR 49.A OG1 ASP 54.A OD2 no hydrogen 2.504 N/A ASN 50.A N ASP 54.A O no hydrogen 3.351 N/A LYS 52.A N ASN 50.A OD1 no hydrogen 2.711 N/A ASP 54.A N ASN 50.A O no hydrogen 2.938 N/A TRP 55.A N HIS 70.A O no hydrogen 2.883 N/A PHE 56.A N GLY 47.A O no hydrogen 2.829 N/A MET 57.A N GLN 68.A O no hydrogen 2.705 N/A LEU 58.A N PHE 45.A O no hydrogen 2.891 N/A GLY 59.A N GLU 66.A O no hydrogen 2.858 N/A LEU 60.A N GLY 42.A O no hydrogen 2.863 N/A ARG 61.A N ARG 64.A O no hydrogen 2.962 N/A ARG 61.A NE GLU 66.A OE1 no hydrogen 2.668 N/A ARG 61.A NE GLU 66.A OE2 no hydrogen 3.382 N/A ARG 61.A NH1 PRO 145.A O no hydrogen 3.012 N/A ARG 61.A NH2 GLU 66.A OE2 no hydrogen 2.788 N/A ARG 61.A NH2 LEU 144.A O no hydrogen 3.024 N/A ARG 61.A NH2 PRO 145.A O no hydrogen 3.377 N/A GLY 63.A N PRO 40.A O no hydrogen 2.862 N/A ARG 64.A N ARG 61.A O no hydrogen 3.022 N/A ARG 64.A NH1 GLY 81.A O no hydrogen 2.976 N/A GLU 66.A N GLY 59.A O no hydrogen 2.879 N/A ILE 67.A N VAL 78.A O no hydrogen 2.798 N/A GLN 68.A N MET 57.A O no hydrogen 3.027 N/A GLN 68.A NE2 GLU 66.A OE2 no hydrogen 2.811 N/A GLN 68.A NE2 LEU 144.A O no hydrogen 3.011 N/A LEU 69.A N LEU 76.A O no hydrogen 2.964 N/A HIS 70.A N TRP 55.A O no hydrogen 2.897 N/A ASN 71.A N ALA 74.A O no hydrogen 2.867 N/A GLN 75.A NE2 ASN 71.A O no hydrogen 3.119 N/A LEU 76.A N LEU 69.A O no hydrogen 2.949 N/A VAL 78.A N ILE 67.A O no hydrogen 2.826 N/A ALA 80.A N PRO 65.A O no hydrogen 3.125 N/A ARG 83.A NE ASP 85.A OD1 no hydrogen 2.847 N/A ARG 83.A NH2 ASP 85.A OD2 no hydrogen 2.871 N/A LEU 84.A N GLY 63.A O no hydrogen 2.728 N/A GLY 87.A N THR 37.A O no hydrogen 2.980 N/A ARG 88.A N ASP 86.A OD1 no hydrogen 3.318 N/A HIS 90.A N VAL 35.A O no hydrogen 2.892 N/A HIS 90.A ND1 ASP 106.A OD1 no hydrogen 2.750 N/A HIS 90.A NE2 ASP 86.A OD1 no hydrogen 2.726 N/A GLN 91.A N ASP 106.A OD2 no hydrogen 2.778 N/A VAL 92.A N PHE 33.A O no hydrogen 2.843 N/A GLU 93.A N GLU 104.A O no hydrogen 2.914 N/A VAL 94.A N SER 31.A O no hydrogen 2.833 N/A LYS 95.A N LEU 102.A O no hydrogen 2.876 N/A MET 96.A N THR 29.A O no hydrogen 2.854 N/A GLU 97.A N SER 100.A O no hydrogen 2.932 N/A SER 100.A N GLU 97.A O no hydrogen 2.829 N/A SER 100.A OG ASP 99.A OD2 no hydrogen 3.274 N/A VAL 101.A N LEU 113.A O no hydrogen 2.875 N/A LEU 102.A N LYS 95.A O no hydrogen 2.775 N/A LEU 103.A N LEU 111.A O no hydrogen 2.872 N/A GLU 104.A N GLU 93.A O no hydrogen 2.882 N/A VAL 105.A N GLU 108.A O no hydrogen 2.926 N/A ASP 106.A N GLN 91.A O no hydrogen 2.743 N/A GLU 108.A N VAL 105.A O no hydrogen 2.984 N/A VAL 110.A N LEU 103.A O no hydrogen 2.860 N/A ARG 112.A NE GLU 109.A OE2 no hydrogen 2.987 N/A ARG 112.A NH2 GLU 109.A OE1 no hydrogen 2.597 N/A ARG 112.A NH2 GLU 109.A OE2 no hydrogen 3.322 N/A LEU 113.A N VAL 101.A O no hydrogen 2.707 N/A GLN 115.A N ASP 99.A OD2 no hydrogen 3.091 N/A VAL 116.A N ASP 99.A O no hydrogen 2.959 N/A SER 117.A N ASP 99.A O no hydrogen 3.111 N/A SER 117.A OG GLY 118.A O no hydrogen 2.727 N/A THR 121.A OG1 LEU 23.A O no hydrogen 3.233 N/A SER 122.A N LEU 120.A O no hydrogen 3.006 N/A SER 122.A OG THR 121.A O no hydrogen 3.079 N/A LYS 123.A N LEU 120.A O no hydrogen 2.969 N/A LYS 123.A NZ ASP 54.A OD1 no hydrogen 3.455 N/A LYS 123.A NZ ASP 54.A OD2 no hydrogen 3.083 N/A MET 128.A N PHE 21.A O no hydrogen 2.886 N/A ARG 129.A N ASP 48.A O no hydrogen 2.808 N/A ARG 129.A NE ASP 48.A OD1 no hydrogen 2.957 N/A ARG 129.A NH2 ASP 48.A OD2 no hydrogen 2.917 N/A ILE 130.A N MET 19.A O no hydrogen 2.838 N/A ALA 131.A N TYR 46.A O no hydrogen 2.727 N/A LEU 132.A N ALA 17.A O no hydrogen 2.859 N/A GLY 133.A N ILE 44.A O no hydrogen 2.828 N/A ASN 141.A N PRO 138.A O no hydrogen 2.875 N/A ASN 141.A ND2 SER 140.A OG no hydrogen 3.178 N/A LEU 142.A N ALA 139.A O no hydrogen 3.118 N/A ARG 143.A NE THR 77.A OG1 no hydrogen 2.838 N/A ARG 143.A NH1 THR 77.A OG1 no hydrogen 3.348 N/A LEU 144.A N GLN 68.A OE1 no hydrogen 3.024 N/A VAL 147.A N GLU 41.A OE2 no hydrogen 2.829 N/A ASP 151.A N ASP 39.A OD2 no hydrogen 2.862 N/A CYS 153.A N ARG 36.A O no hydrogen 2.784 N/A CYS 153.A SG HIS 6.A ND1 no hydrogen 3.974 N/A LEU 154.A N VAL 5.A O no hydrogen 2.818 N/A ARG 155.A N GLU 34.A O no hydrogen 3.005 N/A ARG 155.A NE GLU 34.A OE1 no hydrogen 2.626 N/A ARG 155.A NH2 GLU 34.A OE1 no hydrogen 3.058 N/A ARG 156.A NH1 GLU 34.A OE2 no hydrogen 2.990 N/A SER 158.A N SER 32.A O no hydrogen 2.786 N/A TRP 159.A NE1 ASP 157.A OD1 no hydrogen 2.825 N/A LEU 160.A N SER 31.A OG no hydrogen 3.199 N/A GLN 163.A N ASP 161.A OD1 no hydrogen 3.365 N/A GLN 163.A NE2 LYS 25.A O no hydrogen 2.989 N/A GLN 163.A NE2 ASP 161.A OD2 no hydrogen 2.683 N/A ALA 164.A N ASP 161.A O no hydrogen 2.757 N/A GLU 165.A N LYS 162.A O no hydrogen 3.119 N/A ILE 166.A N THR 20.A O no hydrogen 2.761 N/A SER 169.A N VAL 18.A O no hydrogen 2.782 N/A SER 176.A OG ALA 4.A O no hydrogen 3.457 N/A CYS 177.A N ALA 4.A O no hydrogen 2.961 N/A