Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4wku_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 6.A N ARG 18.A O no hydrogen 2.816 N/A ARG 8.A N HIS 16.A O no hydrogen 2.909 N/A THR 10.A N VAL 14.A O no hydrogen 3.045 N/A THR 10.A OG1 VAL 14.A O no hydrogen 3.500 N/A THR 10.A OG1 HIS 16.A NE2 no hydrogen 2.805 N/A GLY 13.A N THR 10.A O no hydrogen 3.270 N/A HIS 16.A N ARG 8.A O no hydrogen 2.542 N/A HIS 16.A NE2 THR 10.A OG1 no hydrogen 2.805 N/A ARG 18.A N ASP 6.A O no hydrogen 2.721 N/A ARG 18.A NH2 ASP 6.A OD2 no hydrogen 2.895 N/A LYS 20.A NZ ASP 21.A OD2 no hydrogen 3.345 N/A GLU 22.A N GLU 22.A OE1 no hydrogen 2.722 N/A ARG 23.A NH1 GLU 100.A OE1 no hydrogen 2.429 N/A GLY 24.A N ASP 21.A OD1 no hydrogen 2.784 N/A LEU 25.A N ASP 21.A O no hydrogen 2.962 N/A GLY 26.A N GLU 22.A O no hydrogen 2.894 N/A TYR 27.A N ARG 23.A O no hydrogen 3.083 N/A GLY 28.A N GLY 24.A O no hydrogen 3.170 N/A ILE 29.A N LEU 25.A O no hydrogen 3.099 N/A GLY 30.A N GLY 26.A O no hydrogen 2.888 N/A TYR 31.A N TYR 27.A O no hydrogen 3.188 N/A ALA 32.A N GLY 28.A O no hydrogen 3.007 N/A TYR 33.A N ILE 29.A O no hydrogen 2.939 N/A ALA 34.A N GLY 30.A O no hydrogen 3.057 N/A ARG 35.A N TYR 31.A O no hydrogen 3.096 N/A ASP 36.A N TYR 33.A O no hydrogen 3.136 N/A ASN 37.A N TYR 33.A O no hydrogen 2.600 N/A ALA 38.A N ALA 34.A O no hydrogen 3.034 N/A LEU 41.A N ASN 37.A O no hydrogen 3.084 N/A ALA 42.A N ALA 38.A O no hydrogen 2.962 N/A GLU 43.A N CYS 39.A O no hydrogen 3.082 N/A GLU 44.A N LEU 40.A O no hydrogen 3.100 N/A ILE 45.A N LEU 41.A O no hydrogen 2.900 N/A VAL 46.A N ALA 42.A O no hydrogen 3.085 N/A THR 47.A N GLU 43.A O no hydrogen 3.085 N/A THR 47.A OG1 GLU 43.A O no hydrogen 3.254 N/A ALA 48.A N GLU 44.A O no hydrogen 2.913 N/A ARG 49.A N ILE 45.A O no hydrogen 2.839 N/A ARG 49.A NE GLU 51.A OE1 no hydrogen 2.963 N/A ARG 49.A NE GLU 51.A OE2 no hydrogen 3.279 N/A ARG 49.A NH1 ASP 133.A OD1 no hydrogen 3.037 N/A ARG 49.A NH2 GLU 51.A OE2 no hydrogen 3.065 N/A GLY 50.A N THR 47.A O no hydrogen 2.934 N/A GLU 51.A N VAL 46.A O no hydrogen 2.933 N/A ARG 52.A N ASP 72.A OD1 no hydrogen 2.851 N/A ARG 52.A NE ASN 68.A OD1 no hydrogen 2.838 N/A ARG 52.A NH1 GLU 43.A OE1 no hydrogen 2.955 N/A ARG 52.A NH1 THR 47.A OG1 no hydrogen 2.950 N/A ARG 52.A NH2 GLU 43.A OE1 no hydrogen 3.092 N/A ALA 53.A N ASP 72.A OD2 no hydrogen 2.535 N/A TYR 55.A N GLU 51.A O no hydrogen 3.275 N/A PHE 56.A N ARG 52.A O no hydrogen 2.745 N/A GLY 57.A N ALA 53.A O no hydrogen 2.971 N/A SER 62.A N LEU 66.A O no hydrogen 2.861 N/A SER 63.A OG GLU 44.A OE1 no hydrogen 3.201 N/A SER 63.A OG GLU 44.A OE2 no hydrogen 2.606 N/A ALA 64.A N SER 62.A OG no hydrogen 3.170 N/A GLU 65.A N SER 62.A O no hydrogen 3.013 N/A LEU 66.A N SER 62.A OG no hydrogen 3.328 N/A ASN 68.A N GLY 60.A O no hydrogen 3.053 N/A ASN 68.A ND2 GLY 57.A O no hydrogen 2.931 N/A SER 71.A N ASP 67.A O no hydrogen 2.981 N/A ASP 72.A N ASN 68.A O no hydrogen 2.852 N/A ILE 73.A N LEU 69.A O no hydrogen 2.878 N/A PHE 74.A N PRO 70.A O no hydrogen 2.951 N/A TYR 75.A N SER 71.A O no hydrogen 2.978 N/A ALA 76.A N ASP 72.A O no hydrogen 2.898 N/A TRP 77.A N ILE 73.A O no hydrogen 3.080 N/A LEU 78.A N PHE 74.A O no hydrogen 2.808 N/A ASN 79.A N TYR 75.A O no hydrogen 2.848 N/A ASN 79.A ND2 ALA 48.A O no hydrogen 2.997 N/A ASN 79.A ND2 ARG 136.A O no hydrogen 3.351 N/A GLN 80.A NE2 TRP 77.A O no hydrogen 2.882 N/A LEU 84.A N GLN 80.A O no hydrogen 3.075 N/A GLN 85.A N PRO 81.A O no hydrogen 2.979 N/A ALA 86.A N GLU 82.A O no hydrogen 3.175 N/A PHE 87.A N ALA 83.A O no hydrogen 3.108 N/A TRP 88.A N LEU 84.A O no hydrogen 2.970 N/A GLN 89.A N GLN 85.A O no hydrogen 2.934 N/A ALA 90.A N ALA 86.A O no hydrogen 3.216 N/A ALA 90.A N PHE 87.A O no hydrogen 3.142 N/A GLN 91.A N TRP 88.A O no hydrogen 3.045 N/A GLN 91.A NE2 PHE 87.A O no hydrogen 2.932 N/A VAL 95.A N THR 92.A OG1 no hydrogen 3.260 N/A ARG 96.A N THR 92.A O no hydrogen 2.973 N/A ARG 96.A NE GLN 91.A O no hydrogen 3.086 N/A ARG 96.A NH2 GLN 89.A O no hydrogen 3.060 N/A ARG 96.A NH2 GLN 91.A O no hydrogen 3.567 N/A GLN 97.A N PRO 93.A O no hydrogen 3.021 N/A LEU 98.A N ALA 94.A O no hydrogen 3.072 N/A LEU 99.A N VAL 95.A O no hydrogen 3.049 N/A GLU 100.A N ARG 96.A O no hydrogen 2.912 N/A GLY 101.A N GLN 97.A O no hydrogen 2.910 N/A TYR 102.A N LEU 98.A O no hydrogen 2.871 N/A ALA 103.A N LEU 99.A O no hydrogen 2.976 N/A ALA 104.A N GLU 100.A O no hydrogen 3.131 N/A GLY 105.A N GLY 101.A O no hydrogen 2.908 N/A PHE 106.A N TYR 102.A O no hydrogen 2.925 N/A ASN 107.A N ALA 103.A O no hydrogen 2.975 N/A ASN 107.A ND2 ILE 129.A O no hydrogen 2.901 N/A ARG 108.A N ALA 104.A O no hydrogen 2.977 N/A ARG 108.A NE GLU 112.A OE1 no hydrogen 3.460 N/A ARG 108.A NH1 TYR 27.A OH no hydrogen 2.905 N/A PHE 109.A N GLY 105.A O no hydrogen 3.284 N/A LEU 110.A N PHE 106.A O no hydrogen 3.212 N/A ARG 111.A N ASN 107.A O no hydrogen 3.126 N/A GLU 112.A N ARG 108.A O no hydrogen 3.385 N/A GLU 112.A N PHE 109.A O no hydrogen 3.119 N/A ALA 113.A N PHE 109.A O no hydrogen 2.779 N/A LYS 116.A N ASP 114.A OD1 no hydrogen 3.347 N/A THR 117.A OG1 ARG 35.A O no hydrogen 2.860 N/A GLN 123.A N CYS 120.A O no hydrogen 3.191 N/A LEU 126.A N GLN 123.A O no hydrogen 3.092 N/A ARG 127.A NH1 PRO 124.A O no hydrogen 3.200 N/A ILE 129.A N ASN 107.A OD1 no hydrogen 2.704 N/A ALA 130.A N ASP 133.A OD2 no hydrogen 2.997 N/A ASP 133.A N ALA 130.A O no hydrogen 2.973 N/A LEU 135.A N THR 131.A O no hydrogen 3.010 N/A ARG 136.A N ASP 132.A O no hydrogen 2.909 N/A LEU 137.A N ASP 133.A O no hydrogen 3.076 N/A THR 138.A N LEU 134.A O no hydrogen 2.987 N/A THR 138.A OG1 LEU 134.A O no hydrogen 2.817 N/A ARG 139.A N LEU 135.A O no hydrogen 2.941 N/A ARG 139.A NE ASN 79.A OD1 no hydrogen 3.153 N/A ARG 139.A NH2 LEU 78.A O no hydrogen 3.056 N/A ARG 140.A N ARG 136.A O no hydrogen 3.041 N/A ARG 140.A NH1 GLU 44.A OE1 no hydrogen 2.633 N/A ARG 140.A NH2 GLU 44.A OE1 no hydrogen 2.975 N/A LEU 141.A N LEU 137.A O no hydrogen 3.008 N/A LEU 142.A N THR 138.A O no hydrogen 2.922 N/A VAL 143.A N ARG 139.A O no hydrogen 3.175 N/A GLU 144.A N LEU 141.A O no hydrogen 3.236 N/A GLY 146.A N VAL 143.A O no hydrogen 2.953 N/A GLY 148.A N VAL 143.A O no hydrogen 2.846 N/A GLN 149.A N GLY 146.A O no hydrogen 2.913 N/A GLN 149.A NE2 GLU 144.A O no hydrogen 3.110 N/A PHE 150.A N VAL 147.A O no hydrogen 2.915 N/A ALA 151.A N GLY 148.A O no hydrogen 3.341 N/A LEU 154.A N PHE 150.A O no hydrogen 2.809 N/A VAL 155.A N ALA 151.A O no hydrogen 3.138 N/A ALA 156.A N ASP 152.A O no hydrogen 2.954 N/A ALA 157.A N LEU 154.A O no hydrogen 3.201 N/A GLY 161.A N GLU 163.A OE1 no hydrogen 3.032 N/A GLY 161.A N GLU 163.A OE2 no hydrogen 2.913 N/A