Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wur_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A OG1 THR 3.A O no hydrogen 2.367 N/A THR 3.A OG1 GLU 26.A OE1 no hydrogen 3.044 N/A ILE 8.A N PRO 5.A O no hydrogen 3.010 N/A ARG 9.A NE GLN 151.A OE1 no hydrogen 2.608 N/A ARG 9.A NH2 GLN 151.A OE1 no hydrogen 2.677 N/A GLN 10.A N ASP 7.A O no hydrogen 2.873 N/A GLN 11.A N ILE 8.A O no hydrogen 3.012 N/A LEU 16.A N GLU 12.A O no hydrogen 2.886 N/A LEU 17.A N PRO 13.A O no hydrogen 3.151 N/A TYR 18.A N SER 14.A O no hydrogen 3.009 N/A TYR 18.A OH ASP 53.A OD2 no hydrogen 2.598 N/A THR 19.A N ALA 15.A O no hydrogen 2.818 N/A THR 19.A OG1 GLN 11.A OE1 no hydrogen 2.916 N/A THR 19.A OG1 ALA 15.A O no hydrogen 2.856 N/A LEU 20.A N LEU 16.A O no hydrogen 2.991 N/A VAL 21.A N LEU 17.A O no hydrogen 3.007 N/A SER 22.A N TYR 18.A O no hydrogen 2.937 N/A SER 22.A OG TYR 18.A O no hydrogen 2.845 N/A ALA 23.A N THR 19.A O no hydrogen 3.066 N/A TYR 24.A N LEU 20.A O no hydrogen 2.990 N/A TYR 24.A OH PHE 157.A O no hydrogen 2.660 N/A LEU 25.A N VAL 21.A O no hydrogen 2.960 N/A GLU 26.A N SER 22.A O no hydrogen 2.799 N/A HIS 27.A N ALA 23.A O no hydrogen 3.046 N/A THR 28.A N TYR 24.A O no hydrogen 2.976 N/A THR 28.A OG1 TYR 24.A O no hydrogen 3.312 N/A THR 28.A OG1 LEU 25.A O no hydrogen 3.359 N/A ALA 29.A N LEU 25.A O no hydrogen 2.907 N/A GLN 30.A N GLU 26.A O no hydrogen 3.008 N/A THR 31.A N HIS 27.A O no hydrogen 3.031 N/A THR 31.A OG1 HIS 27.A O no hydrogen 3.409 N/A THR 31.A OG1 THR 28.A O no hydrogen 3.381 N/A GLY 32.A N ALA 29.A O no hydrogen 3.391 N/A ASP 33.A N THR 28.A O no hydrogen 3.005 N/A ASP 33.A N THR 31.A OG1 no hydrogen 3.325 N/A GLU 34.A N GLY 32.A O no hydrogen 2.980 N/A SER 35.A OG GLU 34.A OE2 no hydrogen 2.744 N/A LEU 36.A N ASP 33.A O no hydrogen 2.890 N/A SER 37.A N ASP 33.A OD1 no hydrogen 2.936 N/A SER 37.A OG ASP 33.A OD1 no hydrogen 2.815 N/A SER 37.A OG ASP 33.A OD2 no hydrogen 3.350 N/A CYS 38.A N ASP 33.A OD2 no hydrogen 2.998 N/A CYS 38.A SG ASP 33.A OD2 no hydrogen 3.404 N/A LEU 39.A N LEU 36.A O no hydrogen 3.127 N/A SER 40.A N GLN 43.A OE1 no hydrogen 2.985 N/A GLN 43.A N SER 40.A OG no hydrogen 3.081 N/A GLN 43.A NE2 PHE 157.A O no hydrogen 3.442 N/A GLN 43.A NE2 HIS 159.A O no hydrogen 2.859 N/A HIS 44.A N SER 40.A O no hydrogen 2.873 N/A HIS 44.A NE2 LEU 36.A O no hydrogen 3.044 N/A THR 45.A N ASP 41.A O no hydrogen 2.953 N/A THR 45.A OG1 ASP 41.A O no hydrogen 3.207 N/A LEU 46.A N ASP 42.A O no hydrogen 3.133 N/A THR 47.A N GLN 43.A O no hydrogen 2.979 N/A THR 47.A OG1 GLN 43.A O no hydrogen 2.883 N/A ALA 48.A N HIS 44.A O no hydrogen 2.994 N/A PHE 49.A N THR 45.A O no hydrogen 2.958 N/A CYS 50.A N LEU 46.A O no hydrogen 2.926 N/A TYR 51.A N THR 47.A O no hydrogen 3.044 N/A LEU 52.A N ALA 48.A O no hydrogen 2.927 N/A ASP 53.A N PHE 49.A O no hydrogen 2.856 N/A SER 54.A N CYS 50.A O no hydrogen 2.885 N/A SER 54.A OG CYS 50.A O no hydrogen 3.361 N/A SER 54.A OG TYR 51.A O no hydrogen 3.242 N/A GLN 55.A N TYR 51.A O no hydrogen 3.062 N/A GLN 55.A NE2 SER 54.A OG no hydrogen 3.276 N/A VAL 56.A N LEU 52.A O no hydrogen 3.057 N/A GLU 57.A N ASP 53.A O no hydrogen 2.852 N/A GLU 58.A N SER 54.A O no hydrogen 3.065 N/A GLY 59.A N GLN 55.A O no hydrogen 2.957 N/A GLY 60.A N VAL 56.A O no hydrogen 2.882 N/A PHE 61.A N ASP 132.A OD1 no hydrogen 2.829 N/A GLN 63.A N GLY 59.A O no hydrogen 3.218 N/A GLN 63.A NE2 GLN 55.A OE1 no hydrogen 2.968 N/A GLN 63.A NE2 GLU 58.A OE1 no hydrogen 2.977 N/A LEU 64.A N GLY 60.A O no hydrogen 3.228 N/A ILE 65.A N PHE 61.A O no hydrogen 2.924 N/A ALA 66.A N VAL 62.A O no hydrogen 2.852 N/A SER 67.A N GLN 63.A O no hydrogen 2.928 N/A SER 67.A OG GLN 63.A O no hydrogen 3.303 N/A GLY 68.A N ILE 65.A O no hydrogen 3.005 N/A TYR 69.A N LEU 64.A O no hydrogen 3.072 N/A TYR 72.A N TYR 69.A O no hydrogen 3.015 N/A ILE 73.A N TYR 69.A O no hydrogen 3.004 N/A PHE 74.A N GLY 70.A O no hydrogen 2.969 N/A ARG 75.A NH1 GLU 71.A O no hydrogen 2.812 N/A ASP 80.A N ASN 76.A O no hydrogen 2.847 N/A SER 81.A N PRO 77.A O no hydrogen 2.941 N/A SER 81.A OG PRO 77.A O no hydrogen 2.638 N/A LEU 82.A N LEU 78.A O no hydrogen 3.123 N/A ARG 83.A N ALA 79.A O no hydrogen 3.007 N/A ARG 83.A NH1 ASP 80.A OD1 no hydrogen 3.360 N/A ARG 83.A NH2 ASP 95.A OD2 no hydrogen 2.892 N/A ARG 84.A N ASP 80.A O no hydrogen 3.057 N/A TRP 85.A N SER 81.A O no hydrogen 3.390 N/A LYS 86.A N ARG 83.A O no hydrogen 2.922 N/A ILE 87.A N LEU 82.A O no hydrogen 2.975 N/A VAL 90.A N ASP 142.A OD2 no hydrogen 2.810 N/A LYS 92.A N LYS 88.A O no hydrogen 3.128 N/A VAL 93.A N ALA 89.A O no hydrogen 3.156 N/A LEU 94.A N VAL 90.A O no hydrogen 2.883 N/A ASP 95.A N PRO 91.A O no hydrogen 2.977 N/A LYS 96.A N LYS 92.A O no hydrogen 3.226 N/A ALA 97.A N VAL 93.A O no hydrogen 2.854 N/A LYS 98.A N LEU 94.A O no hydrogen 2.823 N/A LYS 98.A NZ PHE 74.A O no hydrogen 3.275 N/A ALA 99.A N ASP 95.A O no hydrogen 3.323 N/A LEU 100.A N LYS 96.A O no hydrogen 3.335 N/A TYR 101.A N ALA 97.A O no hydrogen 2.884 N/A TYR 101.A OH GLU 71.A OE2 no hydrogen 2.659 N/A GLU 102.A N LYS 98.A O no hydrogen 2.902 N/A GLN 103.A N ALA 99.A O no hydrogen 3.185 N/A HIS 104.A N LEU 100.A O no hydrogen 2.837 N/A GLY 105.A N TYR 101.A O no hydrogen 2.780 N/A ILE 108.A N HIS 104.A O no hydrogen 2.981 N/A GLU 109.A N GLY 105.A O no hydrogen 2.918 N/A THR 110.A N LYS 106.A O no hydrogen 3.020 N/A THR 110.A OG1 LYS 106.A O no hydrogen 2.723 N/A LEU 111.A N THR 107.A O no hydrogen 2.913 N/A ALA 112.A N ILE 108.A O no hydrogen 2.887 N/A ASP 113.A N GLU 109.A O no hydrogen 2.858 N/A GLY 114.A N THR 110.A O no hydrogen 3.092 N/A GLY 115.A N ALA 112.A O no hydrogen 2.997 N/A ALA 116.A N LEU 111.A O no hydrogen 3.029 N/A SER 120.A N ASP 117.A OD1 no hydrogen 2.884 N/A LEU 121.A N ASP 117.A O no hydrogen 2.969 N/A ARG 122.A N ILE 118.A O no hydrogen 2.860 N/A ARG 122.A NE ASP 132.A OD2 no hydrogen 3.355 N/A ARG 122.A NH2 ASP 132.A OD2 no hydrogen 2.903 N/A ARG 122.A NH2 TYR 136.A OH no hydrogen 3.090 N/A LYS 123.A N PRO 119.A O no hydrogen 3.253 N/A GLN 124.A N SER 120.A O no hydrogen 2.976 N/A PHE 125.A N LEU 121.A O no hydrogen 2.999 N/A GLU 127.A N GLU 127.A OE1 no hydrogen 2.757 N/A PHE 128.A N PHE 125.A O no hydrogen 3.213 N/A GLU 129.A N PRO 126.A O no hydrogen 2.933 N/A TRP 131.A N PHE 128.A O no hydrogen 2.945 N/A ASP 132.A N PHE 128.A O no hydrogen 2.831 N/A GLY 133.A N GLU 129.A O no hydrogen 3.014 N/A ALA 134.A N GLU 130.A O no hydrogen 2.935 N/A TYR 135.A N TRP 131.A O no hydrogen 2.822 N/A TYR 135.A OH ASP 53.A OD1 no hydrogen 2.697 N/A TYR 136.A N ASP 132.A O no hydrogen 2.958 N/A TYR 136.A OH VAL 56.A O no hydrogen 2.691 N/A GLU 137.A N GLY 133.A O no hydrogen 3.103 N/A ALA 138.A N ALA 134.A O no hydrogen 2.891 N/A ALA 139.A N TYR 135.A O no hydrogen 2.807 N/A GLU 140.A N TYR 136.A O no hydrogen 3.125 N/A GLN 141.A N ALA 138.A O no hydrogen 3.250 N/A ASP 142.A N ALA 138.A O no hydrogen 2.864 N/A LEU 143.A N ALA 139.A O no hydrogen 2.876 N/A LEU 145.A N GLN 141.A O no hydrogen 3.097 N/A LEU 146.A N ASP 142.A O no hydrogen 2.836 N/A ALA 147.A N LEU 143.A O no hydrogen 2.916 N/A GLU 148.A N PRO 144.A O no hydrogen 2.958 N/A HIS 149.A N LEU 145.A O no hydrogen 3.014 N/A ILE 150.A N LEU 146.A O no hydrogen 2.912 N/A GLN 151.A N ALA 147.A O no hydrogen 2.774 N/A GLN 151.A NE2 ARG 9.A O no hydrogen 3.006 N/A SER 152.A N GLU 148.A O no hydrogen 2.955 N/A SER 152.A OG GLU 148.A O no hydrogen 3.079 N/A ASN 153.A N ILE 150.A O no hydrogen 2.974 N/A ASN 153.A ND2 HIS 149.A O no hydrogen 2.873 N/A PHE 157.A N TRP 154.A O no hydrogen 3.029 N/A ALA 158.A N TRP 154.A O no hydrogen 2.884 N/A GLN 162.A NE2 ILE 160.A O no hydrogen 2.905 N/A