Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ual_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG MET 3.A O no hydrogen 3.452 N/A HIS 2.A N LEU 32.A O no hydrogen 3.179 N/A MET 3.A N LEU 32.A O no hydrogen 3.426 N/A TRP 4.A N GLN 108.A O no hydrogen 2.940 N/A ILE 5.A N LYS 34.A O no hydrogen 2.744 N/A GLY 6.A N LEU 110.A O no hydrogen 2.695 N/A VAL 7.A N GLU 36.A O no hydrogen 2.739 N/A ILE 8.A N LEU 112.A O no hydrogen 2.869 N/A SER 9.A N TRP 38.A O no hydrogen 3.026 N/A SER 9.A OG GLU 144.A OE1 no hydrogen 2.614 N/A PHE 11.A N SER 9.A OG no hydrogen 2.886 N/A MET 14.A N PHE 11.A O no hydrogen 2.942 N/A PHE 15.A N PRO 12.A O no hydrogen 3.014 N/A LYS 16.A N GLU 13.A O no hydrogen 3.184 N/A ALA 17.A N MET 14.A O no hydrogen 3.091 N/A ILE 18.A N PHE 15.A O no hydrogen 3.008 N/A THR 19.A N PHE 15.A O no hydrogen 2.993 N/A THR 19.A OG1 PHE 15.A O no hydrogen 3.296 N/A GLU 20.A N LYS 16.A O no hydrogen 2.916 N/A THR 24.A OG1 ILE 18.A O no hydrogen 2.676 N/A THR 24.A OG1 PHE 21.A O no hydrogen 3.310 N/A GLY 25.A N PHE 21.A O no hydrogen 2.982 N/A ARG 26.A N GLY 22.A O no hydrogen 2.960 N/A ALA 27.A N VAL 23.A O no hydrogen 2.949 N/A VAL 28.A N THR 24.A O no hydrogen 3.038 N/A LYS 29.A N GLY 25.A O no hydrogen 3.013 N/A HIS 30.A N ARG 26.A O no hydrogen 2.876 N/A ASN 31.A N VAL 28.A O no hydrogen 2.998 N/A LEU 32.A N ALA 27.A O no hydrogen 2.815 N/A LEU 33.A N ALA 27.A O no hydrogen 3.258 N/A LYS 34.A N MET 3.A O no hydrogen 3.028 N/A LYS 34.A NZ VAL 35.A O no hydrogen 3.549 N/A GLU 36.A N ILE 5.A O no hydrogen 2.975 N/A TRP 38.A N VAL 7.A O no hydrogen 2.826 N/A ASN 39.A ND2 LEU 10.A O no hydrogen 3.388 N/A ARG 41.A N ASN 39.A OD1 no hydrogen 2.832 N/A ASP 42.A N ASN 39.A O no hydrogen 2.817 N/A PHE 43.A N PRO 40.A O no hydrogen 2.825 N/A THR 44.A N ARG 41.A O no hydrogen 3.319 N/A THR 44.A OG1 ARG 41.A O no hydrogen 2.789 N/A LYS 49.A N ASP 46.A O no hydrogen 3.024 N/A THR 50.A N ASP 46.A OD1 no hydrogen 2.926 N/A THR 50.A N ASP 46.A OD2 no hydrogen 3.342 N/A THR 50.A OG1 ASP 46.A OD2 no hydrogen 2.653 N/A ASP 53.A N LEU 63.A O no hydrogen 2.833 N/A ARG 54.A N ASP 53.A OD1 no hydrogen 2.767 N/A GLY 58.A N PRO 55.A O no hydrogen 3.339 N/A LEU 63.A N ASP 53.A O no hydrogen 2.956 N/A MET 64.A N GLY 119.A O no hydrogen 3.021 N/A MET 65.A N VAL 51.A O no hydrogen 2.806 N/A ARG 70.A N VAL 66.A O no hydrogen 2.722 N/A ASP 71.A N GLN 67.A O no hydrogen 2.925 N/A ALA 72.A N PRO 68.A O no hydrogen 3.050 N/A ILE 73.A N LEU 69.A O no hydrogen 2.954 N/A HIS 74.A N ARG 70.A O no hydrogen 2.954 N/A THR 75.A N ASP 71.A O no hydrogen 3.085 N/A THR 75.A OG1 ASP 71.A O no hydrogen 3.048 N/A ALA 76.A N ALA 72.A O no hydrogen 3.080 N/A LYS 77.A N ILE 73.A O no hydrogen 2.947 N/A ALA 78.A N HIS 74.A O no hydrogen 3.008 N/A ALA 79.A N THR 75.A O no hydrogen 3.046 N/A ALA 80.A N ALA 76.A O no hydrogen 2.859 N/A GLY 81.A N LYS 77.A O no hydrogen 2.893 N/A LYS 85.A N LYS 109.A O no hydrogen 3.467 N/A LYS 85.A NZ GLU 131.A OE2 no hydrogen 2.818 N/A VAL 86.A N ASP 130.A OD2 no hydrogen 2.757 N/A ILE 87.A N ILE 111.A O no hydrogen 2.792 N/A TYR 88.A N GLU 131.A O no hydrogen 2.952 N/A LEU 89.A N VAL 113.A O no hydrogen 3.306 N/A SER 90.A N TRP 133.A O no hydrogen 2.892 N/A GLN 92.A N SER 90.A OG no hydrogen 3.097 N/A GLN 92.A NE2 SER 90.A OG no hydrogen 2.641 N/A GLY 93.A N SER 90.A O no hydrogen 2.924 N/A ARG 94.A N GLU 132.A O no hydrogen 2.881 N/A ARG 94.A NH1 GLU 103.A OE1 no hydrogen 3.129 N/A ARG 94.A NH2 GLU 103.A OE1 no hydrogen 3.143 N/A ARG 94.A NH2 GLU 103.A OE2 no hydrogen 3.122 N/A LYS 95.A NZ ASP 137.A OD2 no hydrogen 2.734 N/A LEU 96.A N SER 134.A O no hydrogen 2.742 N/A GLY 100.A N ASP 97.A OD2 no hydrogen 2.731 N/A VAL 101.A N ASP 97.A O no hydrogen 2.857 N/A THR 102.A N GLN 98.A O no hydrogen 3.049 N/A THR 102.A OG1 GLN 98.A O no hydrogen 3.528 N/A THR 102.A OG1 GLY 99.A O no hydrogen 2.682 N/A GLU 103.A N GLY 99.A O no hydrogen 3.162 N/A LEU 104.A N GLY 100.A O no hydrogen 2.930 N/A ALA 105.A N VAL 101.A O no hydrogen 2.880 N/A GLN 106.A N GLU 103.A O no hydrogen 3.147 N/A ASN 107.A N LEU 104.A O no hydrogen 3.095 N/A ASN 107.A ND2 LEU 104.A O no hydrogen 2.909 N/A LYS 109.A NZ ALA 80.A O no hydrogen 2.699 N/A LEU 110.A N TRP 4.A O no hydrogen 3.061 N/A ILE 111.A N LYS 85.A O no hydrogen 2.968 N/A LEU 112.A N GLY 6.A O no hydrogen 2.672 N/A VAL 113.A N ILE 87.A O no hydrogen 2.764 N/A CYS 114.A N ILE 8.A O no hydrogen 2.924 N/A ARG 116.A NE GLU 144.A OE2 no hydrogen 2.893 N/A ARG 116.A NH2 GLU 144.A OE2 no hydrogen 2.895 N/A GLU 118.A N MET 62.A O no hydrogen 2.937 N/A GLY 119.A N ARG 116.A O no hydrogen 3.121 N/A ARG 123.A N ASP 121.A OD2 no hydrogen 2.825 N/A ARG 123.A NE ASP 121.A OD2 no hydrogen 2.876 N/A ARG 123.A NH1 ASP 121.A OD1 no hydrogen 2.863 N/A LEU 124.A N ASP 121.A O no hydrogen 2.979 N/A GLN 126.A N GLU 122.A O no hydrogen 3.248 N/A THR 127.A N ARG 123.A O no hydrogen 2.955 N/A THR 127.A OG1 ARG 123.A O no hydrogen 3.030 N/A GLU 128.A N LEU 124.A O no hydrogen 2.757 N/A ILE 129.A N ILE 125.A O no hydrogen 3.258 N/A ASP 130.A N VAL 86.A O no hydrogen 2.843 N/A GLU 131.A N VAL 86.A O no hydrogen 3.161 N/A TRP 133.A N TYR 88.A O no hydrogen 3.053 N/A TRP 133.A NE1 GLU 131.A OE1 no hydrogen 2.795 N/A SER 134.A N ARG 94.A O no hydrogen 2.878 N/A GLY 136.A N SER 134.A OG no hydrogen 3.104 N/A TYR 138.A N GLY 136.A O no hydrogen 2.903 N/A GLY 143.A N GLY 115.A O no hydrogen 2.928 N/A GLU 144.A N GLU 144.A OE2 no hydrogen 2.794 N/A ALA 147.A N GLY 143.A O no hydrogen 2.853 N/A MET 148.A N GLU 144.A O no hydrogen 2.867 N/A THR 149.A N LEU 145.A O no hydrogen 2.851 N/A THR 149.A OG1 LEU 145.A O no hydrogen 2.831 N/A LEU 150.A N PRO 146.A O no hydrogen 2.985 N/A ILE 151.A N ALA 147.A O no hydrogen 2.908 N/A ASP 152.A N MET 148.A O no hydrogen 2.861 N/A ALA 153.A N THR 149.A O no hydrogen 2.984 N/A VAL 154.A N LEU 150.A O no hydrogen 3.017 N/A ALA 155.A N ILE 151.A O no hydrogen 2.870 N/A PHE 157.A N VAL 154.A O no hydrogen 2.930 N/A ILE 158.A N ALA 155.A O no hydrogen 2.989 N/A VAL 161.A N ILE 158.A O no hydrogen 3.029 N/A PHE 164.A N LEU 168.A O no hydrogen 2.802 N/A LEU 169.A N THR 209.A OG1 no hydrogen 2.853 N/A ASP 170.A N SER 163.A OG no hydrogen 2.889 N/A CYS 171.A N ASP 170.A OD1 no hydrogen 2.723 N/A CYS 171.A SG ASP 170.A OD1 no hydrogen 3.666 N/A CYS 171.A SG PRO 172.A O no hydrogen 3.689 N/A ARG 176.A N THR 175.A OG1 no hydrogen 2.793 N/A LEU 180.A N LEU 183.A O no hydrogen 2.743 N/A LEU 183.A N LEU 180.A O no hydrogen 2.868 N/A VAL 185.A N GLU 178.A O no hydrogen 3.174 N/A LEU 189.A N PRO 186.A O no hydrogen 2.960 N/A MET 190.A N PRO 187.A O no hydrogen 3.038 N/A SER 191.A N VAL 188.A O no hydrogen 3.194 N/A SER 191.A OG VAL 188.A O no hydrogen 2.742 N/A HIS 193.A N SER 191.A OG no hydrogen 3.088 N/A ILE 197.A N HIS 193.A O no hydrogen 2.897 N/A ARG 198.A N HIS 194.A O no hydrogen 2.972 N/A ARG 198.A NE GLU 195.A OE1 no hydrogen 3.441 N/A ARG 198.A NE GLU 195.A OE2 no hydrogen 3.366 N/A ARG 198.A NH1 GLU 225.A OE1 no hydrogen 3.428 N/A ARG 198.A NH1 GLU 225.A OE2 no hydrogen 3.075 N/A ARG 198.A NH2 GLU 195.A OE2 no hydrogen 2.630 N/A ARG 198.A NH2 GLU 225.A OE1 no hydrogen 2.677 N/A LYS 199.A N GLU 195.A O no hydrogen 3.117 N/A TRP 200.A N GLU 196.A O no hydrogen 2.914 N/A ARG 201.A N ILE 197.A O no hydrogen 2.997 N/A LEU 202.A N ARG 198.A O no hydrogen 3.100 N/A LYS 203.A N LYS 199.A O no hydrogen 2.858 N/A LYS 203.A NZ GLU 232.A OE2 no hydrogen 3.372 N/A LYS 203.A NZ GLU 236.A OE1 no hydrogen 2.423 N/A GLN 204.A N TRP 200.A O no hydrogen 2.839 N/A SER 205.A N ARG 201.A O no hydrogen 2.991 N/A SER 205.A OG LEU 169.A O no hydrogen 2.475 N/A LEU 206.A N LEU 202.A O no hydrogen 3.003 N/A GLN 207.A N LYS 203.A O no hydrogen 2.837 N/A ARG 208.A N GLN 204.A O no hydrogen 2.835 N/A ARG 208.A NE ASP 170.A O no hydrogen 2.900 N/A THR 209.A N SER 205.A O no hydrogen 2.969 N/A THR 209.A OG1 SER 205.A O no hydrogen 2.760 N/A TRP 210.A N LEU 206.A O no hydrogen 2.946 N/A LEU 211.A N GLN 207.A O no hydrogen 2.956 N/A ARG 212.A N ARG 208.A O no hydrogen 2.873 N/A ARG 213.A N THR 209.A O no hydrogen 2.777 N/A ARG 213.A NE GLU 215.A OE1 no hydrogen 3.107 N/A LEU 216.A N ARG 213.A O no hydrogen 2.988 N/A LEU 217.A N PRO 214.A O no hydrogen 3.202 N/A GLN 226.A N THR 223.A OG1 no hydrogen 3.148 N/A ARG 227.A N THR 223.A O no hydrogen 2.886 N/A ARG 227.A NH1 ASP 224.A OD2 no hydrogen 3.054 N/A LYS 228.A N ASP 224.A O no hydrogen 3.002 N/A LYS 228.A NZ GLU 225.A O no hydrogen 3.527 N/A LEU 229.A N GLU 225.A O no hydrogen 2.948 N/A LEU 230.A N GLN 226.A O no hydrogen 2.972 N/A LYS 231.A N ARG 227.A O no hydrogen 3.059 N/A GLU 232.A N LYS 228.A O no hydrogen 2.926 N/A ALA 233.A N LEU 229.A O no hydrogen 2.924 N/A GLN 234.A N LEU 230.A O no hydrogen 2.894 N/A ALA 235.A N LYS 231.A O no hydrogen 2.927 N/A GLU 236.A N GLU 232.A O no hydrogen 2.896 N/A HIS 237.A N ALA 233.A O no hydrogen 2.880 N/A ASN 238.A N GLN 234.A O no hydrogen 2.852 N/A SER 239.A N GLU 236.A O no hydrogen 3.266 N/A SER 239.A OG GLU 236.A O no hydrogen 2.750 N/A LEU 240.A N HIS 237.A O no hydrogen 3.284 N/A HIS 242.A NE2 HIS 237.A O no hydrogen 2.543 N/A