Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3hxo_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 3.A N ARG 37.A O no hydrogen 2.902 N/A ARG 5.A NH1 ALA 192.A O no hydrogen 3.114 N/A LEU 6.A N PRO 193.A O no hydrogen 3.063 N/A LEU 7.A N TRP 44.A O no hydrogen 2.960 N/A ASP 8.A N SER 109.A O no hydrogen 2.744 N/A LEU 9.A N ARG 46.A O no hydrogen 2.788 N/A VAL 10.A N ILE 111.A O no hydrogen 2.889 N/A PHE 11.A N ALA 48.A O no hydrogen 2.645 N/A LEU 12.A N LEU 113.A O no hydrogen 3.021 N/A LEU 13.A N VAL 50.A O no hydrogen 2.810 N/A ASP 14.A N LEU 115.A O no hydrogen 2.948 N/A GLY 15.A N TYR 52.A O no hydrogen 2.852 N/A SER 16.A N ASP 14.A OD2 no hydrogen 2.995 N/A SER 16.A OG ASP 14.A OD1 no hydrogen 3.483 N/A SER 16.A OG ASP 14.A OD2 no hydrogen 2.573 N/A SER 17.A OG SER 83.A O no hydrogen 3.382 N/A ARG 18.A N SER 16.A OG no hydrogen 3.343 N/A SER 20.A N GLU 23.A OE1 no hydrogen 2.842 N/A SER 20.A OG GLU 23.A OE1 no hydrogen 2.871 N/A GLU 23.A N SER 20.A OG no hydrogen 3.156 N/A PHE 24.A N SER 20.A O no hydrogen 3.060 N/A GLU 25.A N GLU 21.A O no hydrogen 3.390 N/A VAL 26.A N ALA 22.A O no hydrogen 3.079 N/A LEU 27.A N GLU 23.A O no hydrogen 3.298 N/A LYS 28.A N PHE 24.A O no hydrogen 2.982 N/A LYS 28.A NZ GLU 25.A OE1 no hydrogen 3.158 N/A LYS 28.A NZ GLU 25.A OE2 no hydrogen 2.988 N/A LYS 28.A NZ SER 76.A O no hydrogen 2.622 N/A LYS 28.A NZ VAL 78.A O no hydrogen 3.030 N/A ALA 29.A N GLU 25.A O no hydrogen 2.889 N/A PHE 30.A N VAL 26.A O no hydrogen 2.849 N/A VAL 31.A N LEU 27.A O no hydrogen 3.065 N/A VAL 32.A N LYS 28.A O no hydrogen 2.927 N/A ASP 33.A N ALA 29.A O no hydrogen 2.825 N/A MET 34.A N PHE 30.A O no hydrogen 2.927 N/A MET 35.A N VAL 31.A O no hydrogen 3.098 N/A GLU 36.A N VAL 32.A O no hydrogen 3.004 N/A ARG 37.A N ASP 33.A O no hydrogen 3.171 N/A ARG 37.A N MET 34.A O no hydrogen 2.999 N/A ARG 37.A NE ASP 182.A OD1 no hydrogen 3.389 N/A ARG 37.A NH1 ASP 33.A O no hydrogen 3.080 N/A LEU 38.A N MET 35.A O no hydrogen 3.246 N/A ARG 39.A N CYS 3.A O no hydrogen 2.906 N/A ARG 39.A NH1 SER 4.A OG no hydrogen 2.770 N/A SER 41.A N VAL 45.A O no hydrogen 2.927 N/A GLN 42.A NE2 LEU 62.A O no hydrogen 2.855 N/A LYS 43.A N SER 41.A OG no hydrogen 3.275 N/A TRP 44.A N SER 41.A O no hydrogen 3.074 N/A VAL 45.A N ARG 39.A O no hydrogen 3.029 N/A ARG 46.A N LEU 7.A O no hydrogen 2.774 N/A ARG 46.A NE ASP 8.A OD1 no hydrogen 2.738 N/A ARG 46.A NH1 GLN 42.A OE1 no hydrogen 3.148 N/A ARG 46.A NH2 ASP 8.A OD1 no hydrogen 3.467 N/A ARG 46.A NH2 ASP 8.A OD2 no hydrogen 3.128 N/A ARG 46.A NH2 ASP 104.A OD1 no hydrogen 3.385 N/A ALA 48.A N LEU 9.A O no hydrogen 3.002 N/A VAL 49.A N ILE 60.A O no hydrogen 3.044 N/A VAL 50.A N PHE 11.A O no hydrogen 2.890 N/A GLU 51.A N HIS 57.A O no hydrogen 3.117 N/A TYR 52.A N LEU 13.A O no hydrogen 2.950 N/A HIS 53.A N GLY 55.A O no hydrogen 2.876 N/A HIS 53.A ND1 GLU 51.A OE2 no hydrogen 2.804 N/A HIS 57.A N GLU 51.A O no hydrogen 2.833 N/A TYR 59.A N VAL 49.A O no hydrogen 2.883 N/A ILE 60.A N VAL 49.A O no hydrogen 3.262 N/A GLY 61.A N ASP 64.A OD2 no hydrogen 3.153 N/A LYS 63.A NZ ASP 104.A OD2 no hydrogen 3.122 N/A ASP 64.A N GLY 61.A O no hydrogen 3.331 N/A LYS 66.A N ASP 64.A O no hydrogen 3.040 N/A LEU 71.A N ARG 67.A O no hydrogen 3.045 N/A ARG 72.A N PRO 68.A O no hydrogen 2.859 N/A ARG 73.A N SER 69.A O no hydrogen 3.032 N/A ARG 73.A NE GLN 77.A OE1 no hydrogen 3.198 N/A ILE 74.A N GLU 70.A O no hydrogen 2.955 N/A ALA 75.A N LEU 71.A O no hydrogen 2.812 N/A SER 76.A N ARG 72.A O no hydrogen 2.952 N/A SER 76.A N ARG 73.A O no hydrogen 2.989 N/A SER 76.A OG ARG 72.A O no hydrogen 3.162 N/A SER 76.A OG ARG 73.A O no hydrogen 2.583 N/A GLN 77.A N ILE 74.A O no hydrogen 3.156 N/A LYS 79.A N TYR 59.A OH no hydrogen 3.155 N/A TYR 80.A OH LEU 19.A O no hydrogen 2.580 N/A SER 83.A N GLY 15.A O no hydrogen 3.036 N/A SER 83.A OG ASP 54.A OD1 no hydrogen 3.089 N/A SER 83.A OG VAL 85.A O no hydrogen 2.969 N/A VAL 85.A N SER 83.A OG no hydrogen 2.950 N/A SER 87.A N HIS 53.A O no hydrogen 2.784 N/A SER 87.A OG GLU 120.A OE1 no hydrogen 2.835 N/A THR 88.A OG1 GLN 155.A OE1 no hydrogen 2.821 N/A SER 89.A N GLU 120.A OE1 no hydrogen 3.171 N/A SER 89.A OG GLU 120.A OE1 no hydrogen 3.490 N/A SER 89.A OG GLU 120.A OE2 no hydrogen 2.557 N/A SER 89.A OG MET 124.A O no hydrogen 3.273 N/A GLU 90.A N SER 87.A OG no hydrogen 2.989 N/A VAL 91.A N SER 87.A O no hydrogen 3.114 N/A LEU 92.A N THR 88.A O no hydrogen 2.930 N/A LYS 93.A N SER 89.A O no hydrogen 2.970 N/A TYR 94.A N GLU 90.A O no hydrogen 2.729 N/A THR 95.A N VAL 91.A O no hydrogen 2.919 N/A THR 95.A OG1 VAL 91.A O no hydrogen 2.730 N/A LEU 96.A N LEU 92.A O no hydrogen 2.969 N/A PHE 97.A N LYS 93.A O no hydrogen 2.945 N/A GLN 98.A N TYR 94.A O no hydrogen 2.656 N/A ILE 99.A N TYR 94.A O no hydrogen 3.434 N/A PHE 100.A N THR 95.A O no hydrogen 2.873 N/A SER 101.A OG GLN 98.A O no hydrogen 3.528 N/A ARG 105.A NH1 LEU 7.A O no hydrogen 3.205 N/A ARG 105.A NH1 ASP 8.A OD1 no hydrogen 3.015 N/A ARG 105.A NH1 TRP 44.A O no hydrogen 2.800 N/A ARG 105.A NH2 TRP 44.A O no hydrogen 2.565 N/A GLU 107.A N GLU 107.A OE1 no hydrogen 2.792 N/A ALA 108.A N ARG 105.A O no hydrogen 3.296 N/A SER 109.A N LEU 6.A O no hydrogen 3.233 N/A SER 109.A OG LEU 191.A O no hydrogen 2.875 N/A ARG 110.A NH1 LYS 139.A O no hydrogen 3.200 N/A ILE 111.A N ASP 8.A O no hydrogen 2.928 N/A ALA 112.A N ILE 141.A O no hydrogen 2.644 N/A LEU 113.A N VAL 10.A O no hydrogen 2.817 N/A LEU 114.A N ILE 143.A O no hydrogen 2.953 N/A LEU 115.A N LEU 12.A O no hydrogen 2.836 N/A MET 116.A N VAL 145.A O no hydrogen 3.271 N/A SER 118.A OG ASP 14.A OD1 no hydrogen 2.775 N/A MET 124.A N PRO 121.A O no hydrogen 3.013 N/A SER 125.A N GLN 122.A O no hydrogen 2.984 N/A SER 125.A OG GLU 120.A OE2 no hydrogen 2.778 N/A SER 125.A OG PRO 121.A O no hydrogen 3.292 N/A SER 125.A OG GLN 122.A O no hydrogen 3.408 N/A PHE 128.A N SER 125.A O no hydrogen 3.169 N/A ARG 130.A N ASN 127.A O no hydrogen 3.086 N/A TYR 131.A N ASN 127.A O no hydrogen 3.310 N/A TYR 131.A N PHE 128.A O no hydrogen 2.962 N/A VAL 132.A N PHE 128.A O no hydrogen 3.234 N/A GLN 133.A N VAL 129.A O no hydrogen 2.896 N/A GLY 134.A N ARG 130.A O no hydrogen 2.886 N/A LEU 135.A N TYR 131.A O no hydrogen 2.704 N/A LYS 136.A N VAL 132.A O no hydrogen 3.052 N/A LYS 136.A NZ GLN 162.A O no hydrogen 2.856 N/A LYS 137.A N GLN 133.A O no hydrogen 3.176 N/A LYS 138.A N LEU 135.A O no hydrogen 2.977 N/A LYS 138.A NZ SER 101.A O no hydrogen 3.416 N/A LYS 139.A N LYS 136.A O no hydrogen 2.794 N/A VAL 140.A N LEU 135.A O no hydrogen 2.932 N/A ILE 141.A N ARG 110.A O no hydrogen 2.710 N/A VAL 142.A N ASN 166.A OD1 no hydrogen 2.988 N/A ILE 143.A N ALA 112.A O no hydrogen 2.861 N/A VAL 145.A N LEU 114.A O no hydrogen 2.825 N/A ILE 147.A N MET 116.A O no hydrogen 2.932 N/A ASN 152.A N SER 118.A O no hydrogen 3.191 N/A GLN 155.A N ASN 152.A OD1 no hydrogen 2.896 N/A GLN 155.A NE2 GLU 120.A OE2 no hydrogen 3.017 N/A ILE 156.A N ASN 152.A O no hydrogen 3.146 N/A ARG 157.A N LEU 153.A O no hydrogen 2.854 N/A ARG 157.A NH1 GLU 160.A OE1 no hydrogen 2.966 N/A LEU 158.A N LYS 154.A O no hydrogen 2.930 N/A ILE 159.A N GLN 155.A O no hydrogen 2.755 N/A ILE 159.A N ILE 156.A O no hydrogen 3.178 N/A GLU 160.A N ILE 156.A O no hydrogen 3.199 N/A LYS 161.A N ARG 157.A O no hydrogen 2.994 N/A GLN 162.A N ILE 159.A O no hydrogen 3.062 N/A GLN 162.A NE2 LEU 158.A O no hydrogen 3.462 N/A GLU 165.A N GLU 165.A OE1 no hydrogen 2.701 N/A ASN 166.A N ALA 163.A O no hydrogen 3.221 N/A ASN 166.A ND2 ILE 159.A O no hydrogen 3.149 N/A LYS 167.A NZ ALA 168.A O no hydrogen 3.204 N/A ALA 168.A N GLU 160.A OE2 no hydrogen 2.921 N/A PHE 169.A N PRO 144.A O no hydrogen 2.867 N/A LEU 171.A N GLY 146.A O no hydrogen 2.661 N/A ASP 175.A N SER 173.A OG no hydrogen 3.107 N/A GLU 176.A N SER 173.A O no hydrogen 3.008 N/A LEU 177.A N VAL 174.A O no hydrogen 3.394 N/A GLN 179.A NE2 GLU 176.A OE1 no hydrogen 2.682 N/A GLN 180.A N LEU 177.A O no hydrogen 2.715 N/A ARG 181.A N GLU 178.A O no hydrogen 3.437 N/A ARG 181.A NE ASP 182.A OD1 no hydrogen 3.337 N/A ILE 184.A N GLN 180.A O no hydrogen 3.034 N/A VAL 185.A N ARG 181.A O no hydrogen 2.877 N/A SER 186.A N ASP 182.A O no hydrogen 3.234 N/A SER 186.A OG ASP 182.A O no hydrogen 2.871 N/A SER 186.A OG GLU 183.A O no hydrogen 2.815 N/A TYR 187.A N GLU 183.A O no hydrogen 3.138 N/A TYR 187.A OH GLU 165.A O no hydrogen 3.406 N/A LEU 188.A N ILE 184.A O no hydrogen 2.937 N/A CYS 189.A N VAL 185.A O no hydrogen 2.829 N/A ASP 190.A N SER 186.A O no hydrogen 2.996 N/A LEU 191.A N LEU 188.A O no hydrogen 2.966 N/A ALA 192.A N CYS 189.A O no hydrogen 2.962 N/A THR 199.A OG1 PRO 197.A O no hydrogen 2.960 N/A