Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3g08_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 2.A N MET 97.A O no hydrogen 3.194 N/A PHE 4.A N CYS 95.A O no hydrogen 2.864 N/A ARG 5.A N TRP 25.A O no hydrogen 2.914 N/A CYS 6.A N ALA 93.A O no hydrogen 2.660 N/A LEU 7.A N VAL 23.A O no hydrogen 2.817 N/A GLN 8.A N LEU 91.A O no hydrogen 2.899 N/A GLN 8.A NE2 SER 10.A OG no hydrogen 2.995 N/A MET 9.A N ASP 21.A O no hydrogen 2.809 N/A SER 10.A N ILE 89.A O no hydrogen 2.807 N/A SER 10.A OG THR 20.A OG1 no hydrogen 2.896 N/A SER 11.A N ARG 19.A O no hydrogen 2.823 N/A SER 11.A OG GLU 88.A OE1 no hydrogen 2.641 N/A SER 11.A OG GLU 88.A OE2 no hydrogen 3.519 N/A PHE 12.A N ILE 87.A O no hydrogen 2.819 N/A ALA 13.A N TRP 17.A O no hydrogen 2.896 N/A ASN 14.A N TRP 17.A O no hydrogen 3.502 N/A SER 16.A N ASN 14.A OD1 no hydrogen 3.043 N/A SER 16.A OG ASN 14.A OD1 no hydrogen 3.558 N/A ARG 19.A N SER 11.A O no hydrogen 2.873 N/A ARG 19.A NE ASP 21.A OD1 no hydrogen 2.661 N/A ARG 19.A NH2 ASP 21.A OD1 no hydrogen 3.407 N/A ARG 19.A NH2 ASP 21.A OD2 no hydrogen 2.908 N/A THR 20.A N ASN 36.A OD1 no hydrogen 2.936 N/A THR 20.A OG1 SER 10.A OG no hydrogen 2.896 N/A ASP 21.A N MET 9.A O no hydrogen 2.938 N/A SER 22.A N TRP 34.A O no hydrogen 2.992 N/A VAL 23.A N LEU 7.A O no hydrogen 2.904 N/A VAL 24.A N HIS 32.A O no hydrogen 3.005 N/A TRP 25.A N ARG 5.A O no hydrogen 2.931 N/A LEU 26.A N LEU 29.A O no hydrogen 2.863 N/A GLY 27.A N THR 3.A O no hydrogen 2.866 N/A LEU 29.A N LEU 26.A O no hydrogen 3.125 N/A GLN 30.A NE2 HIS 32.A O no hydrogen 3.118 N/A THR 31.A N VAL 24.A O no hydrogen 2.803 N/A THR 31.A OG1 VAL 24.A O no hydrogen 3.370 N/A THR 31.A OG1 HIS 32.A ND1 no hydrogen 2.857 N/A HIS 32.A N VAL 24.A O no hydrogen 3.429 N/A HIS 32.A ND1 THR 31.A OG1 no hydrogen 2.857 N/A HIS 32.A NE2 SER 48.A O no hydrogen 2.830 N/A ARG 33.A N SER 42.A O no hydrogen 2.992 N/A TRP 34.A N SER 22.A O no hydrogen 2.792 N/A TRP 34.A NE1 SER 38.A O no hydrogen 2.996 N/A SER 35.A OG ASP 37.A OD2 no hydrogen 3.168 N/A ASN 36.A N ASP 21.A OD2 no hydrogen 2.820 N/A ASP 37.A N SER 35.A OG no hydrogen 3.316 N/A SER 38.A N SER 35.A O no hydrogen 3.052 N/A SER 38.A OG THR 40.A O no hydrogen 2.649 N/A THR 40.A N SER 38.A OG no hydrogen 3.283 N/A ILE 41.A N GLN 61.A OE1 no hydrogen 2.861 N/A SER 42.A N ARG 33.A O no hydrogen 2.773 N/A THR 44.A N THR 31.A O no hydrogen 2.975 N/A THR 44.A OG1 GLN 30.A O no hydrogen 2.801 N/A LYS 45.A N SER 48.A OG no hydrogen 3.024 N/A LYS 45.A NZ GLN 30.A O no hydrogen 2.854 N/A LYS 45.A NZ THR 44.A O no hydrogen 3.170 N/A LYS 45.A NZ GLU 226.A OE1 no hydrogen 2.571 N/A LYS 45.A NZ GLU 226.A OE2 no hydrogen 3.429 N/A TRP 47.A NE1 ASP 170.A OD2 no hydrogen 2.823 N/A SER 48.A N LYS 45.A O no hydrogen 3.274 N/A SER 48.A OG THR 31.A O no hydrogen 2.598 N/A SER 48.A OG LYS 45.A O no hydrogen 3.088 N/A GLN 49.A NE2 LEU 52.A O no hydrogen 2.871 N/A GLN 49.A NE2 ASN 54.A OD1 no hydrogen 2.880 N/A GLY 50.A N TRP 47.A O no hydrogen 2.862 N/A LEU 52.A N GLN 49.A O no hydrogen 3.126 N/A SER 53.A N GLN 56.A OE1 no hydrogen 2.959 N/A SER 53.A OG GLN 56.A OE1 no hydrogen 3.385 N/A GLN 56.A N SER 53.A OG no hydrogen 3.012 N/A TRP 57.A N SER 53.A O no hydrogen 2.920 N/A GLU 58.A N ASN 54.A O no hydrogen 2.849 N/A LYS 59.A N GLN 55.A O no hydrogen 2.986 N/A LEU 60.A N GLN 56.A O no hydrogen 3.041 N/A GLN 61.A N TRP 57.A O no hydrogen 2.796 N/A HIS 62.A N GLU 58.A O no hydrogen 2.832 N/A MET 63.A N LYS 59.A O no hydrogen 3.107 N/A PHE 64.A N LEU 60.A O no hydrogen 3.100 N/A GLN 65.A N GLN 61.A O no hydrogen 2.808 N/A GLN 65.A NE2 ALA 39.A O no hydrogen 2.942 N/A VAL 66.A N HIS 62.A O no hydrogen 2.936 N/A TYR 67.A N MET 63.A O no hydrogen 2.913 N/A TYR 67.A OH GLN 8.A OE1 no hydrogen 2.647 N/A ARG 68.A N PHE 64.A O no hydrogen 2.863 N/A ARG 68.A NH1 SER 35.A O no hydrogen 3.029 N/A ARG 68.A NH1 SER 38.A O no hydrogen 3.248 N/A ARG 68.A NH2 SER 38.A O no hydrogen 3.141 N/A VAL 69.A N GLN 65.A O no hydrogen 3.457 N/A SER 70.A N VAL 66.A O no hydrogen 2.898 N/A SER 70.A OG VAL 66.A O no hydrogen 2.796 N/A PHE 71.A N TYR 67.A O no hydrogen 2.690 N/A THR 72.A N ARG 68.A O no hydrogen 3.227 N/A THR 72.A OG1 ARG 68.A O no hydrogen 2.817 N/A ARG 73.A N VAL 69.A O no hydrogen 3.159 N/A ASP 74.A N SER 70.A O no hydrogen 2.913 N/A ILE 75.A N PHE 71.A O no hydrogen 2.946 N/A GLN 76.A N THR 72.A O no hydrogen 3.027 N/A GLN 76.A NE2 ASN 14.A O no hydrogen 3.233 N/A GLU 77.A N ARG 73.A O no hydrogen 2.951 N/A LEU 78.A N ASP 74.A O no hydrogen 2.927 N/A VAL 79.A N ILE 75.A O no hydrogen 2.905 N/A LYS 80.A N GLN 76.A O no hydrogen 3.123 N/A MET 81.A N GLU 77.A O no hydrogen 3.122 N/A MET 81.A N LEU 78.A O no hydrogen 3.254 N/A MET 82.A N LEU 78.A O no hydrogen 2.934 N/A TYR 85.A OH GLN 76.A OE1 no hydrogen 2.541 N/A ILE 87.A N PHE 12.A O no hydrogen 2.863 N/A GLU 88.A N GLN 109.A OE1 no hydrogen 2.852 N/A ILE 89.A N SER 10.A O no hydrogen 2.885 N/A GLN 90.A N ALA 107.A O no hydrogen 3.015 N/A LEU 91.A N GLN 8.A O no hydrogen 2.970 N/A SER 92.A N HIS 105.A O no hydrogen 2.849 N/A ALA 93.A N CYS 6.A O no hydrogen 3.008 N/A GLY 94.A N PHE 103.A O no hydrogen 2.939 N/A CYS 95.A N PHE 4.A O no hydrogen 3.080 N/A GLU 96.A N GLU 101.A O no hydrogen 2.846 N/A MET 97.A N TYR 2.A O no hydrogen 2.769 N/A TYR 98.A N ALA 99.A O no hydrogen 2.796 N/A SER 100.A OG.B GLU 96.A O no hydrogen 3.353 N/A GLU 101.A N GLU 96.A O no hydrogen 3.118 N/A SER 102.A OG LEU 152.A O no hydrogen 2.588 N/A PHE 103.A N GLY 94.A O no hydrogen 2.885 N/A HIS 105.A N SER 92.A O no hydrogen 2.830 N/A VAL 106.A N VAL 114.A O no hydrogen 2.775 N/A ALA 107.A N GLN 90.A O no hydrogen 2.794 N/A PHE 108.A N LYS 111.A O no hydrogen 2.817 N/A GLN 109.A N GLU 88.A O no hydrogen 2.882 N/A GLN 109.A NE2 PRO 86.A O no hydrogen 3.044 N/A LYS 111.A N PHE 108.A O no hydrogen 3.107 N/A VAL 113.A N VAL 106.A O no hydrogen 2.904 N/A VAL 114.A N VAL 106.A O no hydrogen 3.228 N/A ARG 115.A N GLN 122.A O no hydrogen 2.912 N/A ARG 115.A NE GLN 122.A OE1 no hydrogen 3.121 N/A ARG 115.A NH2 GLN 122.A OE1 no hydrogen 2.942 N/A PHE 116.A N LEU 104.A O no hydrogen 3.044 N/A TRP 117.A N SER 120.A O no hydrogen 2.850 N/A SER 120.A N TRP 117.A O no hydrogen 3.374 N/A TRP 121.A N ASN 139.A OD1 no hydrogen 2.807 N/A GLN 122.A N ARG 115.A O no hydrogen 2.851 N/A THR 123.A OG1 ASP 132.A OD1 no hydrogen 3.503 N/A VAL 124.A N VAL 113.A O no hydrogen 2.942 N/A ALA 127.A N VAL 124.A O no hydrogen 2.955 N/A LEU 131.A N PRO 128.A O no hydrogen 3.191 N/A ASP 132.A N SER 129.A O no hydrogen 3.130 N/A ILE 135.A N LEU 131.A O no hydrogen 2.987 N/A LYS 136.A N ASP 132.A O no hydrogen 2.897 N/A VAL 137.A N LEU 133.A O no hydrogen 2.962 N/A LEU 138.A N PRO 134.A O no hydrogen 2.858 N/A ASN 139.A N ILE 135.A O no hydrogen 2.785 N/A ASN 139.A ND2 TRP 121.A O no hydrogen 2.891 N/A ALA 140.A N LYS 136.A O no hydrogen 3.061 N/A ALA 140.A N VAL 137.A O no hydrogen 3.038 N/A ASP 141.A N LEU 138.A O no hydrogen 3.030 N/A THR 144.A N ASP 141.A OD1 no hydrogen 3.159 N/A THR 144.A OG1 ASP 141.A OD2 no hydrogen 2.674 N/A SER 145.A N ASP 141.A O no hydrogen 3.150 N/A SER 145.A OG THR 119.A O no hydrogen 2.806 N/A ALA 146.A N GLN 142.A O no hydrogen 2.845 N/A THR 147.A N GLY 143.A O no hydrogen 3.073 N/A THR 147.A OG1 GLY 143.A O no hydrogen 2.995 N/A VAL 148.A N THR 144.A O no hydrogen 2.938 N/A GLN 149.A N SER 145.A O no hydrogen 2.969 N/A GLN 149.A NE2 SER 145.A O no hydrogen 3.387 N/A GLN 149.A NE2 SER 145.A OG no hydrogen 3.134 N/A MET 150.A N ALA 146.A O no hydrogen 3.006 N/A LEU 151.A N.A THR 147.A O no hydrogen 2.980 N/A LEU 151.A N.B THR 147.A O no hydrogen 2.969 N/A LEU 152.A N VAL 148.A O no hydrogen 2.883 N/A ASN 153.A N GLN 149.A O no hydrogen 2.818 N/A ASP 154.A N MET 150.A O no hydrogen 2.901 N/A THR 155.A N MET 150.A O no hydrogen 2.986 N/A THR 155.A OG1 MET 150.A O no hydrogen 3.447 N/A CYS 156.A N LEU 151.A O.A no hydrogen 2.819 N/A CYS 156.A N LEU 151.A O.B no hydrogen 2.961 N/A LEU 158.A N ASP 154.A O no hydrogen 3.158 N/A PHE 159.A N THR 155.A O no hydrogen 2.772 N/A VAL 160.A N CYS 156.A O no hydrogen 2.941 N/A ARG 161.A N PRO 157.A O no hydrogen 2.962 N/A GLY 162.A N LEU 158.A O no hydrogen 3.393 N/A LEU 163.A N PHE 159.A O no hydrogen 2.903 N/A LEU 164.A N VAL 160.A O no hydrogen 2.850 N/A GLU 165.A N ARG 161.A O no hydrogen 3.162 N/A ALA 166.A N GLY 162.A O no hydrogen 2.870 N/A GLY 167.A N LEU 163.A O no hydrogen 2.762 N/A LYS 168.A N GLU 165.A O no hydrogen 3.407 N/A LYS 168.A NZ GLU 172.A OE1 no hydrogen 3.140 N/A LYS 168.A NZ GLU 172.A OE2 no hydrogen 3.357 N/A LEU 171.A N GLY 167.A O no hydrogen 2.883 N/A GLU 172.A N LYS 168.A O no hydrogen 2.885 N/A LYS 173.A N ASP 170.A O no hydrogen 3.135 N/A LYS 173.A NZ GLU 226.A O no hydrogen 2.871 N/A GLU 175.A N TYR 197.A O no hydrogen 2.808 N/A VAL 178.A N SER 194.A O no hydrogen 2.942 N/A TRP 180.A N HIS 192.A O no hydrogen 3.003 N/A SER 182.A N VAL 190.A O no hydrogen 2.950 N/A SER 182.A OG HIS 192.A NE2 no hydrogen 2.750 N/A VAL 184.A N GLN 188.A O no hydrogen 2.873 N/A ARG 187.A N VAL 236.A O no hydrogen 2.994 N/A ARG 187.A NE SER 183.A OG no hydrogen 2.933 N/A ARG 187.A NH2 SER 183.A OG no hydrogen 2.665 N/A GLN 188.A N VAL 184.A O no hydrogen 2.663 N/A GLN 188.A NE2 ASP 235.A OD1 no hydrogen 2.811 N/A LEU 189.A N LEU 234.A O no hydrogen 2.778 N/A VAL 190.A N SER 182.A O no hydrogen 2.753 N/A CYS 191.A N ALA 232.A O no hydrogen 2.801 N/A HIS 192.A N TRP 180.A O no hydrogen 2.798 N/A HIS 192.A ND1 TYR 229.A OH no hydrogen 2.684 N/A HIS 192.A NE2 SER 182.A OG no hydrogen 2.750 N/A VAL 193.A N LEU 230.A O no hydrogen 2.822 N/A SER 194.A N VAL 178.A O no hydrogen 2.901 N/A GLY 195.A N TRP 228.A O no hydrogen 2.795 N/A TYR 197.A N GLU 175.A O no hydrogen 3.028 N/A TYR 197.A OH ASP 28.A OD1 no hydrogen 2.528 N/A TRP 202.A N LYS 249.A O no hydrogen 2.979 N/A MET 204.A N ARG 247.A O no hydrogen 2.980 N/A TRP 205.A N THR 215.A OG1 no hydrogen 3.142 N/A TRP 205.A NE1 ALA 232.A O no hydrogen 2.962 N/A MET 206.A N ALA 245.A O no hydrogen 2.734 N/A ARG 207.A N GLN 210.A O no hydrogen 2.939 N/A ARG 207.A NH1 ALA 242.A O no hydrogen 2.817 N/A ARG 207.A NH2 GLU 240.A O no hydrogen 2.809 N/A GLN 210.A N ARG 207.A O no hydrogen 3.061 N/A GLN 212.A N TRP 205.A O no hydrogen 2.810 N/A GLN 212.A NE2 GLN 210.A O no hydrogen 3.115 N/A GLN 212.A NE2 GLN 210.A OE1.A no hydrogen 3.027 N/A THR 215.A N GLN 212.A O no hydrogen 3.077 N/A THR 215.A OG1 GLN 212.A O no hydrogen 2.762 N/A HIS 216.A N THR 233.A O no hydrogen 2.852 N/A ARG 217.A NE VAL 203.A O no hydrogen 2.757 N/A ARG 217.A NH2 VAL 203.A O no hydrogen 2.840 N/A GLY 218.A N GLN 231.A O no hydrogen 2.896 N/A LEU 221.A N TYR 229.A O no hydrogen 2.881 N/A ASN 223.A N THR 227.A O no hydrogen 2.846 N/A ASN 223.A ND2 SER 194.A OG no hydrogen 3.096 N/A ASN 223.A ND2 THR 227.A OG1 no hydrogen 3.059 N/A THR 227.A OG1 ASP 225.A OD1 no hydrogen 2.700 N/A TRP 228.A N PHE 196.A O no hydrogen 2.901 N/A TRP 228.A NE1 ASP 28.A OD2 no hydrogen 2.925 N/A TYR 229.A N LEU 221.A O no hydrogen 2.780 N/A TYR 229.A OH HIS 192.A ND1 no hydrogen 2.684 N/A TYR 229.A OH GLN 231.A OE1 no hydrogen 2.920 N/A LEU 230.A N VAL 193.A O no hydrogen 2.816 N/A ALA 232.A N CYS 191.A O no hydrogen 2.892 N/A THR 233.A N HIS 216.A O no hydrogen 2.874 N/A THR 233.A OG1 HIS 216.A O no hydrogen 3.527 N/A LEU 234.A N LEU 189.A O no hydrogen 2.944 N/A VAL 236.A N ARG 187.A O no hydrogen 2.856 N/A GLU 237.A N GLU 240.A OE1 no hydrogen 3.013 N/A GLY 239.A N GLU 241.A OE1 no hydrogen 2.914 N/A GLU 240.A N GLU 237.A O no hydrogen 3.105 N/A GLU 241.A N GLU 241.A OE1 no hydrogen 3.330 N/A LEU 244.A N GLU 241.A O no hydrogen 3.286 N/A ALA 245.A N MET 206.A O no hydrogen 2.874 N/A CYS 246.A N LEU 260.A O no hydrogen 2.779 N/A ARG 247.A N MET 204.A O no hydrogen 2.867 N/A ARG 247.A NE ASP 257.A OD2 no hydrogen 2.617 N/A ARG 247.A NH2 ASP 257.A OD2 no hydrogen 2.862 N/A VAL 248.A N ILE 258.A O no hydrogen 2.850 N/A LYS 249.A N TRP 202.A O no hydrogen 2.876 N/A LYS 249.A NZ ASP 257.A OD2 no hydrogen 2.855 N/A HIS 250.A ND1 SER 252.A OG no hydrogen 2.778 N/A HIS 250.A NE2 PRO 198.A O no hydrogen 2.859 N/A SER 251.A OG GLN 174.A OE1 no hydrogen 2.660 N/A SER 252.A N HIS 250.A ND1 no hydrogen 3.050 N/A SER 252.A OG GLU 175.A O no hydrogen 3.344 N/A SER 252.A OG HIS 250.A ND1 no hydrogen 2.778 N/A LEU 253.A N HIS 250.A O no hydrogen 2.926 N/A GLN 256.A N LEU 253.A O no hydrogen 3.033 N/A ILE 258.A N VAL 248.A O no hydrogen 2.978 N/A LEU 260.A N CYS 246.A O no hydrogen 2.965 N/A TRP 262.A N LEU 244.A O no hydrogen 2.958 N/A