Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8c1g_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 3.A N ASP 6.A OD2 no hydrogen 2.884 N/A ASP 6.A N ALA 3.A O no hydrogen 2.937 N/A PHE 7.A N LEU 4.A O no hydrogen 3.073 N/A GLU 8.A N ARG 25.A O no hydrogen 2.935 N/A GLY 10.A N LEU 23.A O no hydrogen 2.741 N/A ARG 11.A NH1 PRO 12.A O no hydrogen 3.262 N/A LEU 13.A N VAL 21.A O no hydrogen 2.656 N/A GLY 14.A N VAL 21.A O no hydrogen 3.400 N/A GLY 16.A N GLY 19.A O no hydrogen 2.970 N/A ASN 20.A N VAL 37.A O no hydrogen 3.071 N/A VAL 21.A N GLY 14.A O no hydrogen 2.968 N/A TYR 22.A N LEU 35.A O no hydrogen 3.032 N/A LEU 23.A N ARG 11.A O no hydrogen 2.990 N/A ALA 24.A N LEU 33.A O no hydrogen 2.886 N/A ARG 25.A N GLU 8.A O no hydrogen 2.930 N/A ARG 25.A NE GLU 8.A OE1 no hydrogen 3.362 N/A ARG 25.A NH2 GLU 8.A OE1 no hydrogen 2.723 N/A GLU 26.A N PHE 31.A O no hydrogen 2.801 N/A LYS 27.A N ASP 6.A O no hydrogen 2.965 N/A LYS 27.A NZ GLU 5.A O no hydrogen 2.751 N/A GLN 28.A N GLU 26.A OE2 no hydrogen 3.018 N/A SER 29.A N GLU 26.A OE1 no hydrogen 2.987 N/A SER 29.A OG GLU 26.A OE1 no hydrogen 3.027 N/A LYS 30.A N GLU 26.A O no hydrogen 2.740 N/A PHE 31.A N SER 29.A OG no hydrogen 3.190 N/A LEU 33.A N ALA 24.A O no hydrogen 2.908 N/A ALA 34.A N LEU 84.A O no hydrogen 2.870 N/A LEU 35.A N TYR 22.A O no hydrogen 2.735 N/A LYS 36.A N LEU 82.A O no hydrogen 2.814 N/A LYS 36.A NZ GLU 55.A OE2 no hydrogen 2.920 N/A VAL 37.A N ASN 20.A O no hydrogen 2.885 N/A LEU 38.A N VAL 80.A O no hydrogen 2.780 N/A PHE 39.A N PHE 18.A O no hydrogen 2.887 N/A LYS 40.A N THR 78.A O no hydrogen 2.910 N/A LYS 40.A NZ HIS 75.A ND1 no hydrogen 2.789 N/A LYS 40.A NZ ASP 76.A O no hydrogen 2.671 N/A LEU 43.A N PHE 39.A O no hydrogen 3.160 N/A GLU 44.A N LYS 40.A O no hydrogen 2.947 N/A LYS 45.A N ALA 41.A O no hydrogen 2.951 N/A ALA 46.A N GLN 42.A O no hydrogen 3.314 N/A GLY 47.A N GLU 44.A O no hydrogen 3.023 N/A VAL 48.A N LEU 43.A O no hydrogen 3.032 N/A GLN 51.A NE2 GLY 150.A O no hydrogen 2.851 N/A GLN 51.A NE2 SER 152.A O no hydrogen 2.873 N/A LEU 52.A N VAL 48.A O no hydrogen 2.993 N/A ARG 54.A N HIS 50.A O no hydrogen 3.087 N/A ARG 54.A NE GLN 51.A OE1 no hydrogen 2.811 N/A ARG 54.A NH1 GLN 51.A OE1 no hydrogen 2.854 N/A GLU 55.A N GLN 51.A O no hydrogen 2.895 N/A VAL 56.A N LEU 52.A O no hydrogen 3.097 N/A GLU 57.A N ARG 53.A O no hydrogen 2.908 N/A ILE 58.A N ARG 54.A O no hydrogen 2.872 N/A GLN 59.A N GLU 55.A O no hydrogen 2.952 N/A GLN 59.A NE2 LEU 68.A O no hydrogen 3.266 N/A SER 60.A N VAL 56.A O no hydrogen 2.941 N/A SER 60.A OG VAL 56.A O no hydrogen 2.722 N/A SER 60.A OG GLU 57.A O no hydrogen 3.215 N/A SER 60.A OG HIS 61.A ND1 no hydrogen 3.344 N/A HIS 61.A N ILE 58.A O no hydrogen 3.202 N/A HIS 61.A ND1 GLU 57.A O no hydrogen 2.790 N/A LEU 62.A N GLN 59.A O no hydrogen 3.163 N/A ARG 63.A N TYR 120.A OH no hydrogen 3.064 N/A ARG 63.A NH1 SER 60.A O no hydrogen 3.320 N/A ASN 66.A N HIS 64.A ND1 no hydrogen 2.947 N/A ASN 66.A ND2 LEU 144.A O no hydrogen 2.847 N/A ILE 67.A N HIS 64.A O no hydrogen 3.211 N/A LEU 68.A N ILE 146.A O no hydrogen 2.978 N/A ARG 69.A N GLU 85.A OE1 no hydrogen 2.977 N/A TYR 71.A N ILE 83.A O no hydrogen 2.727 N/A PHE 74.A N TYR 81.A O no hydrogen 3.067 N/A ASP 76.A N ARG 79.A O no hydrogen 2.869 N/A THR 78.A N ASP 76.A OD1 no hydrogen 3.303 N/A ARG 79.A N ASP 76.A OD1 no hydrogen 2.839 N/A ARG 79.A NH2 ASP 76.A OD2 no hydrogen 3.274 N/A VAL 80.A N LEU 38.A O no hydrogen 2.860 N/A TYR 81.A N PHE 74.A O no hydrogen 2.806 N/A TYR 81.A OH ASP 76.A OD2 no hydrogen 2.771 N/A LEU 82.A N LYS 36.A O no hydrogen 2.762 N/A ILE 83.A N GLY 72.A O no hydrogen 2.830 N/A LEU 84.A N ALA 34.A O no hydrogen 2.815 N/A GLU 85.A N ARG 69.A O no hydrogen 3.103 N/A LEU 89.A N LEU 138.A O no hydrogen 2.981 N/A GLY 90.A N ALA 87.A O no hydrogen 3.356 N/A VAL 92.A N LEU 136.A O no hydrogen 2.960 N/A ARG 94.A N THR 91.A OG1 no hydrogen 2.979 N/A GLU 95.A N THR 91.A O no hydrogen 3.228 N/A LEU 96.A N VAL 92.A O no hydrogen 2.865 N/A GLN 97.A N TYR 93.A O no hydrogen 3.052 N/A LYS 98.A N ARG 94.A O no hydrogen 3.030 N/A LEU 99.A N GLU 95.A O no hydrogen 2.883 N/A LYS 101.A N LEU 99.A O no hydrogen 2.938 N/A PHE 102.A N PHE 192.A O no hydrogen 2.749 N/A GLN 105.A NE2 ASN 256.A OD1 no hydrogen 2.784 N/A ARG 106.A N ASP 103.A OD1 no hydrogen 2.877 N/A ARG 106.A NH1 GLU 95.A OE1 no hydrogen 3.526 N/A ARG 106.A NH2 GLU 95.A OE1 no hydrogen 2.758 N/A THR 107.A N ASP 103.A O no hydrogen 3.093 N/A THR 107.A OG1 ASP 103.A O no hydrogen 2.893 N/A ALA 108.A N GLU 104.A O no hydrogen 3.051 N/A THR 109.A N GLN 105.A O no hydrogen 3.109 N/A THR 109.A OG1 GLN 105.A O no hydrogen 2.642 N/A TYR 110.A N ARG 106.A O no hydrogen 3.005 N/A ILE 111.A N THR 107.A O no hydrogen 2.933 N/A THR 112.A N ALA 108.A O no hydrogen 3.045 N/A THR 112.A OG1 ALA 108.A O no hydrogen 2.890 N/A THR 112.A OG1 SER 257.A OG no hydrogen 2.891 N/A GLU 113.A N THR 109.A O no hydrogen 3.039 N/A LEU 114.A N TYR 110.A O no hydrogen 2.808 N/A ALA 115.A N ILE 111.A O no hydrogen 2.771 N/A ASN 116.A N THR 112.A O no hydrogen 3.002 N/A ALA 117.A N GLU 113.A O no hydrogen 3.102 N/A LEU 118.A N LEU 114.A O no hydrogen 2.773 N/A SER 119.A N ALA 115.A O no hydrogen 2.803 N/A TYR 120.A N ASN 116.A O no hydrogen 3.241 N/A CYS 121.A N ALA 117.A O no hydrogen 3.078 N/A CYS 121.A SG ALA 117.A O no hydrogen 3.486 N/A HIS 122.A N LEU 118.A O no hydrogen 2.871 N/A HIS 122.A NE2 ASP 181.A OD2 no hydrogen 2.835 N/A SER 123.A N SER 119.A O no hydrogen 2.968 N/A SER 123.A OG TYR 120.A O no hydrogen 2.867 N/A LYS 124.A N CYS 121.A O no hydrogen 2.863 N/A LYS 124.A NZ HIS 61.A O no hydrogen 3.539 N/A LYS 124.A NZ TYR 120.A OH no hydrogen 3.466 N/A ARG 125.A N HIS 122.A O no hydrogen 2.930 N/A ARG 125.A NH2 GLU 178.A OE2 no hydrogen 2.887 N/A VAL 126.A N CYS 121.A O no hydrogen 3.218 N/A ILE 127.A N VAL 153.A O no hydrogen 2.859 N/A HIS 128.A N ASP 181.A OD2 no hydrogen 2.972 N/A HIS 128.A NE2 ALA 147.A O no hydrogen 2.858 N/A ARG 129.A N ASP 181.A OD1 no hydrogen 3.019 N/A ARG 129.A NE TRP 151.A O no hydrogen 2.812 N/A ARG 129.A NH1 ARG 159.A O no hydrogen 3.417 N/A ARG 129.A NH1 HIS 176.A NE2 no hydrogen 2.809 N/A ARG 129.A NH2 TRP 151.A O no hydrogen 3.052 N/A ASP 130.A N HIS 128.A ND1 no hydrogen 2.889 N/A LYS 132.A NZ ASP 130.A OD1 no hydrogen 3.232 N/A ASN 135.A N LYS 132.A O no hydrogen 2.907 N/A LEU 136.A N PRO 133.A O no hydrogen 3.059 N/A LEU 137.A N LYS 145.A O no hydrogen 2.770 N/A LEU 138.A N GLY 90.A O no hydrogen 2.729 N/A GLY 139.A N GLU 143.A O no hydrogen 2.961 N/A GLY 142.A N GLY 139.A O no hydrogen 3.092 N/A GLU 143.A N GLU 143.A OE1 no hydrogen 2.680 N/A LEU 144.A N GLU 113.A OE2 no hydrogen 3.069 N/A LYS 145.A N LEU 137.A O no hydrogen 2.745 N/A LYS 145.A NZ PRO 65.A O no hydrogen 2.825 N/A LYS 145.A NZ GLU 85.A OE2 no hydrogen 3.227 N/A ILE 146.A N ASN 66.A O no hydrogen 2.808 N/A ALA 147.A N ASN 135.A O no hydrogen 2.754 N/A GLY 150.A N ASP 148.A OD1 no hydrogen 3.137 N/A SER 152.A N PHE 149.A O no hydrogen 3.146 N/A SER 152.A OG ILE 127.A O no hydrogen 3.064 N/A VAL 153.A N ILE 127.A O no hydrogen 3.119 N/A ALA 155.A N ARG 125.A O no hydrogen 2.734 N/A SER 157.A N HIS 176.A O no hydrogen 2.998 N/A ARG 159.A N SER 157.A OG no hydrogen 3.176 N/A THR 162.A OG1 ASP 164.A OD2 no hydrogen 2.815 N/A TYR 165.A OH GLU 191.A OE1 no hydrogen 2.579 N/A TYR 165.A OH GLU 191.A OE2 no hydrogen 3.318 N/A LEU 166.A N LEU 163.A O no hydrogen 2.800 N/A GLU 169.A N GLU 169.A OE1 no hydrogen 3.087 N/A MET 170.A N PRO 167.A O no hydrogen 3.252 N/A ILE 171.A N PRO 167.A O no hydrogen 3.238 N/A GLU 172.A N PRO 168.A O no hydrogen 2.954 N/A ARG 174.A N GLU 169.A O no hydrogen 2.819 N/A ARG 174.A NE GLU 172.A OE2 no hydrogen 2.797 N/A HIS 176.A N SER 157.A O no hydrogen 2.857 N/A HIS 176.A ND1 ARG 174.A O no hydrogen 3.118 N/A GLU 178.A N GLU 178.A OE1 no hydrogen 2.816 N/A LYS 179.A N ASP 177.A OD1 no hydrogen 3.474 N/A VAL 180.A N ASP 177.A O no hydrogen 3.040 N/A ASP 181.A N GLU 178.A O no hydrogen 3.166 N/A LEU 182.A N LYS 179.A O no hydrogen 3.193 N/A TRP 183.A N LYS 179.A O no hydrogen 3.219 N/A SER 184.A N VAL 180.A O no hydrogen 3.172 N/A SER 184.A OG TYR 165.A O no hydrogen 2.714 N/A SER 184.A OG VAL 180.A O no hydrogen 3.187 N/A LEU 185.A N ASP 181.A O no hydrogen 2.931 N/A GLY 186.A N LEU 182.A O no hydrogen 3.173 N/A VAL 187.A N TRP 183.A O no hydrogen 3.074 N/A LEU 188.A N SER 184.A O no hydrogen 2.827 N/A CYS 189.A N LEU 185.A O no hydrogen 2.982 N/A TYR 190.A N GLY 186.A O no hydrogen 3.206 N/A TYR 190.A OH THR 217.A O no hydrogen 2.651 N/A GLU 191.A N VAL 187.A O no hydrogen 3.025 N/A PHE 192.A N LEU 188.A O no hydrogen 2.753 N/A LEU 193.A N CYS 189.A O no hydrogen 3.260 N/A VAL 194.A N TYR 190.A O no hydrogen 2.878 N/A GLY 195.A N GLU 191.A O no hydrogen 2.742 N/A GLU 200.A N PRO 197.A O no hydrogen 3.290 N/A GLU 206.A N THR 203.A OG1 no hydrogen 2.942 N/A THR 207.A N THR 203.A O no hydrogen 3.122 N/A THR 207.A OG1 PHE 199.A O no hydrogen 3.317 N/A THR 207.A OG1 THR 203.A O no hydrogen 3.060 N/A TYR 208.A N TYR 204.A O no hydrogen 2.999 N/A LYS 209.A N GLN 205.A O no hydrogen 3.263 N/A ARG 210.A N GLU 206.A O no hydrogen 3.170 N/A ARG 210.A NE GLU 215.A O no hydrogen 2.660 N/A ARG 210.A NH2 GLU 215.A O no hydrogen 2.854 N/A ILE 211.A N THR 207.A O no hydrogen 3.050 N/A SER 212.A N TYR 208.A O no hydrogen 3.023 N/A ARG 213.A N LYS 209.A O no hydrogen 2.837 N/A ARG 213.A NH1 GLU 215.A OE1 no hydrogen 2.767 N/A VAL 214.A N ILE 211.A O no hydrogen 3.186 N/A GLU 215.A N ARG 210.A O no hydrogen 2.876 N/A VAL 222.A N PRO 219.A O no hydrogen 3.258 N/A THR 223.A OG1 GLU 104.A OE1 no hydrogen 2.722 N/A ARG 227.A N THR 223.A O no hydrogen 2.997 N/A ARG 227.A NE VAL 222.A O no hydrogen 2.807 N/A ARG 227.A NH2 VAL 222.A O no hydrogen 3.483 N/A ASP 228.A N GLU 224.A O no hydrogen 3.082 N/A LEU 229.A N GLY 225.A O no hydrogen 3.204 N/A ILE 230.A N ALA 226.A O no hydrogen 2.933 N/A SER 231.A N ARG 227.A O no hydrogen 2.857 N/A SER 231.A OG ARG 227.A O no hydrogen 3.026 N/A ARG 232.A N ASP 228.A O no hydrogen 3.068 N/A ARG 232.A NE ASP 228.A OD1 no hydrogen 2.761 N/A ARG 232.A NE ASP 228.A OD2 no hydrogen 3.481 N/A ARG 232.A NH2 ASP 228.A OD2 no hydrogen 3.536 N/A LEU 233.A N LEU 229.A O no hydrogen 3.137 N/A LEU 234.A N ILE 230.A O no hydrogen 2.868 N/A SER 239.A N ASN 237.A OD1 no hydrogen 2.916 N/A SER 239.A OG ASN 237.A OD1 no hydrogen 3.034 N/A GLN 240.A N ASN 237.A O no hydrogen 2.918 N/A ARG 241.A N PRO 238.A O no hydrogen 3.269 N/A ARG 241.A NE LYS 235.A O no hydrogen 2.829 N/A ARG 241.A NH1 GLU 169.A OE2 no hydrogen 3.017 N/A ARG 241.A NH1 LYS 179.A O no hydrogen 2.852 N/A ARG 241.A NH2 GLU 169.A OE1 no hydrogen 2.892 N/A ARG 241.A NH2 LYS 235.A O no hydrogen 2.974 N/A MET 243.A N GLU 246.A OE1 no hydrogen 3.286 N/A VAL 247.A N MET 243.A O no hydrogen 3.288 N/A LEU 248.A N LEU 244.A O no hydrogen 3.054 N/A GLU 249.A N ARG 245.A O no hydrogen 3.149 N/A HIS 250.A N VAL 247.A O no hydrogen 3.189 N/A HIS 250.A NE2 ASP 228.A OD1 no hydrogen 2.698 N/A TRP 252.A N HIS 250.A ND1 no hydrogen 3.158 N/A TRP 252.A NE1 GLU 104.A OE1 no hydrogen 2.699 N/A THR 254.A N HIS 250.A O no hydrogen 2.983 N/A THR 254.A OG1 HIS 250.A O no hydrogen 3.331 N/A THR 254.A OG1 PRO 251.A O no hydrogen 3.032 N/A ALA 255.A N PRO 251.A O no hydrogen 2.925 N/A ASN 256.A N TRP 252.A O no hydrogen 3.150 N/A ASN 256.A N ILE 253.A O no hydrogen 3.110 N/A ASN 256.A ND2 TRP 252.A O no hydrogen 2.793 N/A SER 257.A N ILE 253.A O no hydrogen 2.744 N/A SER 257.A OG ALA 108.A O no hydrogen 3.471 N/A SER 257.A OG THR 112.A OG1 no hydrogen 2.891 N/A