Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3f9b_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A OH ARG 277.A O no hydrogen 2.663 N/A GLY 4.A N SER 1.A O no hydrogen 3.276 N/A GLU 6.A N GLU 6.A OE1 no hydrogen 2.787 N/A ARG 8.A N GLY 4.A O no hydrogen 3.051 N/A ARG 8.A NH2 ASP 266.A OD2 no hydrogen 3.021 N/A ALA 9.A N PRO 5.A O no hydrogen 2.886 N/A GLU 10.A N GLU 6.A O no hydrogen 2.996 N/A LEU 11.A N ALA 7.A O no hydrogen 2.960 N/A SER 12.A N ARG 8.A O no hydrogen 3.032 N/A SER 13.A N ALA 9.A O no hydrogen 2.909 N/A ARG 14.A N GLU 10.A O no hydrogen 2.985 N/A ARG 14.A NE GLU 10.A OE2 no hydrogen 2.860 N/A ARG 14.A NH1 GLU 244.A OE1 no hydrogen 2.799 N/A ARG 14.A NH1 GLU 244.A OE2 no hydrogen 3.484 N/A ARG 14.A NH1 ASN 281.A O no hydrogen 3.269 N/A ARG 14.A NH2 GLU 10.A OE2 no hydrogen 3.554 N/A LEU 15.A N LEU 11.A O no hydrogen 2.975 N/A THR 16.A N SER 12.A O no hydrogen 2.843 N/A THR 16.A OG1 SER 12.A O no hydrogen 2.900 N/A THR 17.A N SER 13.A O no hydrogen 3.103 N/A THR 17.A OG1 SER 13.A O no hydrogen 3.187 N/A LEU 18.A N ARG 14.A O no hydrogen 3.172 N/A ARG 19.A N LEU 15.A O no hydrogen 2.951 N/A ARG 19.A NE GLY 256.A O no hydrogen 3.020 N/A ARG 19.A NH2 GLN 260.A O no hydrogen 3.384 N/A ASN 20.A N THR 16.A O no hydrogen 3.095 N/A THR 21.A N THR 17.A O no hydrogen 3.017 N/A THR 21.A OG1 THR 17.A O no hydrogen 3.234 N/A LEU 22.A N LEU 18.A O no hydrogen 2.981 N/A ALA 23.A N ASN 20.A O no hydrogen 3.254 N/A ALA 25.A N ASP 28.A OD2 no hydrogen 2.893 N/A ASP 28.A N ALA 25.A O no hydrogen 3.269 N/A ARG 30.A N ASP 28.A OD1 no hydrogen 2.866 N/A ARG 30.A NE ASP 28.A OD1 no hydrogen 3.101 N/A ARG 30.A NE ASP 28.A OD2 no hydrogen 3.373 N/A ARG 30.A NH1 THR 21.A O no hydrogen 2.877 N/A ARG 30.A NH2 THR 21.A O no hydrogen 3.429 N/A ARG 30.A NH2 ASP 28.A OD2 no hydrogen 2.892 N/A TYR 31.A N ASP 28.A O no hydrogen 3.050 N/A TYR 31.A OH LEU 22.A O no hydrogen 2.588 N/A LEU 32.A N CYS 48.A O no hydrogen 2.766 N/A GLN 33.A NE2 ASP 28.A O no hydrogen 3.232 N/A GLN 33.A NE2 TYR 31.A O no hydrogen 3.214 N/A CYS 35.A SG GLN 33.A O no hydrogen 3.734 N/A ARG 42.A N GLN 74.A OE1 no hydrogen 2.844 N/A ARG 42.A NE TYR 75.A O no hydrogen 2.839 N/A ARG 42.A NH1 GLY 111.A O no hydrogen 3.176 N/A ARG 42.A NH2 TYR 75.A O no hydrogen 3.078 N/A ARG 42.A NH2 PRO 76.A O no hydrogen 2.956 N/A ARG 42.A NH2 GLY 111.A O no hydrogen 2.932 N/A ASP 45.A N ASP 45.A OD2 no hydrogen 2.627 N/A ILE 46.A N PHE 43.A O no hydrogen 3.036 N/A GLN 47.A NE2 ARG 44.A O no hydrogen 3.179 N/A CYS 48.A SG ARG 49.A O no hydrogen 3.806 N/A CYS 48.A SG LEU 58.A O no hydrogen 3.992 N/A CYS 48.A SG ALA 60.A O no hydrogen 3.255 N/A CYS 48.A SG ASN 61.A OD1 no hydrogen 3.369 N/A ARG 49.A N ARG 254.A O no hydrogen 2.989 N/A ARG 49.A NH2 GLN 51.A OE1 no hydrogen 3.199 N/A ARG 50.A N ARG 30.A O no hydrogen 2.808 N/A ARG 50.A NE TYR 31.A O no hydrogen 3.158 N/A ARG 50.A NH2 TYR 31.A O no hydrogen 2.826 N/A THR 52.A OG1 ARG 49.A O no hydrogen 3.526 N/A THR 52.A OG1 GLN 253.A O no hydrogen 2.588 N/A ALA 53.A N ARG 50.A O no hydrogen 3.157 N/A VAL 54.A N ALA 60.A O no hydrogen 3.123 N/A ARG 55.A NE SER 83.A OG no hydrogen 2.738 N/A LEU 58.A N ARG 55.A O no hydrogen 3.198 N/A ASN 59.A ND2 ASN 41.A OD1 no hydrogen 2.835 N/A ASN 59.A ND2 ILE 46.A O no hydrogen 3.096 N/A ASN 61.A N ALA 72.A O no hydrogen 2.801 N/A ASN 61.A ND2 ARG 49.A O no hydrogen 2.847 N/A ASN 61.A ND2 THR 52.A OG1 no hydrogen 2.885 N/A TYR 62.A N THR 52.A O no hydrogen 2.858 N/A ILE 63.A N THR 70.A O no hydrogen 2.910 N/A GLN 64.A N GLN 253.A OE1 no hydrogen 2.771 N/A GLN 64.A NE2 GLY 66.A O no hydrogen 2.909 N/A VAL 65.A N THR 68.A O no hydrogen 2.908 N/A GLY 66.A N GLN 249.A OE1 no hydrogen 2.839 N/A ASN 67.A N ASN 238.A OD1 no hydrogen 2.828 N/A ASN 67.A ND2 ASN 238.A OD1 no hydrogen 3.079 N/A THR 68.A N VAL 65.A O no hydrogen 2.940 N/A THR 68.A OG1 ASP 235.A OD2 no hydrogen 2.738 N/A ARG 69.A NE ASP 208.A OD1 no hydrogen 2.640 N/A THR 70.A N ILE 63.A O no hydrogen 2.866 N/A ILE 71.A N PRO 213.A O no hydrogen 2.811 N/A ALA 72.A N ASN 61.A O no hydrogen 2.976 N/A CYS 73.A N ILE 215.A O no hydrogen 3.130 N/A CYS 73.A SG GLN 74.A O no hydrogen 3.495 N/A GLN 74.A N ASN 59.A O no hydrogen 3.026 N/A GLN 74.A NE2 LEU 40.A O no hydrogen 2.962 N/A GLN 74.A NE2 GLN 80.A OE1 no hydrogen 3.194 N/A TYR 75.A N ARG 218.A O no hydrogen 2.906 N/A TYR 75.A OH PRO 113.A O no hydrogen 2.665 N/A LEU 77.A N GLN 80.A OE1 no hydrogen 2.979 N/A GLN 80.A N LEU 77.A O no hydrogen 2.847 N/A GLN 80.A NE2 LEU 40.A O no hydrogen 2.927 N/A LEU 81.A N GLN 78.A O no hydrogen 3.358 N/A SER 83.A OG ASP 57.A OD1 no hydrogen 3.302 N/A SER 83.A OG ASP 57.A OD2 no hydrogen 2.635 N/A HIS 84.A N GLN 80.A O no hydrogen 2.832 N/A HIS 84.A NE2 TYR 115.A OH no hydrogen 2.946 N/A PHE 85.A N LEU 81.A O no hydrogen 2.865 N/A ARG 86.A N GLU 82.A O no hydrogen 2.952 N/A ARG 86.A NE GLU 152.A OE1 no hydrogen 2.846 N/A ARG 86.A NH1 GLU 152.A OE1 no hydrogen 3.368 N/A ARG 86.A NH1 GLU 152.A OE2 no hydrogen 2.767 N/A ARG 86.A NH2 GLU 90.A OE1 no hydrogen 3.021 N/A MET 87.A N SER 83.A O no hydrogen 2.851 N/A LEU 88.A N HIS 84.A O no hydrogen 2.936 N/A ALA 89.A N PHE 85.A O no hydrogen 2.900 N/A GLU 90.A N ARG 86.A O no hydrogen 2.846 N/A ASN 91.A N MET 87.A O no hydrogen 3.057 N/A ASN 91.A ND2 THR 93.A OG1 no hydrogen 2.892 N/A ASN 91.A ND2 ARG 212.A O no hydrogen 2.773 N/A ARG 92.A N ALA 89.A O no hydrogen 2.972 N/A ARG 92.A NH1 ALA 89.A O no hydrogen 2.925 N/A THR 93.A N LEU 88.A O no hydrogen 3.247 N/A THR 93.A OG1 LEU 88.A O no hydrogen 2.720 N/A LEU 96.A N PRO 161.A O no hydrogen 2.860 N/A ALA 97.A N VAL 214.A O no hydrogen 2.801 N/A VAL 98.A N VAL 163.A O no hydrogen 2.847 N/A LEU 99.A N HIS 216.A O no hydrogen 2.799 N/A SER 101.A N GLU 104.A OE2 no hydrogen 2.825 N/A SER 101.A OG GLU 104.A OE2 no hydrogen 3.412 N/A SER 101.A OG ASP 170.A OD2 no hydrogen 2.612 N/A SER 102.A N GLY 166.A O no hydrogen 2.772 N/A SER 102.A OG GLY 166.A O no hydrogen 3.444 N/A GLU 104.A N SER 101.A OG no hydrogen 3.181 N/A ILE 105.A N SER 101.A O no hydrogen 3.007 N/A ALA 106.A N SER 102.A O no hydrogen 2.869 N/A ASN 107.A N SER 103.A O no hydrogen 3.213 N/A ASN 107.A N GLU 104.A O no hydrogen 3.189 N/A ARG 109.A N ASN 107.A OD1 no hydrogen 3.152 N/A ARG 109.A NH1 ASN 107.A OD1 no hydrogen 3.238 N/A PHE 110.A N ASN 107.A O no hydrogen 2.906 N/A GLY 111.A N GLN 108.A O no hydrogen 3.346 N/A TYR 115.A OH HIS 216.A NE2 no hydrogen 2.650 N/A ARG 117.A NE ASP 114.A OD2 no hydrogen 2.876 N/A ARG 117.A NH1 SER 102.A OG no hydrogen 2.786 N/A ARG 117.A NH2 ASP 114.A OD2 no hydrogen 3.239 N/A GLY 120.A N VAL 127.A O no hydrogen 2.953 N/A THR 121.A OG1 THR 126.A OG1 no hydrogen 3.083 N/A TYR 122.A N ILE 125.A O no hydrogen 2.728 N/A SER 124.A N GLU 82.A OE1 no hydrogen 2.940 N/A ILE 125.A N TYR 122.A O no hydrogen 2.968 N/A THR 126.A N ARG 151.A O no hydrogen 2.843 N/A THR 126.A OG1 THR 121.A OG1 no hydrogen 3.083 N/A VAL 127.A N GLY 120.A O no hydrogen 2.765 N/A GLU 128.A N THR 149.A O no hydrogen 2.887 N/A SER 129.A N SER 119.A OG no hydrogen 3.004 N/A SER 129.A OG PHE 116.A O no hydrogen 2.668 N/A LYS 130.A N THR 147.A O no hydrogen 2.982 N/A THR 132.A N MET 145.A O no hydrogen 2.873 N/A GLN 134.A NE2 ASP 144.A OD2 no hydrogen 2.867 N/A VAL 135.A N ALA 143.A O no hydrogen 2.874 N/A LEU 137.A N ILE 141.A O no hydrogen 2.819 N/A ILE 141.A N GLY 138.A O no hydrogen 2.888 N/A MET 142.A N ASN 167.A OD1 no hydrogen 2.845 N/A ALA 143.A N VAL 135.A O no hydrogen 2.857 N/A ASP 144.A N HIS 164.A O no hydrogen 2.771 N/A MET 145.A N GLN 133.A O no hydrogen 2.862 N/A TYR 146.A N VAL 162.A O no hydrogen 3.028 N/A THR 147.A N LYS 130.A O no hydrogen 2.858 N/A LEU 148.A N VAL 160.A O no hydrogen 2.874 N/A THR 149.A N GLU 128.A O no hydrogen 2.814 N/A THR 149.A OG1 SER 159.A OG no hydrogen 3.166 N/A ILE 150.A N ILE 158.A O no hydrogen 2.784 N/A ARG 151.A N THR 126.A O no hydrogen 2.816 N/A ARG 151.A NH2 GLU 128.A OE1 no hydrogen 3.491 N/A GLN 155.A N GLU 152.A O no hydrogen 2.961 N/A ILE 158.A N ILE 150.A O no hydrogen 3.147 N/A SER 159.A OG THR 149.A OG1 no hydrogen 3.166 N/A VAL 160.A N LEU 148.A O no hydrogen 2.764 N/A VAL 162.A N TYR 146.A O no hydrogen 2.815 N/A VAL 163.A N LEU 96.A O no hydrogen 2.782 N/A HIS 164.A N ASP 144.A O no hydrogen 2.814 N/A HIS 164.A NE2 ALA 100.A O no hydrogen 2.740 N/A VAL 165.A N VAL 98.A O no hydrogen 3.013 N/A ASN 167.A ND2 GLY 140.A O no hydrogen 2.910 N/A PHE 168.A N VAL 165.A O no hydrogen 3.184 N/A THR 172.A N PRO 169.A O no hydrogen 2.866 N/A SER 175.A OG GLU 177.A OE2 no hydrogen 3.408 N/A SER 176.A OG GLU 177.A OE2 no hydrogen 3.301 N/A GLU 177.A N GLU 177.A OE2 no hydrogen 2.878 N/A VAL 178.A N SER 175.A OG no hydrogen 3.115 N/A THR 179.A N SER 175.A O no hydrogen 2.888 N/A THR 179.A OG1 SER 175.A O no hydrogen 2.795 N/A LYS 180.A N SER 176.A O no hydrogen 2.844 N/A ALA 181.A N GLU 177.A O no hydrogen 3.069 N/A LEU 182.A N VAL 178.A O no hydrogen 2.855 N/A ALA 183.A N THR 179.A O no hydrogen 2.821 N/A SER 184.A N LYS 180.A O no hydrogen 2.921 N/A SER 184.A OG LYS 180.A O no hydrogen 3.184 N/A LEU 185.A N ALA 181.A O no hydrogen 2.994 N/A VAL 186.A N LEU 182.A O no hydrogen 2.869 N/A ASP 187.A N ALA 183.A O no hydrogen 2.871 N/A GLN 188.A N SER 184.A O no hydrogen 2.870 N/A GLN 188.A NE2 GLN 188.A O no hydrogen 3.123 N/A GLN 188.A NE2 THR 192.A OG1 no hydrogen 3.303 N/A THR 189.A N LEU 185.A O no hydrogen 2.926 N/A THR 189.A OG1 LEU 185.A O no hydrogen 2.757 N/A ALA 190.A N VAL 186.A O no hydrogen 2.983 N/A GLU 191.A N ASP 187.A O no hydrogen 2.874 N/A THR 192.A N GLN 188.A O no hydrogen 3.055 N/A THR 192.A OG1 GLN 188.A O no hydrogen 3.203 N/A LYS 193.A N THR 189.A O no hydrogen 3.191 N/A LYS 193.A NZ SER 159.A O no hydrogen 3.073 N/A ARG 194.A N ALA 190.A O no hydrogen 2.820 N/A ARG 194.A NH2 LEU 211.A O no hydrogen 2.689 N/A ASN 195.A N GLU 191.A O no hydrogen 2.936 N/A MET 196.A N THR 192.A O no hydrogen 3.256 N/A TYR 197.A N LYS 193.A O no hydrogen 3.218 N/A GLU 198.A N ARG 194.A O no hydrogen 2.907 N/A SER 199.A N ASN 195.A O no hydrogen 2.835 N/A SER 199.A OG MET 196.A O no hydrogen 2.661 N/A LYS 200.A N MET 196.A O no hydrogen 3.059 N/A LYS 200.A N TYR 197.A O no hydrogen 3.252 N/A GLY 201.A N GLU 198.A O no hydrogen 3.102 N/A SER 202.A N TYR 197.A O no hydrogen 2.997 N/A ALA 204.A N SER 202.A OG no hydrogen 3.181 N/A VAL 205.A N SER 202.A O no hydrogen 3.499 N/A ALA 206.A N SER 203.A O no hydrogen 3.268 N/A ASP 207.A N ALA 204.A O no hydrogen 3.241 N/A SER 209.A N ASP 207.A OD2 no hydrogen 2.918 N/A SER 209.A OG ASP 207.A OD2 no hydrogen 2.691 N/A LYS 210.A N ASP 207.A O no hydrogen 3.072 N/A LYS 210.A NZ GLU 90.A O no hydrogen 2.959 N/A LEU 211.A N ASN 91.A O no hydrogen 2.724 N/A ARG 212.A N ASN 91.A OD1 no hydrogen 3.119 N/A ARG 212.A NE ASP 208.A O no hydrogen 2.946 N/A ARG 212.A NH1 THR 70.A O no hydrogen 3.018 N/A ARG 212.A NH2 ASP 208.A O no hydrogen 2.988 N/A VAL 214.A N VAL 95.A O no hydrogen 2.952 N/A ILE 215.A N ILE 71.A O no hydrogen 2.900 N/A HIS 216.A N ALA 97.A O no hydrogen 2.998 N/A HIS 216.A ND1 CYS 217.A O no hydrogen 2.925 N/A HIS 216.A NE2 TYR 115.A OH no hydrogen 2.650 N/A CYS 217.A SG THR 224.A OG1 no hydrogen 3.192 N/A ARG 223.A NH1 GLU 104.A OE1 no hydrogen 3.552 N/A ARG 223.A NH1 GLU 104.A OE2 no hydrogen 2.788 N/A ARG 223.A NH2 GLU 104.A OE1 no hydrogen 2.989 N/A ARG 223.A NH2 GLU 104.A OE2 no hydrogen 3.318 N/A GLN 226.A N GLY 222.A O no hydrogen 2.994 N/A GLN 226.A NE2 VAL 174.A O no hydrogen 3.119 N/A GLN 226.A NE2 THR 179.A OG1 no hydrogen 2.819 N/A LEU 227.A N ARG 223.A O no hydrogen 2.998 N/A ILE 228.A N THR 224.A O no hydrogen 2.991 N/A GLY 229.A N ALA 225.A O no hydrogen 2.930 N/A ALA 230.A N GLN 226.A O no hydrogen 3.081 N/A MET 231.A N LEU 227.A O no hydrogen 2.838 N/A CYS 232.A N ILE 228.A O no hydrogen 2.932 N/A CYS 232.A SG GLY 229.A O no hydrogen 3.228 N/A MET 233.A N GLY 229.A O no hydrogen 3.169 N/A ASN 234.A N ALA 230.A O no hydrogen 3.173 N/A ASN 234.A N MET 231.A O no hydrogen 3.065 N/A ASN 234.A ND2 ASP 187.A OD2 no hydrogen 3.405 N/A ASP 235.A N CYS 232.A O no hydrogen 3.209 N/A ARG 237.A N ASP 235.A OD1 no hydrogen 2.962 N/A ARG 237.A NE ASP 235.A OD1 no hydrogen 2.930 N/A ARG 237.A NE ASP 235.A OD2 no hydrogen 3.426 N/A ARG 237.A NH2 ASP 235.A OD2 no hydrogen 2.771 N/A ASN 238.A N ASP 235.A O no hydrogen 3.063 N/A ASN 238.A ND2 VAL 65.A O no hydrogen 3.627 N/A ASN 238.A ND2 THR 68.A OG1 no hydrogen 2.813 N/A ASN 238.A ND2 CYS 232.A O no hydrogen 2.888 N/A LEU 241.A N ASN 238.A O no hydrogen 3.144 N/A SER 242.A N ASP 245.A OD2 no hydrogen 3.178 N/A SER 242.A OG ASN 281.A OD1 no hydrogen 2.638 N/A VAL 243.A N PRO 278.A O no hydrogen 3.042 N/A GLU 244.A N LEU 279.A O no hydrogen 2.873 N/A ASP 245.A N SER 242.A OG no hydrogen 2.898 N/A MET 246.A N SER 242.A O no hydrogen 2.955 N/A VAL 247.A N VAL 243.A O no hydrogen 2.998 N/A SER 248.A N GLU 244.A O no hydrogen 2.972 N/A SER 248.A OG GLU 244.A O no hydrogen 2.755 N/A SER 248.A OG ASP 245.A O no hydrogen 2.933 N/A GLN 249.A N ASP 245.A O no hydrogen 2.902 N/A MET 250.A N MET 246.A O no hydrogen 3.033 N/A ARG 251.A N VAL 247.A O no hydrogen 2.947 N/A ARG 251.A NE MET 258.A O no hydrogen 2.775 N/A ARG 251.A NH2 MET 258.A O no hydrogen 3.028 N/A ARG 251.A NH2 VAL 259.A O no hydrogen 2.989 N/A VAL 252.A N SER 248.A O no hydrogen 2.954 N/A GLN 253.A N GLN 249.A O no hydrogen 3.120 N/A GLN 253.A NE2 GLN 64.A O no hydrogen 2.986 N/A ARG 254.A NE GLY 220.A O no hydrogen 2.982 N/A ARG 254.A NH1 ASN 59.A OD1 no hydrogen 2.805 N/A ARG 254.A NH1 ASN 61.A OD1 no hydrogen 2.841 N/A ARG 254.A NH2 ASN 59.A OD1 no hydrogen 2.938 N/A ARG 254.A NH2 ALA 219.A O no hydrogen 2.814 N/A ASN 255.A ND2 GLN 47.A O no hydrogen 2.842 N/A ILE 257.A N ASN 255.A OD1 no hydrogen 2.953 N/A MET 258.A N ASN 255.A O no hydrogen 3.336 N/A VAL 259.A N VAL 221.A O no hydrogen 2.771 N/A LYS 261.A N GLN 264.A OE1 no hydrogen 2.962 N/A GLU 263.A N GLU 263.A OE2 no hydrogen 2.772 N/A GLN 264.A N LYS 261.A O no hydrogen 3.015 N/A LEU 265.A N LYS 261.A O no hydrogen 3.216 N/A ASP 266.A N ASP 262.A O no hydrogen 2.883 N/A VAL 267.A N GLN 264.A O no hydrogen 3.137 N/A LEU 268.A N GLN 264.A O no hydrogen 3.263 N/A ILE 269.A N LEU 265.A O no hydrogen 2.893 N/A LYS 270.A N ASP 266.A O no hydrogen 2.980 N/A LYS 270.A NZ SER 176.A OG no hydrogen 2.796 N/A LYS 270.A NZ GLU 177.A OE1 no hydrogen 2.984 N/A LYS 270.A NZ GLU 177.A OE2 no hydrogen 3.465 N/A LEU 271.A N VAL 267.A O no hydrogen 2.941 N/A ALA 272.A N LEU 268.A O no hydrogen 2.914 N/A GLU 273.A N ILE 269.A O no hydrogen 2.843 N/A GLY 274.A N LYS 270.A O no hydrogen 3.025 N/A GLN 275.A N ALA 272.A O no hydrogen 2.964 N/A GLN 275.A NE2 MET 233.A O no hydrogen 2.920 N/A GLY 276.A N GLU 273.A O no hydrogen 3.133 N/A ARG 277.A N ALA 272.A O no hydrogen 2.939 N/A ARG 277.A NE GLN 275.A OE1 no hydrogen 2.879 N/A ARG 277.A NH1 ASN 238.A O no hydrogen 2.829 N/A ARG 277.A NH1 LEU 241.A O no hydrogen 2.915 N/A ARG 277.A NH2 GLN 275.A OE1 no hydrogen 2.974 N/A ASN 281.A N GLU 244.A OE1 no hydrogen 2.798 N/A ASN 281.A ND2 ASP 245.A OD1 no hydrogen 2.817 N/A