Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6f3g_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 3.A N LEU 79.A O no hydrogen 2.927 N/A PHE 5.A N PHE 81.A O no hydrogen 2.793 N/A SER 6.A N GLU 9.A OE2 no hydrogen 2.847 N/A GLU 9.A N SER 6.A O no hydrogen 3.050 N/A LEU 10.A N SER 6.A O no hydrogen 3.348 N/A LYS 11.A N PHE 7.A O no hydrogen 2.893 N/A ASN 12.A N TYR 8.A O no hydrogen 2.878 N/A ASN 12.A ND2 TYR 8.A O no hydrogen 3.053 N/A VAL 13.A N GLU 9.A O no hydrogen 2.926 N/A THR 14.A OG1 LEU 10.A O no hydrogen 2.767 N/A THR 14.A OG1 LYS 11.A O no hydrogen 2.955 N/A ASN 15.A ND2 ASP 18.A OD2 no hydrogen 3.027 N/A ASN 16.A N LYS 11.A O no hydrogen 2.679 N/A PHE 17.A N THR 14.A OG1 no hydrogen 3.013 N/A ASP 18.A N THR 14.A O no hydrogen 2.983 N/A ARG 20.A N ASP 18.A OD1 no hydrogen 3.374 N/A ARG 20.A NE ASP 18.A OD1 no hydrogen 3.105 N/A ARG 20.A NE ASP 18.A OD2 no hydrogen 3.502 N/A ARG 20.A NH2 ASP 18.A OD2 no hydrogen 3.156 N/A ILE 22.A N LYS 28.A O no hydrogen 3.217 N/A VAL 24.A N PRO 21.A O no hydrogen 3.177 N/A GLY 25.A N ILE 22.A O no hydrogen 2.901 N/A GLY 26.A N PRO 21.A O no hydrogen 2.982 N/A ASN 27.A N ASP 18.A O no hydrogen 3.325 N/A ASN 27.A ND2 LYS 39.A O no hydrogen 2.716 N/A LYS 28.A N ARG 20.A O no hydrogen 2.909 N/A LYS 28.A NZ GLU 31.A OE1 no hydrogen 2.868 N/A MET 29.A N VAL 37.A O no hydrogen 2.811 N/A GLY 30.A N VAL 37.A O no hydrogen 3.384 N/A VAL 36.A N LYS 51.A O no hydrogen 3.191 N/A VAL 37.A N GLY 30.A O no hydrogen 2.811 N/A TYR 38.A N VAL 49.A O no hydrogen 2.829 N/A LYS 39.A N ASN 27.A O no hydrogen 2.778 N/A LYS 39.A NZ TYR 91.A OH no hydrogen 3.497 N/A GLY 40.A N VAL 47.A O no hydrogen 2.877 N/A TYR 41.A N VAL 13.A O no hydrogen 3.356 N/A VAL 42.A N THR 45.A O no hydrogen 2.797 N/A THR 45.A N VAL 42.A O no hydrogen 2.927 N/A VAL 47.A N GLY 40.A O no hydrogen 2.860 N/A ALA 48.A N TYR 89.A O no hydrogen 3.009 N/A VAL 49.A N TYR 38.A O no hydrogen 2.807 N/A LYS 50.A N LEU 87.A O no hydrogen 2.886 N/A LYS 50.A NZ TYR 89.A OH no hydrogen 3.507 N/A LYS 51.A N VAL 36.A O no hydrogen 2.864 N/A LEU 52.A N LEU 85.A O no hydrogen 2.849 N/A LYS 57.A N THR 53.A O no hydrogen 3.168 N/A LYS 57.A NZ ASP 61.A OD1 no hydrogen 2.811 N/A LYS 57.A NZ ASP 61.A OD2 no hydrogen 3.535 N/A GLN 58.A N GLU 54.A O no hydrogen 3.176 N/A GLN 59.A N GLU 55.A O no hydrogen 3.067 N/A PHE 60.A N LEU 56.A O no hydrogen 2.988 N/A ASP 61.A N LYS 57.A O no hydrogen 2.933 N/A GLN 62.A N GLN 58.A O no hydrogen 2.838 N/A GLU 63.A N GLN 59.A O no hydrogen 3.036 N/A ILE 64.A N PHE 60.A O no hydrogen 3.234 N/A LYS 65.A N ASP 61.A O no hydrogen 3.168 N/A VAL 66.A N GLN 62.A O no hydrogen 2.970 N/A MET 67.A N GLU 63.A O no hydrogen 2.946 N/A ALA 68.A N ILE 64.A O no hydrogen 2.918 N/A LYS 69.A N VAL 66.A O no hydrogen 3.217 N/A CYS 70.A N VAL 66.A O no hydrogen 2.840 N/A GLN 71.A NE2 ALA 68.A O no hydrogen 3.647 N/A ASN 74.A N HIS 72.A ND1 no hydrogen 2.874 N/A ASN 74.A ND2 ALA 152.A O no hydrogen 2.932 N/A LEU 75.A N HIS 72.A O no hydrogen 3.110 N/A VAL 76.A N ILE 154.A O no hydrogen 2.853 N/A LEU 79.A N VAL 88.A O no hydrogen 2.757 N/A GLY 80.A N VAL 88.A O no hydrogen 3.161 N/A PHE 81.A N HIS 3.A O no hydrogen 3.011 N/A SER 82.A N CYS 86.A O no hydrogen 2.916 N/A SER 82.A OG PHE 5.A O no hydrogen 2.941 N/A CYS 86.A N SER 82.A O no hydrogen 2.900 N/A LEU 87.A N LYS 50.A O no hydrogen 2.945 N/A VAL 88.A N GLY 80.A O no hydrogen 2.844 N/A TYR 89.A N ALA 48.A O no hydrogen 2.885 N/A TYR 89.A OH GLU 63.A OE1 no hydrogen 2.685 N/A VAL 90.A N GLU 77.A O no hydrogen 2.947 N/A ASN 94.A N LEU 146.A O no hydrogen 3.031 N/A ASN 94.A ND2 ASP 147.A O no hydrogen 2.879 N/A GLY 95.A N MET 92.A O no hydrogen 3.296 N/A LEU 97.A N ILE 144.A O no hydrogen 2.792 N/A LEU 98.A N SER 141.A O no hydrogen 3.266 N/A ASP 99.A N SER 96.A OG no hydrogen 3.104 N/A ARG 100.A N SER 96.A O no hydrogen 3.022 N/A ARG 100.A NE THR 107.A OG1 no hydrogen 2.945 N/A ARG 100.A NH1 LEU 104.A O no hydrogen 2.945 N/A ARG 100.A NH1 THR 107.A OG1 no hydrogen 3.301 N/A ARG 100.A NH2 ASN 94.A O no hydrogen 2.870 N/A LEU 101.A N LEU 97.A O no hydrogen 2.809 N/A SER 102.A N LEU 98.A O no hydrogen 3.051 N/A SER 102.A OG LEU 98.A O no hydrogen 3.514 N/A SER 102.A OG ASP 99.A O no hydrogen 3.034 N/A CYS 103.A N ARG 100.A O no hydrogen 3.290 N/A CYS 103.A SG ARG 100.A O no hydrogen 3.942 N/A LEU 104.A N ASP 99.A O no hydrogen 3.026 N/A GLY 106.A N CYS 103.A O no hydrogen 3.105 N/A THR 107.A OG1 LEU 104.A O no hydrogen 3.341 N/A TRP 112.A N ASP 239.A OD1 no hydrogen 2.782 N/A TRP 112.A NE1 SER 244.A OG no hydrogen 2.724 N/A HIS 113.A N ASP 239.A OD2 no hydrogen 3.123 N/A MET 114.A N SER 111.A OG no hydrogen 3.025 N/A ARG 115.A N SER 111.A O no hydrogen 2.953 N/A ARG 115.A NE LEU 110.A O no hydrogen 2.896 N/A ARG 115.A NH1 ILE 199.A O no hydrogen 2.819 N/A ARG 115.A NH1 ASP 234.A OD2 no hydrogen 2.859 N/A ARG 115.A NH2 LEU 110.A O no hydrogen 2.985 N/A ARG 115.A NH2 ASP 234.A OD2 no hydrogen 2.962 N/A CYS 116.A N TRP 112.A O no hydrogen 2.921 N/A CYS 116.A SG TRP 112.A O no hydrogen 3.389 N/A LYS 117.A N HIS 113.A O no hydrogen 3.243 N/A ILE 118.A N MET 114.A O no hydrogen 2.910 N/A ALA 119.A N ARG 115.A O no hydrogen 2.959 N/A GLN 120.A N CYS 116.A O no hydrogen 3.025 N/A GLY 121.A N LYS 117.A O no hydrogen 2.861 N/A ALA 122.A N ILE 118.A O no hydrogen 2.855 N/A ALA 123.A N ALA 119.A O no hydrogen 3.013 N/A ASN 124.A N GLN 120.A O no hydrogen 2.984 N/A GLY 125.A N GLY 121.A O no hydrogen 3.038 N/A ILE 126.A N ALA 122.A O no hydrogen 3.027 N/A ASN 127.A N ALA 123.A O no hydrogen 2.847 N/A PHE 128.A N ASN 124.A O no hydrogen 3.073 N/A LEU 129.A N GLY 125.A O no hydrogen 3.146 N/A HIS 130.A N ILE 126.A O no hydrogen 2.870 N/A HIS 130.A NE2 ASP 188.A OD2 no hydrogen 2.806 N/A GLU 131.A N ASN 127.A O no hydrogen 2.799 N/A ASN 132.A N PHE 128.A O no hydrogen 3.147 N/A ASN 132.A N LEU 129.A O no hydrogen 3.183 N/A ASN 132.A ND2 PHE 128.A O no hydrogen 2.815 N/A HIS 133.A N HIS 130.A O no hydrogen 3.105 N/A HIS 134.A N LEU 129.A O no hydrogen 2.905 N/A HIS 134.A ND1 ASN 132.A O no hydrogen 2.804 N/A ILE 135.A N ARG 161.A O no hydrogen 2.817 N/A HIS 136.A N ASP 188.A OD2 no hydrogen 2.838 N/A HIS 136.A NE2 SER 155.A O no hydrogen 2.742 N/A ARG 137.A N ASP 188.A OD1 no hydrogen 2.992 N/A ARG 137.A NE LEU 159.A O no hydrogen 2.856 N/A ARG 137.A NH2 LEU 159.A O no hydrogen 3.257 N/A ASP 138.A N HIS 136.A ND1 no hydrogen 2.968 N/A LYS 140.A NZ THR 170.A OG1 no hydrogen 2.964 N/A SER 141.A OG TYR 173.A OH no hydrogen 3.249 N/A SER 141.A OG GLU 198.A OE1 no hydrogen 3.164 N/A SER 141.A OG GLU 198.A OE2 no hydrogen 2.698 N/A ASN 143.A N LYS 140.A O no hydrogen 2.965 N/A ASN 143.A ND2 ASP 138.A O no hydrogen 2.810 N/A ILE 144.A N SER 141.A O no hydrogen 3.259 N/A LEU 145.A N LYS 153.A O no hydrogen 2.838 N/A LEU 146.A N GLY 95.A O no hydrogen 2.759 N/A ASP 147.A N THR 151.A O no hydrogen 3.212 N/A ALA 149.A N ASP 147.A OD1 no hydrogen 2.887 N/A PHE 150.A N ASP 147.A O no hydrogen 2.948 N/A THR 151.A N ASP 147.A OD1 no hydrogen 2.909 N/A LYS 153.A N LEU 145.A O no hydrogen 2.808 N/A LYS 153.A NZ GLU 73.A O no hydrogen 2.776 N/A ILE 154.A N ASN 74.A O no hydrogen 2.870 N/A SER 155.A N ASN 143.A O no hydrogen 2.813 N/A GLY 158.A N ASP 156.A OD1 no hydrogen 3.441 N/A ALA 160.A N PHE 157.A O no hydrogen 3.283 N/A ARG 161.A N ILE 135.A O no hydrogen 2.967 N/A SER 163.A N HIS 133.A O no hydrogen 2.704 N/A SER 163.A OG HIS 133.A O no hydrogen 3.405 N/A THR 170.A OG1 ASP 138.A OD1 no hydrogen 2.744 N/A TYR 173.A N THR 170.A O no hydrogen 2.939 N/A TYR 173.A OH SER 141.A OG no hydrogen 3.249 N/A TYR 173.A OH GLU 198.A OE1 no hydrogen 2.714 N/A TYR 173.A OH GLU 198.A OE2 no hydrogen 3.135 N/A MET 174.A N THR 171.A O no hydrogen 3.234 N/A GLU 177.A N GLU 177.A OE1 no hydrogen 2.965 N/A LEU 179.A N ALA 175.A O no hydrogen 3.101 N/A ARG 180.A N PRO 176.A O no hydrogen 3.276 N/A ARG 180.A N GLU 177.A O no hydrogen 3.179 N/A GLY 181.A N ALA 178.A O no hydrogen 3.131 N/A GLU 182.A N GLU 177.A O no hydrogen 2.996 N/A ILE 183.A N VAL 164.A O no hydrogen 2.848 N/A LYS 186.A N THR 184.A OG1 no hydrogen 3.215 N/A SER 187.A N THR 184.A O no hydrogen 3.064 N/A SER 187.A OG GLU 177.A OE2 no hydrogen 2.713 N/A ILE 189.A N PRO 185.A O no hydrogen 3.402 N/A TYR 190.A N LYS 186.A O no hydrogen 3.352 N/A SER 191.A N SER 187.A O no hydrogen 3.111 N/A SER 191.A OG TYR 173.A O no hydrogen 2.723 N/A SER 191.A OG SER 187.A O no hydrogen 3.263 N/A PHE 192.A N ASP 188.A O no hydrogen 2.943 N/A GLY 193.A N ILE 189.A O no hydrogen 2.982 N/A VAL 194.A N TYR 190.A O no hydrogen 3.294 N/A VAL 195.A N SER 191.A O no hydrogen 3.131 N/A LEU 196.A N PHE 192.A O no hydrogen 2.882 N/A LEU 197.A N GLY 193.A O no hydrogen 3.077 N/A GLU 198.A N VAL 194.A O no hydrogen 2.930 N/A ILE 199.A N VAL 195.A O no hydrogen 2.907 N/A ILE 200.A N LEU 196.A O no hydrogen 2.960 N/A THR 201.A N LEU 197.A O no hydrogen 2.972 N/A THR 201.A OG1 LEU 197.A O no hydrogen 2.767 N/A GLY 202.A N GLU 198.A O no hydrogen 2.749 N/A LEU 203.A N THR 201.A OG1 no hydrogen 3.104 N/A ASP 207.A N GLN 213.A O no hydrogen 2.924 N/A HIS 209.A N ASP 207.A OD1 no hydrogen 3.113 N/A ARG 210.A NE PRO 212.A O no hydrogen 2.879 N/A ARG 210.A NH1 PRO 204.A O no hydrogen 2.861 N/A ARG 210.A NH2 PRO 204.A O no hydrogen 2.949 N/A ARG 210.A NH2 GLN 213.A O no hydrogen 2.835 N/A GLN 213.A NE2 GLU 208.A O no hydrogen 2.803 N/A LEU 215.A N ALA 205.A O no hydrogen 2.822 N/A ASP 217.A N LEU 214.A O no hydrogen 3.107 N/A ILE 218.A N LEU 215.A O no hydrogen 2.967 N/A LYS 219.A N LEU 216.A O no hydrogen 3.368 N/A LYS 219.A NZ GLU 223.A OE1 no hydrogen 3.335 N/A LYS 219.A NZ GLU 223.A OE2 no hydrogen 3.459 N/A GLU 220.A N ASP 217.A O no hydrogen 3.188 N/A GLU 221.A N ASP 217.A O no hydrogen 3.439 N/A ILE 222.A N ILE 218.A O no hydrogen 2.958 N/A GLU 223.A N LYS 219.A O no hydrogen 2.924 N/A ASP 224.A N GLU 220.A O no hydrogen 2.861 N/A GLU 225.A N ILE 222.A O no hydrogen 3.095 N/A GLU 226.A N GLU 221.A O no hydrogen 2.901 N/A LYS 227.A N GLU 221.A O no hydrogen 3.221 N/A LYS 227.A NZ GLU 226.A O no hydrogen 3.368 N/A THR 228.A N ASP 231.A OD2 no hydrogen 3.103 N/A ASP 231.A N THR 228.A OG1 no hydrogen 3.148 N/A TYR 232.A N ILE 229.A O no hydrogen 2.888 N/A TYR 232.A OH GLU 221.A OE2 no hydrogen 2.669 N/A ILE 233.A N GLU 230.A O no hydrogen 3.389 N/A ASP 234.A N ILE 200.A O no hydrogen 2.904 N/A LYS 236.A N ASP 234.A OD1 no hydrogen 2.959 N/A LYS 236.A NZ ASP 234.A OD1 no hydrogen 2.869 N/A SER 242.A OG GLU 230.A OE2 no hydrogen 2.852 N/A SER 244.A N ASP 241.A OD2 no hydrogen 3.073 N/A SER 244.A OG ASP 241.A O no hydrogen 3.429 N/A SER 244.A OG ASP 241.A OD1 no hydrogen 2.682 N/A VAL 245.A N ASP 241.A O no hydrogen 3.085 N/A GLU 246.A N SER 242.A O no hydrogen 2.859 N/A ALA 247.A N THR 243.A O no hydrogen 2.990 N/A MET 248.A N SER 244.A O no hydrogen 2.891 N/A TYR 249.A N VAL 245.A O no hydrogen 2.840 N/A SER 250.A N GLU 246.A O no hydrogen 2.857 N/A SER 250.A OG GLN 254.A OE1 no hydrogen 3.469 N/A VAL 251.A N ALA 247.A O no hydrogen 3.242 N/A ALA 252.A N MET 248.A O no hydrogen 2.937 N/A SER 253.A N TYR 249.A O no hydrogen 2.786 N/A GLN 254.A N SER 250.A O no hydrogen 3.044 N/A CYS 255.A N VAL 251.A O no hydrogen 2.959 N/A CYS 255.A SG VAL 251.A O no hydrogen 3.284 N/A LEU 256.A N ALA 252.A O no hydrogen 3.000 N/A HIS 257.A N GLN 254.A O no hydrogen 3.326 N/A LYS 259.A N HIS 257.A ND1 no hydrogen 3.119 N/A LYS 260.A NZ GLU 182.A OE1 no hydrogen 2.820 N/A LYS 262.A N LYS 259.A O no hydrogen 2.998 N/A ARG 263.A N LYS 260.A O no hydrogen 3.352 N/A ARG 263.A NE HIS 257.A O no hydrogen 2.725 N/A ARG 263.A NH1 GLU 177.A OE1 no hydrogen 3.470 N/A ARG 263.A NH1 GLU 177.A OE2 no hydrogen 2.761 N/A ARG 263.A NH1 LYS 186.A O no hydrogen 2.936 N/A ARG 263.A NH2 GLU 177.A OE1 no hydrogen 2.864 N/A ARG 263.A NH2 HIS 257.A O no hydrogen 3.276 N/A ARG 263.A NH2 GLU 258.A O no hydrogen 3.333 N/A LYS 267.A NZ GLN 270.A OE1 no hydrogen 3.173 N/A LYS 268.A N ASP 265.A OD1 no hydrogen 2.936 N/A VAL 269.A N ASP 265.A O no hydrogen 3.046 N/A GLN 270.A N ILE 266.A O no hydrogen 2.890 N/A GLN 270.A NE2 ASN 124.A OD1 no hydrogen 2.772 N/A GLN 271.A N LYS 267.A O no hydrogen 3.050 N/A LEU 272.A N LYS 268.A O no hydrogen 2.908 N/A LEU 273.A N VAL 269.A O no hydrogen 2.983 N/A GLN 274.A N GLN 270.A O no hydrogen 2.884 N/A GLU 275.A N GLN 271.A O no hydrogen 2.928 N/A MET 276.A N LEU 272.A O no hydrogen 3.095 N/A THR 277.A N GLN 274.A O no hydrogen 3.271 N/A THR 277.A OG1 GLN 120.A OE1 no hydrogen 2.787 N/A THR 277.A OG1 GLN 274.A O no hydrogen 3.480 N/A