Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6ru6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N TYR 7.A O no hydrogen 2.914 N/A GLY 4.A N GLU 68.A OE1 no hydrogen 3.154 N/A ARG 6.A NE ASP 22.A OD1 no hydrogen 2.951 N/A ARG 6.A NH2 ASP 22.A OD1 no hydrogen 3.312 N/A ARG 6.A NH2 ASP 22.A OD2 no hydrogen 3.019 N/A TYR 7.A N VAL 3.A O no hydrogen 3.206 N/A ARG 8.A N THR 21.A O no hydrogen 2.892 N/A LEU 9.A N LEU 1.A O no hydrogen 2.958 N/A GLY 10.A N LEU 19.A O no hydrogen 2.510 N/A LYS 12.A NZ SER 15.A OG no hydrogen 3.092 N/A LYS 12.A NZ ASP 16.A OD2 no hydrogen 3.356 N/A ILE 13.A N ILE 17.A O no hydrogen 2.963 N/A GLY 14.A N ILE 17.A O no hydrogen 3.409 N/A SER 15.A OG ASP 16.A OD1 no hydrogen 2.371 N/A ASP 16.A N LEU 33.A O no hydrogen 3.191 N/A ILE 17.A N GLY 14.A O no hydrogen 2.966 N/A TYR 18.A N ILE 31.A O no hydrogen 2.742 N/A LEU 19.A N ARG 11.A O no hydrogen 2.815 N/A GLY 20.A N VAL 29.A O no hydrogen 3.017 N/A THR 21.A N ARG 8.A O no hydrogen 2.996 N/A THR 21.A OG1 GLU 28.A OE2 no hydrogen 2.718 N/A ASP 22.A N GLU 27.A O no hydrogen 2.865 N/A ILE 23.A N ARG 6.A O no hydrogen 2.750 N/A ALA 24.A N ASP 22.A OD1 no hydrogen 3.204 N/A ALA 25.A N ASP 22.A OD1 no hydrogen 3.269 N/A GLY 26.A N ASP 22.A O no hydrogen 2.730 N/A GLU 27.A N ASP 22.A O no hydrogen 3.361 N/A VAL 29.A N GLY 20.A O no hydrogen 3.012 N/A ALA 30.A N MET 76.A O no hydrogen 2.823 N/A ILE 31.A N TYR 18.A O no hydrogen 2.916 N/A LYS 32.A N MET 74.A O no hydrogen 2.842 N/A LYS 32.A NZ GLU 46.A OE1 no hydrogen 2.789 N/A LYS 32.A NZ GLU 46.A OE2 no hydrogen 3.557 N/A LEU 33.A N ASP 16.A O no hydrogen 2.933 N/A GLU 34.A N ASN 72.A O no hydrogen 2.873 N/A CYS 35.A SG ASP 70.A O no hydrogen 3.784 N/A VAL 36.A N ASP 70.A O no hydrogen 2.984 N/A THR 38.A N CYS 35.A O no hydrogen 3.284 N/A GLN 42.A N GLU 34.A OE2 no hydrogen 2.923 N/A LEU 43.A N GLU 34.A OE2 no hydrogen 2.755 N/A GLU 46.A N GLN 42.A O no hydrogen 2.794 N/A SER 47.A N LEU 43.A O no hydrogen 2.817 N/A SER 47.A OG HIS 44.A O no hydrogen 2.565 N/A LYS 48.A N HIS 44.A O no hydrogen 3.353 N/A ILE 49.A N ILE 45.A O no hydrogen 3.266 N/A TYR 50.A N GLU 46.A O no hydrogen 2.998 N/A LYS 51.A N SER 47.A O no hydrogen 2.981 N/A MET 52.A N LYS 48.A O no hydrogen 3.146 N/A MET 53.A N ILE 49.A O no hydrogen 3.088 N/A MET 53.A N TYR 50.A O no hydrogen 2.971 N/A GLN 54.A N LYS 51.A O no hydrogen 3.455 N/A GLN 54.A NE2 TYR 50.A O no hydrogen 3.196 N/A GLN 54.A NE2 PRO 60.A O no hydrogen 2.799 N/A GLY 56.A N MET 53.A O no hydrogen 3.052 N/A ILE 59.A N GLY 56.A O no hydrogen 3.078 N/A THR 61.A N GLU 77.A OE1 no hydrogen 3.307 N/A ILE 62.A N GLN 54.A OE1 no hydrogen 3.033 N/A ARG 63.A N VAL 75.A O no hydrogen 2.624 N/A ARG 63.A NH2 ASP 22.A OD2 no hydrogen 2.748 N/A TRP 64.A N VAL 75.A O no hydrogen 3.290 N/A GLY 66.A N VAL 73.A O no hydrogen 3.083 N/A GLU 68.A N TYR 71.A O no hydrogen 2.743 N/A TYR 71.A N GLU 68.A O no hydrogen 2.978 N/A ASN 72.A N GLU 34.A O no hydrogen 2.632 N/A VAL 73.A N GLY 66.A O no hydrogen 2.741 N/A MET 74.A N LYS 32.A O no hydrogen 2.859 N/A VAL 75.A N TRP 64.A O no hydrogen 2.702 N/A MET 76.A N ALA 30.A O no hydrogen 2.790 N/A GLU 77.A N THR 61.A O no hydrogen 2.925 N/A GLY 80.A N MET 130.A O no hydrogen 2.761 N/A SER 82.A N ASP 85.A OD2 no hydrogen 3.112 N/A LEU 83.A N PHE 128.A O no hydrogen 2.845 N/A ASP 85.A N SER 82.A OG no hydrogen 3.063 N/A LEU 86.A N SER 82.A O no hydrogen 2.981 N/A PHE 87.A N LEU 83.A O no hydrogen 2.861 N/A ASN 88.A N GLU 84.A O no hydrogen 2.930 N/A PHE 89.A N ASP 85.A O no hydrogen 2.953 N/A CYS 90.A N PHE 87.A O no hydrogen 3.138 N/A CYS 90.A SG LEU 86.A O no hydrogen 3.209 N/A SER 91.A N ASN 88.A O no hydrogen 3.136 N/A ARG 92.A N PHE 87.A O no hydrogen 2.678 N/A ARG 92.A NH1 TYR 199.A OH no hydrogen 2.575 N/A ARG 92.A NH1 GLY 203.A O no hydrogen 3.212 N/A ARG 92.A NH2 GLU 84.A OE2 no hydrogen 2.957 N/A ARG 92.A NH2 ASN 88.A OD1 no hydrogen 2.699 N/A SER 95.A N ASP 283.A OD2 no hydrogen 2.610 N/A SER 95.A OG ASP 283.A OD1 no hydrogen 2.702 N/A SER 95.A OG ASP 283.A OD2 no hydrogen 3.294 N/A LYS 97.A NZ ASP 279.A OD1 no hydrogen 2.848 N/A LYS 97.A NZ ASP 279.A OD2 no hydrogen 3.374 N/A THR 98.A N SER 95.A OG no hydrogen 3.292 N/A VAL 99.A N SER 95.A O no hydrogen 3.133 N/A LEU 100.A N LEU 96.A O no hydrogen 3.060 N/A LEU 101.A N LYS 97.A O no hydrogen 2.955 N/A LEU 102.A N THR 98.A O no hydrogen 3.024 N/A ALA 103.A N VAL 99.A O no hydrogen 2.741 N/A ASP 104.A N LEU 100.A O no hydrogen 2.967 N/A GLN 105.A NE2 ASN 137.A O no hydrogen 2.907 N/A MET 106.A N LEU 102.A O no hydrogen 2.961 N/A ILE 107.A N ALA 103.A O no hydrogen 3.058 N/A SER 108.A N ASP 104.A O no hydrogen 3.441 N/A SER 108.A OG ASP 104.A O no hydrogen 3.132 N/A ARG 109.A N GLN 105.A O no hydrogen 2.855 N/A ARG 109.A NH2 GLN 105.A OE1 no hydrogen 3.020 N/A ARG 109.A NH2 VAL 139.A O no hydrogen 2.721 N/A ILE 110.A N MET 106.A O no hydrogen 3.174 N/A GLU 111.A N ILE 107.A O no hydrogen 2.895 N/A TYR 112.A N SER 108.A O no hydrogen 2.966 N/A TYR 112.A OH MET 53.A O no hydrogen 2.845 N/A ILE 113.A N ARG 109.A O no hydrogen 3.060 N/A HIS 114.A N ILE 110.A O no hydrogen 2.994 N/A HIS 114.A ND1 TYR 260.A OH no hydrogen 2.725 N/A HIS 114.A NE2 ASP 189.A OD2 no hydrogen 2.656 N/A SER 115.A N GLU 111.A O no hydrogen 2.873 N/A SER 115.A OG TYR 112.A O no hydrogen 2.541 N/A LYS 116.A N ILE 113.A O no hydrogen 3.028 N/A ASN 117.A N HIS 114.A O no hydrogen 2.856 N/A PHE 118.A N ILE 113.A O no hydrogen 3.328 N/A ILE 119.A N LYS 148.A O no hydrogen 2.850 N/A HIS 120.A N ASP 189.A OD2 no hydrogen 2.873 N/A HIS 120.A NE2 ILE 142.A O no hydrogen 2.950 N/A ARG 121.A N ASP 189.A OD1 no hydrogen 2.959 N/A ARG 121.A NE LEU 146.A O no hydrogen 2.695 N/A ARG 121.A NH2 LEU 146.A O no hydrogen 2.967 N/A ASP 122.A N HIS 120.A ND1 no hydrogen 3.096 N/A LYS 124.A NZ THR 170.A OG1 no hydrogen 3.022 N/A ASN 127.A N LYS 124.A O no hydrogen 3.049 N/A ASN 127.A ND2 ASP 122.A O no hydrogen 2.881 N/A ASN 127.A ND2 ASP 122.A OD2 no hydrogen 2.886 N/A ASN 127.A ND2 ASP 143.A OD2 no hydrogen 3.273 N/A LEU 129.A N TYR 140.A O no hydrogen 2.991 N/A MET 130.A N PRO 81.A O no hydrogen 2.993 N/A GLY 131.A N LEU 138.A O no hydrogen 2.888 N/A LYS 135.A N LEU 132.A O no hydrogen 3.103 N/A GLY 136.A N GLY 133.A O no hydrogen 3.108 N/A LEU 138.A N LYS 135.A O no hydrogen 3.008 N/A VAL 139.A N GLN 105.A OE1 no hydrogen 2.918 N/A TYR 140.A N LEU 129.A O no hydrogen 2.793 N/A ILE 141.A N GLY 58.A O no hydrogen 3.081 N/A ILE 142.A N ASN 127.A O no hydrogen 2.953 N/A ASP 143.A N TYR 50.A OH no hydrogen 3.220 N/A PHE 144.A N GLU 46.A OE2 no hydrogen 3.058 N/A ALA 147.A N PHE 144.A O no hydrogen 3.336 N/A LYS 148.A N ILE 119.A O no hydrogen 3.087 N/A LYS 148.A NZ GLU 183.A OE2 no hydrogen 3.070 N/A TYR 150.A N ASN 117.A O no hydrogen 3.215 N/A TYR 150.A OH HIS 114.A O no hydrogen 2.730 N/A ARG 151.A NE ASN 117.A OD1 no hydrogen 2.717 N/A ARG 151.A NH2 SER 115.A O no hydrogen 3.395 N/A ARG 151.A NH2 ASN 117.A OD1 no hydrogen 3.235 N/A ASP 152.A N GLN 157.A O no hydrogen 2.873 N/A ARG 154.A N ASP 152.A OD1 no hydrogen 2.613 N/A THR 155.A N ASP 152.A OD1 no hydrogen 3.084 N/A HIS 156.A N ASP 152.A O no hydrogen 2.999 N/A GLN 157.A N THR 155.A OG1 no hydrogen 3.024 N/A HIS 158.A ND1 ILE 159.A O no hydrogen 2.775 N/A ILE 159.A N TYR 150.A O no hydrogen 2.677 N/A LYS 165.A N GLY 181.A O no hydrogen 2.718 N/A LYS 165.A NZ GLU 183.A OE1 no hydrogen 2.848 N/A THR 168.A OG1 ASN 166.A O no hydrogen 3.204 N/A THR 170.A OG1 ASP 122.A OD1 no hydrogen 2.891 N/A ARG 172.A NH2 TYR 173.A OH no hydrogen 3.187 N/A TYR 173.A N THR 170.A O no hydrogen 3.244 N/A SER 175.A OG THR 178.A OG1 no hydrogen 2.866 N/A SER 175.A OG ASP 188.A OD1 no hydrogen 2.529 N/A ILE 176.A N GLU 191.A OE2 no hydrogen 2.984 N/A THR 178.A N SER 175.A O no hydrogen 3.029 N/A THR 178.A N SER 175.A OG no hydrogen 2.969 N/A THR 178.A OG1 SER 175.A OG no hydrogen 2.866 N/A HIS 179.A N SER 175.A O no hydrogen 3.186 N/A LEU 180.A N ILE 176.A O no hydrogen 2.996 N/A GLY 181.A N THR 178.A O no hydrogen 2.907 N/A ILE 182.A N ASN 177.A O no hydrogen 2.937 N/A GLU 183.A N ARG 162.A O no hydrogen 3.039 N/A SER 185.A N ASP 188.A OD2 no hydrogen 2.897 N/A SER 185.A OG PHE 254.A O no hydrogen 2.629 N/A ARG 186.A NH2 ASP 255.A O no hydrogen 3.050 N/A ARG 187.A NH2 LEU 252.A O no hydrogen 2.899 N/A ASP 188.A N SER 185.A O no hydrogen 3.156 N/A LEU 190.A N ARG 186.A O no hydrogen 3.423 N/A GLU 191.A N ARG 187.A O no hydrogen 2.810 N/A SER 192.A N ASP 188.A O no hydrogen 2.964 N/A SER 192.A OG TYR 173.A O no hydrogen 2.604 N/A SER 192.A OG ASP 188.A O no hydrogen 3.157 N/A LEU 193.A N ASP 189.A O no hydrogen 3.214 N/A GLY 194.A N LEU 190.A O no hydrogen 3.055 N/A TYR 195.A N GLU 191.A O no hydrogen 3.206 N/A TYR 195.A OH GLU 191.A OE2 no hydrogen 2.681 N/A VAL 196.A N SER 192.A O no hydrogen 2.917 N/A LEU 197.A N LEU 193.A O no hydrogen 2.800 N/A MET 198.A N GLY 194.A O no hydrogen 3.229 N/A TYR 199.A N TYR 195.A O no hydrogen 2.851 N/A TYR 199.A OH GLU 84.A OE1 no hydrogen 2.741 N/A TYR 199.A OH GLU 84.A OE2 no hydrogen 3.020 N/A PHE 200.A N VAL 196.A O no hydrogen 3.003 N/A ASN 201.A N LEU 197.A O no hydrogen 3.058 N/A LEU 202.A N MET 198.A O no hydrogen 2.926 N/A LEU 202.A N TYR 199.A O no hydrogen 3.332 N/A GLY 203.A N TYR 199.A O no hydrogen 2.814 N/A LEU 205.A N GLN 208.A OE1 no hydrogen 2.833 N/A TRP 207.A NE1 ARG 172.A O no hydrogen 2.646 N/A GLN 208.A N LEU 205.A O no hydrogen 3.052 N/A GLN 217.A N THR 214.A OG1 no hydrogen 2.740 N/A LYS 218.A NZ LEU 210.A O no hydrogen 2.874 N/A TYR 219.A N LYS 215.A O no hydrogen 3.192 N/A GLU 220.A N ARG 216.A O no hydrogen 3.158 N/A ARG 221.A N GLN 217.A O no hydrogen 3.242 N/A ARG 221.A NE LYS 211.A O no hydrogen 2.986 N/A ARG 221.A NH2 LYS 211.A O no hydrogen 3.515 N/A ILE 222.A N LYS 218.A O no hydrogen 2.935 N/A SER 223.A N TYR 219.A O no hydrogen 2.868 N/A GLU 224.A N GLU 220.A O no hydrogen 2.998 N/A LYS 225.A N ARG 221.A O no hydrogen 3.025 N/A LYS 226.A N ILE 222.A O no hydrogen 2.951 N/A LYS 226.A NZ ALA 171.A O no hydrogen 2.822 N/A LYS 226.A NZ ARG 172.A O no hydrogen 3.387 N/A LYS 226.A NZ ALA 174.A O no hydrogen 2.756 N/A LYS 226.A NZ HIS 179.A NE2 no hydrogen 2.949 N/A MET 227.A N SER 223.A O no hydrogen 3.061 N/A SER 228.A N GLU 224.A O no hydrogen 2.959 N/A SER 228.A N LYS 225.A O no hydrogen 3.333 N/A SER 228.A OG GLU 224.A O no hydrogen 2.968 N/A SER 228.A OG LYS 225.A O no hydrogen 3.306 N/A THR 229.A N LYS 226.A O no hydrogen 3.372 N/A THR 229.A OG1 LYS 225.A O no hydrogen 2.480 N/A VAL 233.A N PRO 230.A O no hydrogen 2.887 N/A LEU 234.A N PRO 230.A O no hydrogen 3.061 N/A CYS 235.A N ILE 231.A O no hydrogen 3.088 N/A CYS 235.A SG ILE 231.A O no hydrogen 3.441 N/A LYS 236.A N VAL 233.A O no hydrogen 3.304 N/A TYR 238.A N CYS 235.A O no hydrogen 3.145 N/A GLU 241.A N GLU 241.A OE2 no hydrogen 2.792 N/A PHE 242.A N PRO 239.A O no hydrogen 3.182 N/A THR 244.A N SER 240.A O no hydrogen 2.960 N/A THR 244.A OG1 SER 240.A O no hydrogen 3.217 N/A TYR 245.A N GLU 241.A O no hydrogen 2.834 N/A TYR 245.A OH LEU 190.A O no hydrogen 2.594 N/A LEU 246.A N PHE 242.A O no hydrogen 3.273 N/A ASN 247.A N ALA 243.A O no hydrogen 2.839 N/A PHE 248.A N THR 244.A O no hydrogen 2.988 N/A CYS 249.A N TYR 245.A O no hydrogen 3.052 N/A CYS 249.A SG TYR 245.A O no hydrogen 3.424 N/A ARG 250.A N LEU 246.A O no hydrogen 3.014 N/A SER 251.A N ASN 247.A O no hydrogen 3.032 N/A SER 251.A N PHE 248.A O no hydrogen 3.072 N/A SER 251.A OG ASN 247.A O no hydrogen 3.057 N/A LEU 252.A N CYS 249.A O no hydrogen 3.310 N/A ARG 253.A N ASP 256.A OD2 no hydrogen 2.698 N/A ARG 253.A NE ASP 256.A OD1 no hydrogen 3.057 N/A ARG 253.A NE ASP 256.A OD2 no hydrogen 3.418 N/A ARG 253.A NH1 ASP 256.A OD1 no hydrogen 3.153 N/A ASP 256.A N ARG 253.A O no hydrogen 2.954 N/A TYR 260.A OH HIS 114.A ND1 no hydrogen 2.725 N/A TYR 262.A N ASP 259.A OD1 no hydrogen 3.156 N/A LEU 263.A N ASP 259.A O no hydrogen 3.176 N/A ARG 264.A N TYR 260.A O no hydrogen 2.892 N/A ARG 264.A NH1 GLU 111.A OE1 no hydrogen 2.605 N/A ARG 264.A NH2 GLU 111.A OE1 no hydrogen 2.922 N/A GLN 265.A N SER 261.A O no hydrogen 2.880 N/A GLN 265.A NE2 ASN 269.A OD1 no hydrogen 3.010 N/A LEU 266.A N TYR 262.A O no hydrogen 2.883 N/A ARG 268.A N ARG 264.A O no hydrogen 2.998 N/A ARG 268.A NE ASP 104.A OD1 no hydrogen 2.912 N/A ARG 268.A NH1 ASP 104.A OD1 no hydrogen 3.034 N/A ARG 268.A NH1 ASP 104.A OD2 no hydrogen 3.304 N/A ASN 269.A N GLN 265.A O no hydrogen 2.911 N/A LEU 270.A N LEU 266.A O no hydrogen 3.338 N/A PHE 271.A N PHE 267.A O no hydrogen 2.747 N/A HIS 272.A N ARG 268.A O no hydrogen 2.843 N/A ARG 273.A N ASN 269.A O no hydrogen 3.038 N/A ARG 273.A NH1.B GLU 241.A OE1 no hydrogen 2.751 N/A ARG 273.A NH2.B GLU 241.A OE1 no hydrogen 3.189 N/A GLN 274.A N LEU 270.A O no hydrogen 3.101 N/A GLY 275.A N HIS 272.A O no hydrogen 3.035 N/A PHE 276.A N PHE 271.A O no hydrogen 3.208 N/A VAL 281.A N ASP 279.A OD1 no hydrogen 2.903 N/A PHE 282.A N ASN 285.A OD1 no hydrogen 2.917 N/A ASP 283.A N THR 98.A OG1 no hydrogen 2.909 N/A ASN 285.A N PHE 282.A O no hydrogen 2.982 N/A MET 286.A N ASP 283.A O no hydrogen 3.022 N/A LEU 287.A N TRP 284.A O no hydrogen 3.233 N/A