Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8pqb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 8.A N ASP 6.A OD1 no hydrogen 3.002 N/A THR 8.A OG1 ASP 6.A OD1 no hydrogen 2.790 N/A THR 8.A OG1 ASP 6.A OD2 no hydrogen 3.281 N/A GLN 9.A N ASP 6.A O no hydrogen 2.916 N/A LEU 10.A N PRO 7.A O no hydrogen 3.356 N/A TYR 12.A OH GLU 17.A OE1 no hydrogen 2.667 N/A LYS 15.A N ASP 13.A OD1 no hydrogen 2.987 N/A TRP 16.A N ASP 13.A O no hydrogen 3.238 N/A TRP 16.A NE1 SER 73.A OG no hydrogen 2.824 N/A GLU 17.A N HIS 14.A O no hydrogen 2.969 N/A PHE 18.A N ALA 87.A O no hydrogen 2.962 N/A ARG 20.A NH1 PRO 93.A O no hydrogen 2.808 N/A ARG 20.A NH2 HIS 90.A O no hydrogen 3.514 N/A ARG 20.A NH2 PRO 93.A O no hydrogen 3.069 N/A ARG 22.A N PRO 19.A O no hydrogen 3.081 N/A LEU 23.A N ARG 20.A O no hydrogen 3.226 N/A SER 24.A N THR 41.A O no hydrogen 2.906 N/A GLY 26.A N GLU 39.A O no hydrogen 2.549 N/A LYS 27.A NZ TYR 100.A OH no hydrogen 3.358 N/A LEU 29.A N VAL 37.A O no hydrogen 2.783 N/A GLY 30.A N VAL 37.A O no hydrogen 3.162 N/A GLY 32.A N GLY 35.A O no hydrogen 2.871 N/A LYS 36.A N MET 52.A O no hydrogen 2.908 N/A VAL 37.A N GLY 30.A O no hydrogen 2.869 N/A VAL 38.A N VAL 50.A O no hydrogen 2.960 N/A GLU 39.A N LYS 27.A O no hydrogen 2.866 N/A ALA 40.A N VAL 48.A O no hydrogen 2.843 N/A THR 41.A N SER 24.A O no hydrogen 2.902 N/A ALA 42.A N MET 46.A O no hydrogen 3.066 N/A GLN 43.A N ARG 22.A O no hydrogen 3.079 N/A VAL 48.A N ALA 40.A O no hydrogen 2.868 N/A ALA 49.A N THR 98.A O no hydrogen 3.080 N/A VAL 50.A N VAL 38.A O no hydrogen 2.758 N/A LYS 51.A N VAL 96.A O no hydrogen 2.851 N/A LYS 51.A NZ GLU 68.A OE1 no hydrogen 2.833 N/A LYS 51.A NZ GLU 68.A OE2 no hydrogen 3.330 N/A MET 52.A N LYS 36.A O no hydrogen 2.949 N/A LYS 54.A N PHE 34.A O no hydrogen 2.746 N/A LYS 54.A NZ GLY 32.A O no hydrogen 2.867 N/A SER 56.A OG ALA 33.A O no hydrogen 3.529 N/A ALA 57.A N LYS 54.A O no hydrogen 2.904 N/A THR 60.A OG1 GLU 61.A OE1 no hydrogen 2.788 N/A GLU 61.A N GLU 61.A OE1 no hydrogen 2.863 N/A ARG 62.A N HIS 58.A O no hydrogen 3.223 N/A ARG 62.A NH2 LYS 54.A O no hydrogen 3.095 N/A ARG 62.A NH2 ALA 57.A O no hydrogen 3.179 N/A GLU 63.A N SER 59.A O no hydrogen 2.903 N/A ALA 64.A N THR 60.A O no hydrogen 2.950 N/A LEU 65.A N GLU 61.A O no hydrogen 2.942 N/A MET 66.A N ARG 62.A O no hydrogen 3.183 N/A SER 67.A N GLU 63.A O no hydrogen 2.922 N/A SER 67.A OG GLU 63.A O no hydrogen 3.239 N/A GLU 68.A N ALA 64.A O no hydrogen 3.005 N/A LEU 69.A N LEU 65.A O no hydrogen 2.979 N/A LYS 70.A N MET 66.A O no hydrogen 2.875 N/A LYS 70.A NZ LEU 10.A O no hydrogen 2.922 N/A VAL 71.A N SER 67.A O no hydrogen 2.880 N/A LEU 72.A N GLU 68.A O no hydrogen 3.016 N/A SER 73.A N LEU 69.A O no hydrogen 2.933 N/A TYR 74.A N LYS 70.A O no hydrogen 3.101 N/A TYR 74.A OH LYS 146.A O no hydrogen 3.086 N/A LEU 75.A N VAL 71.A O no hydrogen 2.968 N/A HIS 78.A N ASN 83.A OD1 no hydrogen 2.990 N/A ASN 80.A N HIS 78.A ND1 no hydrogen 2.935 N/A ASN 80.A ND2 GLN 135.A OE1 no hydrogen 3.280 N/A ASN 80.A ND2 THR 166.A O no hydrogen 3.094 N/A ILE 81.A N HIS 78.A O no hydrogen 3.264 N/A VAL 82.A N ILE 168.A O no hydrogen 2.893 N/A ASN 83.A N GLU 99.A OE1 no hydrogen 2.986 N/A ASN 83.A ND2 HIS 78.A O no hydrogen 2.908 N/A ASN 83.A ND2 GLU 99.A OE1 no hydrogen 3.166 N/A ASN 83.A ND2 GLU 99.A OE2 no hydrogen 3.457 N/A LEU 85.A N ILE 97.A O no hydrogen 2.737 N/A GLY 86.A N ILE 97.A O no hydrogen 3.170 N/A ALA 87.A N TRP 16.A O no hydrogen 2.911 N/A CYS 88.A N LEU 95.A O no hydrogen 2.883 N/A CYS 88.A SG PHE 18.A O no hydrogen 3.383 N/A THR 89.A N GLU 17.A OE2 no hydrogen 2.781 N/A THR 89.A OG1 GLU 17.A OE1 no hydrogen 2.646 N/A THR 89.A OG1 GLU 17.A OE2 no hydrogen 3.240 N/A HIS 90.A N GLU 17.A OE2 no hydrogen 3.292 N/A LEU 95.A N CYS 88.A O no hydrogen 3.022 N/A VAL 96.A N LYS 51.A O no hydrogen 3.058 N/A ILE 97.A N GLY 86.A O no hydrogen 2.791 N/A THR 98.A N ALA 49.A O no hydrogen 2.826 N/A THR 98.A OG1 GLU 99.A O no hydrogen 3.134 N/A GLU 99.A N ASN 83.A O no hydrogen 2.993 N/A TYR 103.A N LEU 160.A O no hydrogen 2.951 N/A GLY 104.A N CYS 101.A O no hydrogen 3.257 N/A LEU 106.A N ILE 158.A O no hydrogen 2.692 N/A LEU 107.A N ALA 155.A O no hydrogen 3.363 N/A ASN 108.A N ASP 105.A OD2 no hydrogen 2.849 N/A ASN 108.A ND2 ASP 105.A OD1 no hydrogen 2.687 N/A PHE 109.A N ASP 105.A O no hydrogen 3.103 N/A LEU 110.A N LEU 106.A O no hydrogen 2.835 N/A ARG 111.A N LEU 107.A O no hydrogen 3.199 N/A ARG 111.A NE GLY 215.A O no hydrogen 2.637 N/A ARG 111.A NH2 GLY 215.A O no hydrogen 2.873 N/A ARG 112.A N ASN 108.A O no hydrogen 3.116 N/A LYS 113.A N LEU 110.A O no hydrogen 3.155 N/A LYS 113.A NZ GLU 116.A OE1 no hydrogen 2.682 N/A LYS 113.A NZ ASP 122.A O no hydrogen 2.827 N/A ARG 114.A NE LEU 214.A O no hydrogen 2.966 N/A ARG 114.A NH2 LEU 214.A O no hydrogen 3.004 N/A GLU 116.A N LYS 113.A O no hydrogen 2.918 N/A VAL 118.A N LEU 124.A O no hydrogen 3.055 N/A LEU 124.A N GLU 116.A O no hydrogen 2.859 N/A THR 125.A N HIS 128.A ND1 no hydrogen 2.996 N/A THR 125.A OG1 HIS 128.A ND1 no hydrogen 3.219 N/A LEU 126.A N TYR 120.A O no hydrogen 3.164 N/A HIS 128.A N THR 125.A OG1 no hydrogen 3.389 N/A LEU 129.A N THR 125.A O no hydrogen 3.236 N/A LEU 130.A N LEU 126.A O no hydrogen 2.913 N/A SER 131.A N GLU 127.A O no hydrogen 2.984 N/A PHE 132.A N HIS 128.A O no hydrogen 2.897 N/A SER 133.A N LEU 129.A O no hydrogen 3.048 N/A SER 133.A OG LEU 130.A O no hydrogen 2.809 N/A TYR 134.A N LEU 130.A O no hydrogen 2.963 N/A TYR 134.A OH GLU 274.A OE2 no hydrogen 3.257 N/A GLN 135.A N SER 131.A O no hydrogen 2.828 N/A GLN 135.A NE2 SER 131.A OG no hydrogen 3.053 N/A GLN 135.A NE2 ASN 164.A O no hydrogen 2.870 N/A VAL 136.A N PHE 132.A O no hydrogen 3.003 N/A ALA 137.A N SER 133.A O no hydrogen 3.133 N/A LYS 138.A N TYR 134.A O no hydrogen 2.867 N/A GLY 139.A N GLN 135.A O no hydrogen 2.884 N/A MET 140.A N VAL 136.A O no hydrogen 2.879 N/A ALA 141.A N ALA 137.A O no hydrogen 2.833 N/A PHE 142.A N LYS 138.A O no hydrogen 2.996 N/A LEU 143.A N GLY 139.A O no hydrogen 3.064 N/A ALA 144.A N MET 140.A O no hydrogen 2.936 N/A SER 145.A N ALA 141.A O no hydrogen 2.896 N/A SER 145.A OG PHE 142.A O no hydrogen 2.711 N/A LYS 146.A N PHE 142.A O no hydrogen 3.157 N/A LYS 146.A N LEU 143.A O no hydrogen 2.977 N/A LYS 146.A NZ LEU 75.A O no hydrogen 3.344 N/A ASN 147.A N ALA 144.A O no hydrogen 2.903 N/A CYS 148.A N LEU 143.A O no hydrogen 2.939 N/A CYS 148.A SG.A ILE 149.A O no hydrogen 3.681 N/A CYS 148.A SG.A ARG 175.A O no hydrogen 3.932 N/A CYS 148.A SG.B LYS 146.A O no hydrogen 3.434 N/A ILE 149.A N ARG 175.A O no hydrogen 2.897 N/A HIS 150.A N ASP 200.A OD2 no hydrogen 2.817 N/A HIS 150.A NE2 CYS 169.A O no hydrogen 2.870 N/A ARG 151.A N ASP 200.A OD1 no hydrogen 3.059 N/A ARG 151.A NE LEU 173.A O no hydrogen 2.788 N/A ARG 151.A NH2 LEU 173.A O no hydrogen 3.222 N/A ASP 152.A N HIS 150.A ND1 no hydrogen 3.036 N/A ALA 155.A N GLU 210.A OE1 no hydrogen 2.907 N/A ARG 156.A NH2 ASP 152.A OD1 no hydrogen 3.128 N/A ASN 157.A N ALA 154.A O no hydrogen 2.828 N/A ASN 157.A ND2 ASP 152.A O no hydrogen 2.867 N/A ILE 158.A N ALA 155.A O no hydrogen 3.249 N/A LEU 159.A N LYS 167.A O no hydrogen 2.794 N/A LEU 160.A N GLY 104.A O no hydrogen 2.879 N/A THR 161.A N ILE 165.A O no hydrogen 2.948 N/A THR 161.A OG1 HIS 162.A ND1 no hydrogen 3.329 N/A HIS 162.A N THR 161.A OG1 no hydrogen 2.769 N/A THR 166.A N GLN 135.A OE1 no hydrogen 2.940 N/A LYS 167.A N LEU 159.A O no hydrogen 2.884 N/A LYS 167.A NZ GLU 79.A O no hydrogen 2.845 N/A LYS 167.A NZ ILE 81.A O no hydrogen 2.941 N/A LYS 167.A NZ GLU 99.A OE1 no hydrogen 2.829 N/A ILE 168.A N ASN 80.A O no hydrogen 2.910 N/A CYS 169.A N ASN 157.A O no hydrogen 2.951 N/A PHE 171.A N GLU 68.A OE2 no hydrogen 3.058 N/A GLY 172.A N ASP 170.A OD1 no hydrogen 3.174 N/A ALA 174.A N PHE 171.A O no hydrogen 3.144 N/A ARG 175.A N ILE 149.A O no hydrogen 2.880 N/A ARG 175.A NE ALA 174.A O no hydrogen 3.205 N/A ILE 177.A N ASN 147.A O no hydrogen 2.831 N/A LYS 183.A NZ PRO 218.A O no hydrogen 3.239 N/A LYS 183.A NZ TYR 219.A O no hydrogen 3.129 N/A LYS 183.A NZ MET 222.A O no hydrogen 2.788 N/A TRP 184.A N PRO 181.A O no hydrogen 2.809 N/A TRP 184.A NE1 GLU 210.A OE1 no hydrogen 2.807 N/A MET 185.A N VAL 182.A O no hydrogen 3.058 N/A GLU 188.A N GLU 188.A OE1 no hydrogen 2.820 N/A SER 189.A N ALA 186.A O no hydrogen 2.993 N/A SER 189.A OG VAL 194.A O no hydrogen 2.691 N/A ILE 190.A N ALA 186.A O no hydrogen 3.069 N/A PHE 191.A N PRO 187.A O no hydrogen 2.798 N/A ASN 192.A N GLU 188.A O no hydrogen 2.913 N/A SER 193.A N SER 189.A O no hydrogen 2.994 N/A VAL 194.A N GLU 188.A O no hydrogen 3.416 N/A THR 196.A N SER 199.A OG no hydrogen 2.868 N/A THR 196.A OG1 GLU 198.A OE1 no hydrogen 2.697 N/A GLU 198.A N GLU 198.A OE1 no hydrogen 2.789 N/A SER 199.A N THR 196.A O no hydrogen 3.130 N/A SER 199.A N THR 196.A OG1 no hydrogen 3.225 N/A SER 199.A OG THR 196.A O no hydrogen 2.983 N/A ASP 200.A N THR 196.A O no hydrogen 3.309 N/A VAL 201.A N PHE 197.A O no hydrogen 3.242 N/A TRP 202.A N GLU 198.A O no hydrogen 3.204 N/A SER 203.A N SER 199.A O no hydrogen 3.228 N/A SER 203.A OG TRP 184.A O no hydrogen 2.740 N/A SER 203.A OG SER 199.A O no hydrogen 3.356 N/A TYR 204.A N ASP 200.A O no hydrogen 2.953 N/A TYR 204.A OH SER 133.A O no hydrogen 2.708 N/A GLY 205.A N VAL 201.A O no hydrogen 3.028 N/A ILE 206.A N TRP 202.A O no hydrogen 3.131 N/A PHE 207.A N SER 203.A O no hydrogen 2.822 N/A LEU 208.A N TYR 204.A O no hydrogen 2.850 N/A TRP 209.A N GLY 205.A O no hydrogen 3.076 N/A TRP 209.A NE1 SER 239.A O no hydrogen 3.018 N/A GLU 210.A N ILE 206.A O no hydrogen 2.958 N/A LEU 211.A N PHE 207.A O no hydrogen 2.788 N/A PHE 212.A N LEU 208.A O no hydrogen 2.943 N/A SER 213.A N GLU 210.A O no hydrogen 3.322 N/A SER 213.A OG TRP 209.A O no hydrogen 2.822 N/A SER 213.A OG GLU 210.A O no hydrogen 3.046 N/A LEU 214.A N LEU 211.A O no hydrogen 3.098 N/A GLY 215.A N GLU 210.A O no hydrogen 2.833 N/A SER 216.A N SER 213.A OG no hydrogen 3.165 N/A SER 216.A OG.A SER 213.A O no hydrogen 3.339 N/A SER 216.A OG.B SER 217.A O no hydrogen 3.333 N/A MET 222.A N TYR 219.A O no hydrogen 3.124 N/A PHE 228.A N ASP 225.A OD1 no hydrogen 2.974 N/A TYR 229.A N ASP 225.A O no hydrogen 3.182 N/A LYS 230.A N SER 226.A O no hydrogen 3.123 N/A MET 231.A N LYS 227.A O no hydrogen 3.025 N/A ILE 232.A N PHE 228.A O no hydrogen 3.037 N/A LYS 233.A N TYR 229.A O no hydrogen 2.974 N/A GLU 234.A N LYS 230.A O no hydrogen 2.865 N/A GLY 235.A N ILE 232.A O no hydrogen 3.138 N/A PHE 236.A N MET 231.A O no hydrogen 2.832 N/A ARG 237.A NE TRP 256.A O no hydrogen 2.750 N/A ARG 237.A NH1 ILE 232.A O no hydrogen 3.056 N/A ARG 237.A NH1 PHE 236.A O no hydrogen 2.890 N/A ARG 237.A NH2 TRP 256.A O no hydrogen 2.998 N/A SER 240.A OG.A PRO 241.A O no hydrogen 3.108 N/A TYR 243.A N PHE 212.A O no hydrogen 3.005 N/A ALA 244.A N PRO 241.A O no hydrogen 3.323 N/A GLU 247.A N GLU 247.A OE1 no hydrogen 2.493 N/A MET 248.A N PRO 245.A O no hydrogen 2.937 N/A TYR 249.A N PRO 245.A O no hydrogen 3.085 N/A TYR 249.A OH MET 238.A O no hydrogen 3.104 N/A ASP 250.A N ALA 246.A O no hydrogen 2.889 N/A ILE 251.A N GLU 247.A O no hydrogen 3.335 N/A MET 252.A N MET 248.A O no hydrogen 3.002 N/A LYS 253.A N TYR 249.A O no hydrogen 2.889 N/A LYS 253.A NZ ASP 250.A OD1 no hydrogen 3.499 N/A THR 254.A N ASP 250.A O no hydrogen 3.211 N/A THR 254.A OG1 ILE 251.A O no hydrogen 2.813 N/A CYS 255.A N ILE 251.A O no hydrogen 2.906 N/A CYS 255.A SG ILE 251.A O no hydrogen 3.272 N/A TRP 256.A N MET 252.A O no hydrogen 3.109 N/A TRP 256.A N LYS 253.A O no hydrogen 3.301 N/A ASP 257.A N THR 254.A O no hydrogen 3.244 N/A ASP 259.A N ASP 257.A OD1 no hydrogen 2.934 N/A ASP 261.A N ASP 259.A OD1 no hydrogen 3.008 N/A LYS 262.A N ASP 259.A O no hydrogen 2.965 N/A ARG 263.A N PRO 260.A O no hydrogen 3.180 N/A ARG 263.A NE ASP 257.A O no hydrogen 2.865 N/A ARG 263.A NH1 GLU 188.A OE2 no hydrogen 2.812 N/A ARG 263.A NH1 GLU 198.A O no hydrogen 3.034 N/A ARG 263.A NH2 GLU 188.A OE1 no hydrogen 2.985 N/A ARG 263.A NH2 ASP 257.A O no hydrogen 2.996 N/A THR 265.A N GLN 268.A OE1 no hydrogen 3.026 N/A GLN 268.A N THR 265.A OG1 no hydrogen 3.077 N/A ILE 269.A N THR 265.A O no hydrogen 2.849 N/A VAL 270.A N PHE 266.A O no hydrogen 2.767 N/A GLN 271.A N LYS 267.A O no hydrogen 3.200 N/A ASP 272.A N GLN 268.A O no hydrogen 2.996 N/A ILE 273.A N ILE 269.A O no hydrogen 2.898 N/A GLU 274.A N VAL 270.A O no hydrogen 2.861 N/A LYS 275.A N GLN 271.A O no hydrogen 3.270 N/A GLN 276.A N ASP 272.A O no hydrogen 3.254 N/A GLN 276.A NE2 ASP 272.A OD1 no hydrogen 3.265 N/A ILE 277.A N ILE 273.A O no hydrogen 2.888 N/A SER 278.A N GLU 274.A O no hydrogen 3.128 N/A SER 278.A OG GLU 274.A O no hydrogen 3.301 N/A GLU 279.A N LYS 275.A O no hydrogen 3.136 N/A SER 280.A N ILE 277.A O no hydrogen 3.204 N/A