Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6xbp_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A N THR 1.A OG1 no hydrogen 2.785 N/A ARG 2.A NH1 ASP 71.A OD1 no hydrogen 3.454 N/A ARG 2.A NH2 ASP 71.A OD1 no hydrogen 3.461 N/A THR 4.A N GLU 75.A OE1 no hydrogen 2.831 N/A THR 4.A OG1 GLU 75.A OE1 no hydrogen 3.416 N/A THR 4.A OG1 GLU 75.A OE2 no hydrogen 2.696 N/A GLU 6.A N PHE 3.A O no hydrogen 3.357 N/A TYR 7.A N PHE 3.A O no hydrogen 2.950 N/A GLN 8.A N VAL 25.A O no hydrogen 2.835 N/A PHE 10.A N ARG 23.A O no hydrogen 2.860 N/A GLU 11.A N GLU 11.A OE1 no hydrogen 2.732 N/A LEU 13.A N VAL 21.A O no hydrogen 2.616 N/A GLY 14.A N VAL 21.A O no hydrogen 3.147 N/A LYS 15.A NZ GLU 12.A OE2 no hydrogen 3.015 N/A GLY 16.A N SER 19.A O no hydrogen 2.891 N/A VAL 20.A N ILE 37.A O no hydrogen 3.213 N/A VAL 21.A N GLY 14.A O no hydrogen 2.838 N/A ARG 22.A N ALA 35.A O no hydrogen 2.878 N/A ARG 22.A NE PHE 10.A O no hydrogen 2.773 N/A ARG 22.A NH1 PHE 10.A O no hydrogen 2.799 N/A ARG 23.A N GLU 11.A O no hydrogen 2.993 N/A ARG 23.A NE GLU 11.A OE1 no hydrogen 3.362 N/A ARG 23.A NE GLU 11.A OE2 no hydrogen 2.993 N/A ARG 23.A NH1 GLU 32.A OE1 no hydrogen 2.924 N/A ARG 23.A NH2 GLU 11.A OE1 no hydrogen 3.042 N/A CYS 24.A N TYR 33.A O no hydrogen 2.814 N/A CYS 24.A SG TYR 33.A O no hydrogen 3.751 N/A VAL 25.A N GLN 8.A O no hydrogen 2.968 N/A LYS 26.A N GLN 31.A O no hydrogen 2.697 N/A LYS 26.A NZ HIS 70.A NE2 no hydrogen 2.871 N/A VAL 27.A N GLU 6.A O no hydrogen 2.932 N/A ALA 29.A N LYS 26.A O no hydrogen 3.055 N/A GLY 30.A N VAL 27.A O no hydrogen 3.364 N/A GLN 31.A N LYS 26.A O no hydrogen 3.478 N/A TYR 33.A N CYS 24.A O no hydrogen 2.853 N/A TYR 33.A OH GLN 31.A OE1 no hydrogen 2.565 N/A ALA 34.A N PHE 83.A O no hydrogen 2.915 N/A ALA 35.A N ARG 22.A O no hydrogen 2.740 N/A LYS 36.A N LEU 81.A O no hydrogen 2.845 N/A LYS 36.A NZ GLU 54.A OE1 no hydrogen 2.586 N/A LYS 36.A NZ GLU 54.A OE2 no hydrogen 3.232 N/A ILE 37.A N VAL 20.A O no hydrogen 2.906 N/A ILE 38.A N HIS 79.A O no hydrogen 2.787 N/A ASN 39.A N PHE 18.A O no hydrogen 2.963 N/A THR 40.A N GLY 77.A O no hydrogen 3.006 N/A LYS 41.A N ASN 39.A OD1 no hydrogen 3.003 N/A LEU 43.A N THR 40.A O no hydrogen 3.291 N/A ASP 47.A N SER 44.A OG no hydrogen 3.152 N/A HIS 48.A N SER 44.A O no hydrogen 3.065 N/A GLN 49.A N ALA 45.A O no hydrogen 3.215 N/A LYS 50.A N ARG 46.A O no hydrogen 3.013 N/A LEU 51.A N ASP 47.A O no hydrogen 3.009 N/A GLU 52.A N HIS 48.A O no hydrogen 3.015 N/A ARG 53.A N GLN 49.A O no hydrogen 2.886 N/A ARG 53.A NH2 GLY 152.A O no hydrogen 3.357 N/A GLU 54.A N LYS 50.A O no hydrogen 2.916 N/A ALA 55.A N LEU 51.A O no hydrogen 2.955 N/A ARG 56.A N GLU 52.A O no hydrogen 2.864 N/A ARG 56.A NE GLU 156.A OE1 no hydrogen 2.669 N/A ARG 56.A NH2 GLU 156.A OE1 no hydrogen 3.279 N/A ARG 56.A NH2 GLU 156.A OE2 no hydrogen 2.752 N/A ILE 57.A N ARG 53.A O no hydrogen 2.898 N/A CYS 58.A N GLU 54.A O no hydrogen 3.013 N/A CYS 58.A SG GLU 54.A O no hydrogen 3.236 N/A ARG 59.A N ALA 55.A O no hydrogen 2.864 N/A LEU 60.A N ARG 56.A O no hydrogen 2.908 N/A LEU 60.A N ILE 57.A O no hydrogen 3.107 N/A ASN 65.A N HIS 63.A ND1 no hydrogen 2.912 N/A ASN 65.A ND2 VAL 146.A O no hydrogen 2.711 N/A ILE 66.A N HIS 63.A O no hydrogen 3.171 N/A VAL 67.A N LEU 148.A O no hydrogen 3.210 N/A HIS 70.A N ILE 82.A O no hydrogen 2.701 N/A ASP 71.A N ILE 82.A O no hydrogen 3.197 N/A SER 72.A N ASP 71.A OD1 no hydrogen 2.888 N/A SER 72.A OG HIS 79.A NE2 no hydrogen 2.670 N/A ILE 73.A N TYR 80.A O no hydrogen 2.874 N/A GLU 75.A N HIS 78.A O no hydrogen 2.872 N/A HIS 79.A N ILE 38.A O no hydrogen 2.966 N/A HIS 79.A NE2 SER 72.A OG no hydrogen 2.670 N/A TYR 80.A N ILE 73.A O no hydrogen 2.830 N/A LEU 81.A N LYS 36.A O no hydrogen 2.898 N/A ILE 82.A N ASP 71.A O no hydrogen 2.877 N/A PHE 83.A N ALA 34.A O no hydrogen 2.762 N/A ASP 84.A N ARG 68.A O no hydrogen 3.157 N/A GLY 88.A N LEU 137.A O no hydrogen 2.960 N/A LEU 91.A N LEU 135.A O no hydrogen 2.636 N/A PHE 92.A N PRO 132.A O no hydrogen 3.145 N/A GLU 93.A N GLU 90.A O no hydrogen 3.131 N/A ILE 95.A N LEU 91.A O no hydrogen 2.993 N/A VAL 96.A N PHE 92.A O no hydrogen 3.186 N/A ALA 97.A N GLU 93.A O no hydrogen 3.157 N/A ARG 98.A N ASP 94.A O no hydrogen 3.072 N/A ARG 98.A NH2 ASP 94.A OD2 no hydrogen 2.956 N/A GLU 99.A N VAL 96.A O no hydrogen 3.215 N/A TYR 101.A N LEU 200.A O no hydrogen 2.873 N/A TYR 101.A OH ASP 94.A OD2 no hydrogen 2.619 N/A ASP 105.A N SER 102.A OG no hydrogen 3.287 N/A ALA 106.A N SER 102.A O no hydrogen 2.778 N/A SER 107.A N GLU 103.A O no hydrogen 2.833 N/A SER 107.A OG TRP 264.A O no hydrogen 2.867 N/A HIS 108.A N ALA 104.A O no hydrogen 3.143 N/A CYS 109.A N ASP 105.A O no hydrogen 2.929 N/A ILE 110.A N ALA 106.A O no hydrogen 2.888 N/A GLN 111.A N SER 107.A O no hydrogen 2.891 N/A GLN 112.A N HIS 108.A O no hydrogen 3.275 N/A ILE 113.A N CYS 109.A O no hydrogen 3.080 N/A LEU 114.A N ILE 110.A O no hydrogen 2.805 N/A GLU 115.A N GLN 111.A O no hydrogen 2.941 N/A ALA 116.A N GLN 112.A O no hydrogen 3.010 N/A VAL 117.A N ILE 113.A O no hydrogen 2.903 N/A LEU 118.A N LEU 114.A O no hydrogen 2.691 N/A HIS 119.A N GLU 115.A O no hydrogen 3.012 N/A CYS 120.A N ALA 116.A O no hydrogen 3.142 N/A CYS 120.A SG ALA 116.A O no hydrogen 3.245 N/A HIS 121.A N VAL 117.A O no hydrogen 2.873 N/A HIS 121.A NE2 ASP 189.A OD2 no hydrogen 2.730 N/A GLN 122.A N LEU 118.A O no hydrogen 2.862 N/A MET 123.A N HIS 119.A O no hydrogen 2.893 N/A MET 123.A N CYS 120.A O no hydrogen 2.926 N/A GLY 124.A N HIS 121.A O no hydrogen 3.104 N/A VAL 125.A N CYS 120.A O no hydrogen 2.830 N/A VAL 126.A N ILE 155.A O no hydrogen 2.981 N/A HIS 127.A N ASP 189.A OD2 no hydrogen 3.067 N/A HIS 127.A NE2 ALA 149.A O no hydrogen 3.084 N/A ARG 128.A N ASP 189.A OD1 no hydrogen 2.896 N/A ARG 128.A NE LEU 153.A O no hydrogen 2.615 N/A ARG 128.A NH1 LEU 153.A O no hydrogen 2.767 N/A ARG 128.A NH2 PHE 165.A O no hydrogen 3.307 N/A ARG 128.A NH2 TYR 184.A OH no hydrogen 3.065 N/A ASN 129.A N HIS 127.A ND1 no hydrogen 3.048 N/A LYS 131.A NZ THR 170.A OG1 no hydrogen 2.856 N/A GLU 133.A N GLU 133.A OE1 no hydrogen 2.999 N/A ASN 134.A N LYS 131.A O no hydrogen 2.868 N/A ASN 134.A ND2 ASN 129.A O no hydrogen 2.741 N/A LEU 135.A N PRO 132.A O no hydrogen 3.316 N/A LEU 136.A N LYS 147.A O no hydrogen 2.853 N/A LEU 137.A N GLY 89.A O no hydrogen 3.098 N/A ALA 138.A N ALA 145.A O no hydrogen 2.822 N/A LYS 142.A N LYS 140.A O no hydrogen 3.006 N/A LYS 142.A NZ ASP 105.A OD2 no hydrogen 3.563 N/A VAL 146.A N GLN 112.A OE1 no hydrogen 2.960 N/A LYS 147.A N LEU 136.A O no hydrogen 2.745 N/A LEU 148.A N ASN 65.A O no hydrogen 2.852 N/A ALA 149.A N ASN 134.A O no hydrogen 2.931 N/A GLY 152.A N ASP 150.A OD1 no hydrogen 3.343 N/A ALA 154.A N PHE 151.A O no hydrogen 3.142 N/A ILE 155.A N VAL 126.A O no hydrogen 2.913 N/A VAL 157.A N GLY 124.A O no hydrogen 2.770 N/A GLN 161.A N GLU 158.A O no hydrogen 3.208 N/A ALA 163.A N TYR 184.A O no hydrogen 3.400 N/A THR 170.A OG1 ASN 129.A OD1 no hydrogen 2.442 N/A TYR 173.A N THR 170.A O no hydrogen 2.906 N/A LEU 174.A N PRO 171.A O no hydrogen 3.391 N/A GLU 177.A N GLU 177.A OE2 no hydrogen 2.922 N/A LEU 179.A N SER 175.A O no hydrogen 3.235 N/A ARG 180.A N PRO 176.A O no hydrogen 2.851 N/A ARG 180.A NE ASP 182.A OD2 no hydrogen 2.878 N/A ARG 180.A NH2 ASP 182.A OD2 no hydrogen 3.462 N/A LYS 181.A N VAL 178.A O no hydrogen 3.085 N/A ASP 182.A N GLU 177.A O no hydrogen 2.922 N/A TYR 184.A N ALA 163.A O no hydrogen 3.180 N/A TYR 184.A OH GLY 166.A O no hydrogen 2.344 N/A LYS 186.A NZ HIS 121.A O no hydrogen 3.174 N/A LYS 186.A NZ GLY 159.A O no hydrogen 3.431 N/A LYS 186.A NZ GLU 160.A OE1 no hydrogen 3.190 N/A LYS 186.A NZ GLU 160.A OE2 no hydrogen 3.339 N/A VAL 188.A N GLY 185.A O no hydrogen 3.258 N/A ASP 189.A N LYS 186.A O no hydrogen 3.087 N/A TRP 191.A N PRO 187.A O no hydrogen 3.127 N/A ALA 192.A N VAL 188.A O no hydrogen 3.232 N/A CYS 193.A N ASP 189.A O no hydrogen 3.017 N/A CYS 193.A SG ASP 189.A O no hydrogen 3.415 N/A GLY 194.A N LEU 190.A O no hydrogen 3.064 N/A VAL 195.A N TRP 191.A O no hydrogen 3.245 N/A ILE 196.A N ALA 192.A O no hydrogen 2.926 N/A LEU 197.A N CYS 193.A O no hydrogen 2.724 N/A TYR 198.A N GLY 194.A O no hydrogen 2.957 N/A TYR 198.A OH ASP 225.A O no hydrogen 2.764 N/A ILE 199.A N VAL 195.A O no hydrogen 3.100 N/A LEU 200.A N ILE 196.A O no hydrogen 2.858 N/A LEU 201.A N LEU 197.A O no hydrogen 3.115 N/A LEU 201.A N TYR 198.A O no hydrogen 3.097 N/A VAL 202.A N TYR 198.A O no hydrogen 3.306 N/A GLY 203.A N ILE 199.A O no hydrogen 2.728 N/A ASP 211.A N ASP 209.A OD1 no hydrogen 3.216 N/A ARG 214.A N ASP 211.A OD1 no hydrogen 3.363 N/A ARG 214.A NH1 ASP 209.A OD2 no hydrogen 3.313 N/A LEU 215.A N ASP 211.A O no hydrogen 2.979 N/A TYR 216.A N GLN 212.A O no hydrogen 2.939 N/A LYS 217.A N HIS 213.A O no hydrogen 3.068 N/A LYS 217.A NZ GLN 218.A OE1 no hydrogen 3.180 N/A GLN 218.A N ARG 214.A O no hydrogen 3.004 N/A ILE 219.A N LEU 215.A O no hydrogen 3.016 N/A LYS 220.A N TYR 216.A O no hydrogen 2.932 N/A ALA 221.A N LYS 217.A O no hydrogen 3.189 N/A GLY 222.A N ILE 219.A O no hydrogen 2.806 N/A ALA 223.A N GLN 218.A O no hydrogen 2.866 N/A TYR 224.A OH ASN 243.A OD1 no hydrogen 3.102 N/A TYR 224.A OH LEU 246.A O no hydrogen 2.836 N/A SER 228.A OG ASP 232.A OD1 no hydrogen 2.464 N/A SER 228.A OG ASP 232.A OD2 no hydrogen 3.317 N/A TRP 231.A N PRO 227.A O no hydrogen 3.213 N/A ASP 232.A N PRO 229.A O no hydrogen 3.075 N/A VAL 234.A N TRP 231.A O no hydrogen 3.405 N/A THR 235.A N GLU 103.A OE2 no hydrogen 2.828 N/A THR 235.A OG1 GLU 103.A OE1 no hydrogen 2.620 N/A ALA 238.A N THR 235.A OG1 no hydrogen 3.227 N/A LYS 239.A N THR 235.A O no hydrogen 3.321 N/A ASP 240.A N PRO 236.A O no hydrogen 2.907 N/A LEU 241.A N GLU 237.A O no hydrogen 3.240 N/A ILE 242.A N ALA 238.A O no hydrogen 3.142 N/A ASN 243.A N LYS 239.A O no hydrogen 2.909 N/A LYS 244.A N ASP 240.A O no hydrogen 2.947 N/A LYS 244.A NZ ASP 240.A OD1 no hydrogen 3.336 N/A LYS 244.A NZ ASP 240.A OD2 no hydrogen 2.719 N/A MET 245.A N LEU 241.A O no hydrogen 2.984 N/A LEU 246.A N ILE 242.A O no hydrogen 2.706 N/A THR 247.A OG1 ASN 243.A O no hydrogen 2.893 N/A THR 247.A OG1 LYS 244.A O no hydrogen 3.215 N/A SER 251.A N ASN 249.A OD1 no hydrogen 2.931 N/A SER 251.A OG ASN 249.A OD1 no hydrogen 3.137 N/A LYS 252.A N ASN 249.A O no hydrogen 3.117 N/A ARG 253.A NE THR 247.A O no hydrogen 2.887 N/A ARG 253.A NH1 GLU 177.A OE1 no hydrogen 2.756 N/A ARG 253.A NH1 GLU 177.A OE2 no hydrogen 3.461 N/A ARG 253.A NH1 PRO 187.A O no hydrogen 2.831 N/A ARG 253.A NH2 GLU 177.A OE2 no hydrogen 2.861 N/A ARG 253.A NH2 THR 247.A O no hydrogen 3.121 N/A ARG 253.A NH2 ILE 248.A O no hydrogen 2.957 N/A ILE 254.A N LYS 244.A O no hydrogen 3.106 N/A THR 255.A N GLU 258.A OE1 no hydrogen 3.112 N/A GLU 258.A N THR 255.A OG1 no hydrogen 3.172 N/A ALA 259.A N THR 255.A O no hydrogen 2.838 N/A LEU 260.A N ALA 256.A O no hydrogen 3.091 N/A LYS 261.A N GLU 258.A O no hydrogen 2.926 N/A HIS 262.A N ALA 259.A O no hydrogen 3.050 N/A HIS 262.A NE2 ASP 240.A OD2 no hydrogen 2.646 N/A TRP 264.A N HIS 262.A ND1 no hydrogen 3.265 N/A TRP 264.A NE1 GLU 103.A OE1 no hydrogen 2.912 N/A ILE 265.A N HIS 262.A O no hydrogen 2.831 N/A SER 266.A N HIS 262.A O no hydrogen 2.987 N/A SER 266.A OG LYS 261.A O no hydrogen 3.256 N/A SER 266.A OG HIS 262.A O no hydrogen 3.322 N/A HIS 267.A N PRO 263.A O no hydrogen 3.232 N/A ARG 268.A NE TRP 264.A O no hydrogen 3.449 N/A ARG 268.A NH2 TRP 264.A O no hydrogen 2.973 N/A