Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3i0e_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 9.A N LYS 6.A O no hydrogen 2.993 N/A ARG 12.A NE ASP 14.A OD2 no hydrogen 2.826 N/A ARG 12.A NH1 GLU 28.A O no hydrogen 2.930 N/A ARG 12.A NH2 ASP 14.A OD1 no hydrogen 2.916 N/A ARG 12.A NH2 ASP 14.A OD2 no hydrogen 3.254 N/A ARG 12.A NH2 VAL 263.A O no hydrogen 2.948 N/A THR 19.A N ALA 23.A O no hydrogen 2.807 N/A THR 19.A OG1 ALA 23.A O no hydrogen 3.535 N/A TRP 21.A N THR 19.A OG1 no hydrogen 3.210 N/A TRP 21.A NE1 PRO 243.A O no hydrogen 2.821 N/A LEU 22.A N THR 19.A O no hydrogen 2.842 N/A ALA 23.A N THR 19.A OG1 no hydrogen 3.085 N/A ILE 25.A N VAL 17.A O no hydrogen 2.809 N/A VAL 26.A N VAL 246.A O no hydrogen 2.918 N/A TRP 27.A N THR 30.A OG1 no hydrogen 3.390 N/A TRP 27.A NE1 LEU 16.A O no hydrogen 2.932 N/A GLU 28.A N GLU 250.A OE1 no hydrogen 2.787 N/A GLU 28.A N GLU 250.A OE2 no hydrogen 3.147 N/A THR 30.A N TRP 27.A O no hydrogen 3.096 N/A THR 30.A OG1 TRP 27.A O no hydrogen 2.661 N/A ILE 35.A N ASN 32.A OD1 no hydrogen 3.145 N/A LEU 36.A N ASN 32.A O no hydrogen 3.290 N/A ASN 37.A N ILE 33.A O no hydrogen 2.796 N/A GLU 38.A N ASP 34.A O no hydrogen 3.065 N/A GLN 39.A N ILE 35.A O no hydrogen 3.072 N/A PHE 40.A N LEU 36.A O no hydrogen 2.864 N/A ARG 41.A N ASN 37.A O no hydrogen 2.840 N/A ARG 41.A NH2 ASN 44.A OD1 no hydrogen 2.884 N/A LEU 42.A N GLU 38.A O no hydrogen 2.973 N/A GLN 43.A N PHE 40.A O no hydrogen 3.145 N/A ASN 44.A N ARG 41.A O no hydrogen 2.863 N/A THR 45.A N PHE 40.A O no hydrogen 3.267 N/A THR 45.A OG1 PHE 40.A O no hydrogen 2.753 N/A THR 46.A N ASP 133.A OD2 no hydrogen 2.797 N/A ILE 47.A N ARG 77.A O no hydrogen 2.806 N/A GLY 48.A N TYR 134.A O no hydrogen 2.783 N/A LEU 49.A N HIS 79.A O no hydrogen 2.986 N/A THR 50.A N VAL 136.A O no hydrogen 2.824 N/A THR 50.A OG1 VAL 136.A O no hydrogen 3.538 N/A VAL 51.A N TYR 81.A O no hydrogen 3.095 N/A ALA 53.A N PHE 83.A O no hydrogen 2.834 N/A LYS 55.A N ASP 85.A OD1 no hydrogen 2.974 N/A LYS 55.A N ASP 85.A OD2 no hydrogen 3.141 N/A TYR 57.A N ILE 54.A O no hydrogen 3.069 N/A VAL 58.A N LYS 55.A O no hydrogen 3.315 N/A ALA 59.A N LYS 56.A O no hydrogen 3.148 N/A PHE 60.A N TYR 57.A O no hydrogen 2.938 N/A LEU 61.A N VAL 58.A O no hydrogen 3.199 N/A LYS 62.A NZ GLU 66.A OE2 no hydrogen 2.589 N/A PHE 64.A N PHE 60.A O no hydrogen 3.141 N/A LEU 65.A N LEU 61.A O no hydrogen 2.967 N/A GLU 66.A N LYS 62.A O no hydrogen 2.879 N/A THR 67.A N LEU 63.A O no hydrogen 3.046 N/A THR 67.A OG1 LEU 63.A O no hydrogen 2.858 N/A THR 67.A OG1 PHE 64.A O no hydrogen 3.222 N/A ALA 68.A N PHE 64.A O no hydrogen 2.900 N/A GLU 69.A N LEU 65.A O no hydrogen 3.009 N/A LYS 70.A N GLU 66.A O no hydrogen 3.377 N/A HIS 71.A N ALA 68.A O no hydrogen 3.255 N/A PHE 72.A N ALA 68.A O no hydrogen 2.752 N/A MET 73.A N VAL 148.A O no hydrogen 2.820 N/A HIS 76.A N MET 73.A O no hydrogen 3.004 N/A HIS 76.A NE2 ASN 37.A OD1 no hydrogen 2.853 N/A ARG 77.A NH1 GLU 131.A OE1 no hydrogen 3.400 N/A ARG 77.A NH2 GLU 131.A OE1 no hydrogen 3.533 N/A VAL 78.A N GLY 98.A O no hydrogen 3.179 N/A HIS 79.A N ILE 47.A O no hydrogen 2.949 N/A HIS 79.A NE2 SER 102.A OG no hydrogen 2.698 N/A TYR 80.A N GLN 100.A O no hydrogen 2.804 N/A TYR 80.A OH GLU 69.A OE2 no hydrogen 2.471 N/A TYR 81.A N LEU 49.A O no hydrogen 2.739 N/A VAL 82.A N SER 102.A O no hydrogen 2.880 N/A PHE 83.A N VAL 51.A O no hydrogen 2.820 N/A THR 84.A N LEU 104.A O no hydrogen 3.054 N/A THR 84.A OG1 ALA 53.A O no hydrogen 2.722 N/A GLN 86.A N THR 84.A OG1 no hydrogen 3.031 N/A ALA 89.A N GLN 86.A O no hydrogen 2.904 N/A VAL 90.A N PRO 87.A O no hydrogen 3.358 N/A GLY 96.A N GLU 69.A OE1 no hydrogen 2.718 N/A ARG 99.A NE GLU 69.A OE2 no hydrogen 2.808 N/A ARG 99.A NH1 GLU 69.A OE2 no hydrogen 3.498 N/A ARG 99.A NH1 PHE 72.A O no hydrogen 2.904 N/A ARG 99.A NH1 TYR 80.A OH no hydrogen 2.872 N/A ARG 99.A NH2 PHE 72.A O no hydrogen 3.033 N/A ARG 99.A NH2 MET 73.A O no hydrogen 3.362 N/A GLN 100.A N VAL 78.A O no hydrogen 2.967 N/A SER 102.A N TYR 80.A O no hydrogen 2.831 N/A SER 102.A OG HIS 79.A NE2 no hydrogen 2.698 N/A LEU 104.A N VAL 82.A O no hydrogen 2.782 N/A VAL 106.A N THR 84.A O no hydrogen 2.974 N/A SER 113.A N TRP 109.A O no hydrogen 2.938 N/A SER 113.A OG GLU 225.A OE1 no hydrogen 2.739 N/A MET 114.A N GLN 110.A O no hydrogen 2.942 N/A ARG 115.A N VAL 112.A O no hydrogen 3.030 N/A ARG 116.A NE ASP 230.A OD2 no hydrogen 2.678 N/A ARG 116.A NH1 ASP 139.A OD1 no hydrogen 3.105 N/A ARG 116.A NH2 ASP 230.A OD1 no hydrogen 2.718 N/A ARG 116.A NH2 ASP 230.A OD2 no hydrogen 3.342 N/A GLU 118.A N MET 114.A O no hydrogen 2.919 N/A MET 119.A N ARG 115.A O no hydrogen 2.839 N/A ILE 120.A N ARG 116.A O no hydrogen 2.934 N/A SER 121.A N MET 117.A O no hydrogen 2.921 N/A ASP 122.A N GLU 118.A O no hydrogen 3.018 N/A PHE 123.A N MET 119.A O no hydrogen 2.948 N/A SER 124.A N ILE 120.A O no hydrogen 2.751 N/A SER 124.A OG ILE 120.A O no hydrogen 3.185 N/A SER 124.A OG SER 121.A O no hydrogen 2.857 N/A GLU 125.A N ASP 122.A O no hydrogen 3.227 N/A ARG 126.A N PHE 123.A O no hydrogen 2.991 N/A ARG 126.A NE ASP 122.A OD1 no hydrogen 3.004 N/A ARG 126.A NH2 ASP 122.A OD1 no hydrogen 3.192 N/A ARG 126.A NH2 ASP 122.A OD2 no hydrogen 3.542 N/A LEU 129.A N ARG 126.A O no hydrogen 3.206 N/A SER 130.A N ARG 127.A O no hydrogen 2.831 N/A SER 130.A OG ARG 127.A O no hydrogen 3.310 N/A VAL 132.A N LEU 129.A O no hydrogen 2.923 N/A ASP 133.A N THR 46.A O no hydrogen 2.886 N/A TYR 134.A N THR 46.A O no hydrogen 3.219 N/A LEU 135.A N GLY 200.A O no hydrogen 2.858 N/A VAL 136.A N GLY 48.A O no hydrogen 2.792 N/A CYS 137.A N PHE 198.A O no hydrogen 2.752 N/A CYS 137.A SG THR 50.A OG1 no hydrogen 3.342 N/A VAL 138.A N THR 50.A O no hydrogen 3.136 N/A ASP 139.A N ALA 196.A O no hydrogen 3.174 N/A MET 142.A N VAL 140.A O no hydrogen 2.763 N/A GLU 143.A N THR 270.A O no hydrogen 2.907 N/A PHE 144.A N THR 67.A OG1 no hydrogen 2.910 N/A ARG 145.A N ARG 268.A O no hydrogen 2.808 N/A ARG 145.A NH1 GLN 255.A OE1 no hydrogen 3.010 N/A ARG 145.A NH1 THR 270.A OG1 no hydrogen 3.277 N/A ARG 145.A NH2 GLN 255.A OE1 no hydrogen 2.759 N/A ASP 146.A N ARG 268.A O no hydrogen 3.338 N/A HIS 147.A N ASP 146.A OD1 no hydrogen 2.729 N/A HIS 147.A NE2 GLU 151.A OE2 no hydrogen 2.705 N/A VAL 148.A N HIS 71.A O no hydrogen 2.918 N/A GLY 149.A N GLU 151.A OE1 no hydrogen 2.965 N/A GLU 151.A N GLU 151.A OE2 no hydrogen 2.844 N/A ILE 152.A N GLY 149.A O no hydrogen 3.144 N/A LEU 153.A N VAL 150.A O no hydrogen 3.017 N/A THR 154.A OG1 THR 244.A OG1 no hydrogen 2.696 N/A LEU 156.A N THR 244.A OG1 no hydrogen 2.982 N/A PHE 157.A N GLY 199.A O no hydrogen 2.882 N/A THR 159.A OG1 PHE 197.A O no hydrogen 2.795 N/A LEU 160.A N LEU 247.A O no hydrogen 3.028 N/A HIS 161.A N TYR 192.A O no hydrogen 3.026 N/A PHE 164.A N HIS 161.A O no hydrogen 3.211 N/A SER 167.A N PHE 164.A O no hydrogen 2.981 N/A ARG 169.A NE GLY 189.A O no hydrogen 2.766 N/A ARG 169.A NH1 GLY 189.A O no hydrogen 2.918 N/A ALA 171.A N SER 168.A O no hydrogen 3.049 N/A PHE 172.A N ARG 169.A O no hydrogen 2.856 N/A THR 173.A OG1 TYR 192.A OH no hydrogen 3.229 N/A TYR 174.A OH PHE 191.A O no hydrogen 2.815 N/A ARG 176.A NH1 ILE 184.A O no hydrogen 3.061 N/A ARG 176.A NH2 ARG 169.A O no hydrogen 2.892 N/A ARG 176.A NH2 PHE 172.A O no hydrogen 2.827 N/A ARG 177.A N GLU 175.A OE2 no hydrogen 2.836 N/A ARG 177.A NE GLU 175.A OE2 no hydrogen 2.845 N/A ARG 177.A NH2 GLU 175.A OE1 no hydrogen 3.099 N/A ARG 177.A NH2 GLU 225.A O no hydrogen 2.724 N/A SER 180.A N ARG 177.A O no hydrogen 2.998 N/A SER 180.A OG ASP 219.A OD2 no hydrogen 2.652 N/A GLN 181.A N ASP 219.A OD1 no hydrogen 2.830 N/A ALA 182.A N SER 180.A OG no hydrogen 3.055 N/A TYR 183.A N SER 180.A O no hydrogen 3.127 N/A ILE 184.A N GLU 175.A O no hydrogen 3.045 N/A GLU 188.A N PRO 185.A O no hydrogen 2.971 N/A TYR 192.A OH GLU 231.A OE2 no hydrogen 2.669 N/A TYR 193.A N ASN 235.A OD1 no hydrogen 2.720 N/A MET 194.A N THR 159.A O no hydrogen 2.906 N/A GLY 195.A N GLU 231.A OE1 no hydrogen 2.790 N/A PHE 198.A N CYS 137.A O no hydrogen 3.179 N/A GLY 199.A N PHE 157.A O no hydrogen 3.284 N/A GLY 200.A N LEU 135.A O no hydrogen 2.887 N/A SER 201.A N PRO 155.A O no hydrogen 2.814 N/A VAL 202.A N ASP 133.A O no hydrogen 3.232 N/A GLU 204.A N SER 201.A OG no hydrogen 3.167 N/A VAL 205.A N SER 201.A O no hydrogen 2.896 N/A GLN 206.A N VAL 202.A O no hydrogen 2.829 N/A ARG 207.A N GLN 203.A O no hydrogen 3.090 N/A ARG 207.A NH1 GLU 204.A OE2 no hydrogen 2.632 N/A LEU 208.A N GLU 204.A O no hydrogen 2.947 N/A THR 209.A N VAL 205.A O no hydrogen 2.945 N/A THR 209.A OG1 VAL 205.A O no hydrogen 2.756 N/A THR 209.A OG1 GLN 206.A O no hydrogen 3.365 N/A ARG 210.A N GLN 206.A O no hydrogen 2.928 N/A ALA 211.A N ARG 207.A O no hydrogen 2.973 N/A CYS 212.A N LEU 208.A O no hydrogen 2.909 N/A CYS 212.A SG LEU 208.A O no hydrogen 3.462 N/A HIS 213.A N THR 209.A O no hydrogen 2.934 N/A GLN 214.A N ARG 210.A O no hydrogen 2.899 N/A ALA 215.A N ALA 211.A O no hydrogen 2.926 N/A MET 216.A N CYS 212.A O no hydrogen 2.926 N/A MET 217.A N HIS 213.A O no hydrogen 2.906 N/A VAL 218.A N GLN 214.A O no hydrogen 3.165 N/A ASP 219.A N ALA 215.A O no hydrogen 3.053 N/A GLN 220.A N MET 216.A O no hydrogen 2.896 N/A GLN 220.A NE2 ASP 111.A OD1 no hydrogen 3.531 N/A ALA 221.A N MET 217.A O no hydrogen 2.970 N/A ASN 222.A N VAL 218.A O no hydrogen 3.130 N/A GLY 223.A N GLN 220.A O no hydrogen 3.045 N/A ILE 224.A N ASP 219.A O no hydrogen 3.031 N/A VAL 227.A N GLU 175.A OE1 no hydrogen 2.758 N/A TRP 228.A N SER 232.A OG no hydrogen 2.866 N/A HIS 229.A N ALA 226.A O no hydrogen 2.942 N/A SER 232.A N HIS 229.A O no hydrogen 2.953 N/A LEU 234.A N ASP 230.A O no hydrogen 2.785 N/A ASN 235.A N GLU 231.A O no hydrogen 3.075 N/A ASN 235.A ND2 TYR 193.A O no hydrogen 2.844 N/A ASN 235.A ND2 GLU 231.A O no hydrogen 2.959 N/A LYS 236.A N SER 232.A O no hydrogen 3.107 N/A LYS 236.A NZ GLN 181.A O no hydrogen 2.872 N/A LYS 236.A NZ TYR 183.A O no hydrogen 2.814 N/A TYR 237.A N HIS 233.A O no hydrogen 2.814 N/A LEU 238.A N LEU 234.A O no hydrogen 2.885 N/A LEU 239.A N ASN 235.A O no hydrogen 2.966 N/A ARG 240.A N LYS 236.A O no hydrogen 3.260 N/A ARG 240.A NH1 GLU 188.A OE1 no hydrogen 2.769 N/A ARG 240.A NH2 GLU 188.A OE1 no hydrogen 3.472 N/A HIS 241.A N TYR 237.A O no hydrogen 2.708 N/A HIS 241.A ND1 TYR 237.A O no hydrogen 3.227 N/A LYS 242.A NZ ASP 190.A OD2 no hydrogen 2.738 N/A LYS 242.A NZ LEU 239.A O no hydrogen 2.779 N/A THR 244.A N LEU 156.A O no hydrogen 2.679 N/A THR 244.A OG1 THR 154.A OG1 no hydrogen 2.696 N/A THR 244.A OG1 LEU 156.A O no hydrogen 3.150 N/A LYS 245.A N LEU 156.A O no hydrogen 3.291 N/A LYS 245.A NZ GLU 151.A O no hydrogen 2.850 N/A LYS 245.A NZ LEU 153.A O no hydrogen 2.735 N/A VAL 246.A N PRO 24.A O no hydrogen 2.973 N/A LEU 247.A N GLY 158.A O no hydrogen 2.927 N/A SER 248.A N VAL 26.A O no hydrogen 3.193 N/A SER 248.A OG VAL 26.A O no hydrogen 2.756 N/A GLU 250.A N SER 248.A OG no hydrogen 3.377 N/A TYR 251.A N SER 248.A O no hydrogen 2.965 N/A TYR 251.A OH GLU 151.A OE1 no hydrogen 2.625 N/A LEU 252.A N PRO 249.A O no hydrogen 3.013 N/A TRP 253.A N PHE 269.A O no hydrogen 3.059 N/A TRP 253.A NE1 GLY 259.A O no hydrogen 2.790 N/A LEU 257.A N ASP 254.A OD1 no hydrogen 3.043 N/A LEU 258.A N ASP 254.A O no hydrogen 2.971 N/A GLY 259.A N GLN 255.A O no hydrogen 2.766 N/A TRP 260.A NE1 LEU 264.A O no hydrogen 2.646 N/A LEU 264.A N PRO 261.A O no hydrogen 3.041 N/A LYS 266.A NZ ASP 146.A OD1 no hydrogen 3.092 N/A ARG 268.A N GLU 250.A O no hydrogen 2.936 N/A ARG 268.A NE GLU 250.A OE2 no hydrogen 2.872 N/A ARG 268.A NH1 HIS 147.A O no hydrogen 2.952 N/A ARG 268.A NH2 GLU 28.A OE2 no hydrogen 2.784 N/A ARG 268.A NH2 GLU 250.A OE2 no hydrogen 2.955 N/A THR 270.A N GLU 143.A O no hydrogen 2.852 N/A ALA 271.A N TRP 253.A O no hydrogen 2.854 N/A VAL 272.A N ASP 141.A O no hydrogen 3.106 N/A