Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2xwa_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N ILE 130.A O no hydrogen 2.787 N/A ILE 1.A N ASP 182.A OD2 no hydrogen 2.711 N/A LEU 2.A N ASP 177.A O no hydrogen 2.959 N/A ARG 5.A N HIS 143.A O no hydrogen 3.280 N/A ALA 7.A N LEU 141.A O no hydrogen 2.913 N/A ALA 11.A N GLU 8.A O no hydrogen 3.099 N/A ARG 12.A NE ASP 124.A OD2 no hydrogen 2.762 N/A ARG 12.A NH2 ASP 124.A OD1 no hydrogen 3.374 N/A ARG 12.A NH2 ASP 124.A OD2 no hydrogen 3.410 N/A MET 15.A N ARG 12.A O no hydrogen 2.906 N/A ALA 16.A N GLY 28.A O no hydrogen 2.914 N/A SER 17.A N LEU 54.A O no hydrogen 3.052 N/A SER 17.A OG HIS 24.A ND1 no hydrogen 2.748 N/A VAL 18.A N CYS 26.A O no hydrogen 2.730 N/A GLN 19.A N GLN 52.A O no hydrogen 2.747 N/A GLN 19.A NE2 SER 17.A OG no hydrogen 3.090 N/A LEU 20.A N ALA 23.A O no hydrogen 2.927 N/A ASN 21.A N LYS 50.A O no hydrogen 2.800 N/A ALA 23.A N LEU 20.A O no hydrogen 3.011 N/A HIS 24.A ND1 SER 17.A OG no hydrogen 2.748 N/A HIS 24.A NE2 GLY 181.A O no hydrogen 2.814 N/A LEU 25.A N VAL 18.A O no hydrogen 2.919 N/A CYS 26.A N VAL 18.A O no hydrogen 3.025 N/A CYS 26.A SG LEU 25.A O no hydrogen 3.214 N/A GLY 27.A N SER 183.A O no hydrogen 2.700 N/A VAL 29.A N LEU 37.A O no hydrogen 2.800 N/A LEU 30.A N TYR 14.A O no hydrogen 2.963 N/A VAL 31.A N TRP 35.A O no hydrogen 3.038 N/A ALA 32.A N TRP 35.A O no hydrogen 3.404 N/A GLN 34.A NE2 LEU 95.A O no hydrogen 2.770 N/A TRP 35.A N ALA 32.A O no hydrogen 3.225 N/A VAL 36.A N LEU 93.A O no hydrogen 3.078 N/A LEU 37.A N VAL 29.A O no hydrogen 2.712 N/A SER 38.A N LEU 91.A O no hydrogen 2.818 N/A SER 38.A OG GLY 27.A O no hydrogen 2.588 N/A HIS 41.A N ASP 89.A OD1 no hydrogen 2.926 N/A HIS 41.A ND1 ASP 89.A OD1 no hydrogen 3.023 N/A HIS 41.A ND1 ASP 89.A OD2 no hydrogen 2.629 N/A HIS 41.A NE2 SER 183.A OG no hydrogen 2.991 N/A CYS 42.A N ALA 39.A O no hydrogen 3.287 N/A LEU 43.A N ALA 40.A O no hydrogen 3.204 N/A GLU 44.A N ALA 40.A O no hydrogen 3.094 N/A ALA 46.A N LEU 43.A O no hydrogen 3.110 N/A LYS 50.A N ASN 21.A OD1 no hydrogen 3.005 N/A GLN 52.A N GLN 19.A O no hydrogen 2.864 N/A GLN 52.A NE2 ASP 71.A OD1 no hydrogen 3.123 N/A VAL 53.A N TYR 70.A O no hydrogen 2.869 N/A LEU 54.A N SER 17.A O no hydrogen 2.818 N/A LEU 55.A N ARG 68.A O no hydrogen 2.960 N/A HIS 58.A N GLU 64.A OE1 no hydrogen 3.010 N/A HIS 58.A NE2 ALA 7.A O no hydrogen 3.006 N/A SER 59.A N GLU 64.A OE2 no hydrogen 2.795 N/A SER 59.A OG ASP 139.A OD1 no hydrogen 3.045 N/A SER 59.A OG ASP 139.A OD2 no hydrogen 2.928 N/A LEU 60.A N ASP 139.A O no hydrogen 2.836 N/A SER 61.A N SER 59.A OG no hydrogen 3.234 N/A SER 61.A N ASP 139.A OD1 no hydrogen 3.197 N/A SER 61.A OG ASP 139.A OD1 no hydrogen 2.728 N/A GLN 62.A N SER 59.A OG no hydrogen 2.906 N/A SER 66.A OG GLY 56.A O no hydrogen 2.433 N/A LYS 67.A N GLU 64.A O no hydrogen 3.314 N/A LYS 67.A NZ SER 59.A O no hydrogen 3.073 N/A LYS 67.A NZ LEU 60.A O no hydrogen 3.341 N/A LYS 67.A NZ GLN 62.A O no hydrogen 2.729 N/A ARG 68.A N LEU 55.A O no hydrogen 2.918 N/A ARG 68.A NH1 LEU 69.A O no hydrogen 3.488 N/A ARG 68.A NH2 GLU 97.A OE2 no hydrogen 2.445 N/A TYR 70.A N VAL 53.A O no hydrogen 2.944 N/A LEU 73.A N GLN 94.A O no hydrogen 2.882 N/A VAL 76.A N LEU 92.A O no hydrogen 2.652 N/A HIS 78.A N LEU 90.A O no hydrogen 2.825 N/A ASP 80.A N HIS 78.A ND1 no hydrogen 3.034 N/A SER 81.A N HIS 78.A O no hydrogen 2.833 N/A SER 81.A OG HIS 78.A O no hydrogen 2.701 N/A THR 85.A N GLN 82.A O no hydrogen 3.136 N/A THR 85.A OG1 GLN 82.A O no hydrogen 3.149 N/A HIS 88.A ND1 ASP 80.A O no hydrogen 3.347 N/A LEU 90.A N HIS 88.A O no hydrogen 2.980 N/A LEU 91.A N SER 38.A O no hydrogen 2.960 N/A LEU 92.A N VAL 76.A O no hydrogen 2.764 N/A LEU 93.A N VAL 36.A O no hydrogen 3.030 N/A GLN 94.A N ARG 74.A O no hydrogen 3.109 N/A LEU 95.A N GLN 34.A O no hydrogen 2.971 N/A SER 96.A N ASP 71.A O no hydrogen 2.893 N/A ALA 99.A N GLU 33.A O no hydrogen 2.704 N/A THR 100.A N TYR 70.A OH no hydrogen 3.200 N/A GLY 102.A N VAL 105.A O no hydrogen 2.779 N/A VAL 105.A N GLY 102.A O no hydrogen 3.279 N/A ARG 106.A N PRO 13.A O no hydrogen 3.092 N/A LEU 108.A N LEU 30.A O no hydrogen 2.857 N/A GLN 111.A N LEU 193.A O no hydrogen 3.190 N/A GLN 111.A NE2 GLU 194.A OE2 no hydrogen 2.957 N/A ARG 115.A N VAL 113.A O no hydrogen 2.790 N/A ARG 115.A NH1 GLU 194.A OE2 no hydrogen 2.958 N/A GLY 120.A N VAL 148.A O no hydrogen 2.746 N/A THR 121.A N ALA 118.A O no hydrogen 3.070 N/A THR 121.A OG1 ALA 118.A O no hydrogen 2.552 N/A CYS 123.A N LEU 146.A O no hydrogen 2.881 N/A ASP 124.A N VAL 188.A O no hydrogen 2.673 N/A VAL 125.A N VAL 144.A O no hydrogen 3.062 N/A GLY 127.A N GLN 142.A O no hydrogen 3.010 N/A TRP 128.A NE1 HIS 58.A O no hydrogen 2.908 N/A GLY 129.A N ASP 182.A OD1 no hydrogen 2.729 N/A ILE 130.A N LYS 180.A O no hydrogen 3.011 N/A VAL 131.A N ARG 136.A O no hydrogen 2.860 N/A HIS 133.A NE2 CYS 204.A O no hydrogen 2.387 N/A GLY 135.A N ASN 132.A O no hydrogen 3.228 N/A ARG 136.A N ASN 132.A OD1 no hydrogen 2.976 N/A LEU 141.A N HIS 58.A O no hydrogen 2.958 N/A GLN 142.A N GLY 127.A O no hydrogen 3.075 N/A GLN 142.A NE2 SER 140.A O no hydrogen 3.086 N/A HIS 143.A N ARG 5.A O no hydrogen 2.974 N/A HIS 143.A ND1 ASP 124.A OD1 no hydrogen 2.894 N/A VAL 144.A N VAL 125.A O no hydrogen 3.040 N/A LEU 146.A N CYS 123.A O no hydrogen 2.950 N/A VAL 148.A N THR 121.A O no hydrogen 2.831 N/A LEU 149.A N CYS 170.A O no hydrogen 2.961 N/A ARG 151.A NE THR 165.A O no hydrogen 2.890 N/A ARG 151.A NE LEU 168.A O no hydrogen 3.432 N/A ARG 151.A NH1 ASP 116.A OD2 no hydrogen 2.807 N/A ARG 151.A NH2 ASP 116.A OD1 no hydrogen 2.884 N/A ARG 151.A NH2 ASP 116.A OD2 no hydrogen 3.473 N/A ARG 151.A NH2 LEU 168.A O no hydrogen 3.037 N/A THR 153.A N ASP 150.A OD2 no hydrogen 3.129 N/A THR 153.A OG1 ASP 150.A OD1 no hydrogen 3.016 N/A THR 153.A OG1 ASP 150.A OD2 no hydrogen 2.611 N/A CYS 154.A N ASP 150.A O no hydrogen 3.069 N/A ASN 155.A N ALA 152.A O no hydrogen 3.118 N/A ASN 155.A ND2 ILE 164.A O no hydrogen 3.090 N/A ARG 156.A N THR 153.A O no hydrogen 3.223 N/A HIS 159.A ND1 THR 153.A O no hydrogen 3.146 N/A HIS 160.A N CYS 154.A O no hydrogen 3.241 N/A HIS 160.A NE2 PRO 210.A O no hydrogen 2.873 N/A ASP 161.A N ARG 156.A O no hydrogen 3.199 N/A GLY 162.A N ASN 155.A O no hydrogen 2.899 N/A ILE 164.A N ASN 155.A OD1 no hydrogen 2.925 N/A GLU 166.A N GLU 166.A OE1 no hydrogen 3.050 N/A ARG 167.A N THR 165.A OG1 no hydrogen 3.118 N/A LEU 168.A N THR 165.A O no hydrogen 3.078 N/A MET 169.A N TYR 213.A O no hydrogen 2.831 N/A ALA 171.A N GLY 211.A O no hydrogen 3.026 N/A GLU 172.A N PRO 147.A O no hydrogen 2.880 N/A SER 173.A OG ASN 206.A O no hydrogen 3.063 N/A SER 173.A OG LYS 209.A O no hydrogen 2.496 N/A ARG 175.A N GLY 205.A O no hydrogen 3.175 N/A ARG 175.A NE ASN 174.A O no hydrogen 3.028 N/A ASP 177.A N LEU 2.A O no hydrogen 3.211 N/A SER 178.A N ASP 177.A OD1 no hydrogen 2.650 N/A SER 178.A OG TYR 213.A OH no hydrogen 3.381 N/A CYS 179.A N ASP 182.A OD2 no hydrogen 2.901 N/A CYS 179.A SG ILE 130.A O no hydrogen 3.196 N/A ASP 182.A N CYS 179.A O no hydrogen 2.875 N/A SER 183.A OG HIS 41.A NE2 no hydrogen 2.991 N/A SER 183.A OG THR 198.A O no hydrogen 3.070 N/A GLY 184.A N VAL 197.A O no hydrogen 3.081 N/A GLY 185.A N ASP 182.A O no hydrogen 2.904 N/A LEU 187.A N GLY 195.A O no hydrogen 2.713 N/A VAL 188.A N ASP 124.A O no hydrogen 2.879 N/A CYS 189.A N VAL 192.A O no hydrogen 2.679 N/A VAL 192.A N CYS 189.A O no hydrogen 2.990 N/A LEU 193.A N PRO 109.A O no hydrogen 3.011 N/A GLU 194.A N LEU 187.A O no hydrogen 2.973 N/A GLY 195.A N LEU 187.A O no hydrogen 2.808 N/A VAL 196.A N THR 214.A O no hydrogen 2.965 N/A VAL 197.A N GLY 185.A O no hydrogen 2.940 N/A THR 198.A N ILE 212.A O no hydrogen 3.240 N/A SER 201.A OG SER 178.A O no hydrogen 3.247 N/A SER 201.A OG VAL 203.A O no hydrogen 3.105 N/A GLY 205.A N ASP 177.A OD2 no hydrogen 3.486 N/A LYS 208.A N ASN 206.A OD1 no hydrogen 3.355 N/A LYS 208.A NZ THR 158.A O no hydrogen 2.571 N/A LYS 209.A N ASN 206.A O no hydrogen 2.803 N/A GLY 211.A N ALA 171.A O no hydrogen 3.072 N/A TYR 213.A N MET 169.A O no hydrogen 2.942 N/A TYR 213.A OH SER 178.A OG no hydrogen 3.381 N/A THR 214.A N VAL 196.A O no hydrogen 2.771 N/A ARG 215.A N ARG 167.A O no hydrogen 2.966 N/A ARG 215.A NE GLU 166.A O no hydrogen 3.055 N/A ARG 215.A NH2 ASP 114.A OD1 no hydrogen 2.391 N/A ARG 215.A NH2 GLU 166.A O no hydrogen 3.011 N/A VAL 216.A N GLU 194.A O no hydrogen 2.970 N/A SER 218.A N ARG 215.A O no hydrogen 3.236 N/A TYR 219.A N VAL 216.A O no hydrogen 2.922 N/A ALA 220.A N ALA 217.A O no hydrogen 3.388 N/A ILE 223.A N TYR 219.A O no hydrogen 2.902 N/A ASP 224.A N ALA 220.A O no hydrogen 3.030 N/A SER 225.A N ALA 221.A O no hydrogen 3.177 N/A SER 225.A OG ALA 221.A O no hydrogen 2.917 N/A SER 225.A OG TRP 222.A O no hydrogen 2.719 N/A VAL 226.A N TRP 222.A O no hydrogen 3.117 N/A LEU 227.A N ILE 223.A O no hydrogen 2.986 N/A ALA 228.A N ASP 224.A O no hydrogen 2.903 N/A