Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2pox_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 4.A N ASP 2.A OD1 no hydrogen 3.230 N/A SER 5.A N ASP 2.A O no hydrogen 3.122 N/A SER 5.A OG ASP 2.A O no hydrogen 2.671 N/A VAL 6.A N PRO 3.A O no hydrogen 3.473 N/A LYS 8.A NZ ASP 112.A OD1.A no hydrogen 3.109 N/A MET 11.A N GLY 34.A O no hydrogen 2.936 N/A LYS 12.A N ASP 112.A O.A no hydrogen 2.673 N/A LYS 12.A N ASP 112.A O.B no hydrogen 2.793 N/A ILE 13.A N GLY 32.A O no hydrogen 2.886 N/A LYS 14.A N TYR 114.A O no hydrogen 2.924 N/A LEU 15.A N GLY 30.A O no hydrogen 2.929 N/A ARG 16.A N TYR 116.A O no hydrogen 3.256 N/A ARG 16.A NE GLU 18.A OE2 no hydrogen 2.791 N/A ARG 16.A NH1 GLU 18.A OE2 no hydrogen 3.196 N/A ARG 16.A NH1 GLU 49.A OE2 no hydrogen 2.874 N/A ARG 16.A NH2 GLU 29.A OE2 no hydrogen 2.878 N/A MET 17.A N ILE 28.A O no hydrogen 2.796 N/A GLU 18.A N ILE 118.A O no hydrogen 3.087 N/A GLY 19.A N PHE 26.A O no hydrogen 2.941 N/A ALA 20.A N PHE 120.A O no hydrogen 2.855 N/A VAL 21.A N HIS 24.A O no hydrogen 3.141 N/A ASN 22.A N GLY 122.A O no hydrogen 2.791 N/A ASN 22.A ND2 PHE 125.A O no hydrogen 3.028 N/A HIS 24.A N VAL 21.A O no hydrogen 3.061 N/A PHE 26.A N GLY 19.A O no hydrogen 2.890 N/A ALA 27.A N GLU 49.A O no hydrogen 3.013 N/A ILE 28.A N MET 17.A O no hydrogen 2.925 N/A GLU 29.A N LYS 46.A O no hydrogen 2.951 N/A GLY 30.A N LEU 15.A O no hydrogen 2.971 N/A VAL 31.A N ASP 44.A O no hydrogen 3.072 N/A GLY 32.A N ILE 13.A O no hydrogen 2.824 N/A LEU 33.A N SER 42.A O no hydrogen 2.932 N/A GLY 34.A N MET 11.A O no hydrogen 2.958 N/A LYS 35.A N LYS 40.A O no hydrogen 2.762 N/A LYS 35.A NZ ASP 10.A OD1 no hydrogen 2.970 N/A GLU 38.A N.A LYS 35.A O no hydrogen 3.106 N/A GLU 38.A N.B LYS 35.A O no hydrogen 3.093 N/A GLY 39.A N LYS 35.A O no hydrogen 2.943 N/A LYS 40.A N LYS 35.A O no hydrogen 3.279 N/A GLN 41.A N GLU 211.A O no hydrogen 2.980 N/A SER 42.A N LEU 33.A O no hydrogen 2.924 N/A MET 43.A N LEU 209.A O no hydrogen 2.859 N/A ASP 44.A N VAL 31.A O no hydrogen 2.829 N/A LEU 45.A N VAL 207.A O no hydrogen 2.790 N/A LYS 46.A N GLU 29.A O no hydrogen 2.842 N/A VAL 47.A N SER 205.A O no hydrogen 3.012 N/A LYS 48.A N ALA 27.A O no hydrogen 2.822 N/A GLU 49.A N ALA 27.A O no hydrogen 3.136 N/A ALA 56.A N VAL 131.A O no hydrogen 2.764 N/A ILE 59.A N ALA 56.A O no hydrogen 3.186 N/A LEU 60.A N TYR 57.A O no hydrogen 2.833 N/A THR 61.A N ASP 58.A O no hydrogen 3.430 N/A THR 61.A OG1 ASP 58.A O no hydrogen 3.196 N/A VAL 63.A N LEU 60.A O no hydrogen 2.945 N/A PHE 64.A N LEU 60.A O no hydrogen 3.211 N/A ASN 65.A ND2 TYR 116.A OH no hydrogen 2.944 N/A ARG 66.A NE GLU 144.A OE1 no hydrogen 2.924 N/A ARG 66.A NH1 GLU 211.A OE2 no hydrogen 3.116 N/A ARG 66.A NH2 GLU 144.A OE1 no hydrogen 2.976 N/A VAL 67.A N ASN 65.A OD1 no hydrogen 3.193 N/A PHE 68.A N ASN 65.A O no hydrogen 3.013 N/A LYS 70.A N ALA 213.A O no hydrogen 2.956 N/A TYR 71.A OH HIS 189.A NE2 no hydrogen 2.754 N/A ILE 75.A N PRO 72.A O no hydrogen 3.183 N/A LYS 80.A N ASP 77.A OD1 no hydrogen 3.261 N/A LYS 80.A NZ PRO 36.A O no hydrogen 3.249 N/A LYS 80.A NZ VAL 67.A O no hydrogen 3.104 N/A LYS 80.A NZ ALA 69.A O no hydrogen 2.885 N/A LYS 80.A NZ ASP 77.A OD2 no hydrogen 3.074 N/A GLN 81.A N ASP 77.A O no hydrogen 3.122 N/A SER 82.A N.A PHE 79.A O no hydrogen 3.256 N/A SER 82.A N.B PHE 79.A O no hydrogen 3.245 N/A SER 82.A OG.A PHE 79.A O no hydrogen 2.820 N/A SER 82.A OG.B TYR 78.A O no hydrogen 2.788 N/A PHE 83.A N LYS 80.A O no hydrogen 3.494 N/A GLU 85.A N GLU 85.A OE1 no hydrogen 2.726 N/A GLY 86.A N SER 82.A O.A no hydrogen 2.795 N/A GLY 86.A N SER 82.A O.B no hydrogen 2.809 N/A TYR 87.A N ILE 107.A O no hydrogen 3.284 N/A TYR 87.A OH ASN 65.A OD1 no hydrogen 2.711 N/A SER 88.A N LYS 178.A O no hydrogen 2.871 N/A TRP 89.A N ASN 105.A O no hydrogen 2.929 N/A GLU 90.A N.A THR 176.A O no hydrogen 2.982 N/A GLU 90.A N.B THR 176.A O no hydrogen 2.989 N/A ARG 91.A N ALA 103.A O no hydrogen 2.820 N/A ARG 91.A NE THR 175.A OG1 no hydrogen 2.962 N/A ARG 91.A NH1 THR 62.A O no hydrogen 2.798 N/A SER 92.A N LYS 174.A O no hydrogen 2.955 N/A MET 93.A N CYS 101.A O no hydrogen 2.740 N/A ASN 94.A N ASP 172.A O no hydrogen 2.953 N/A TYR 95.A N GLY 99.A O no hydrogen 2.860 N/A GLU 96.A N ARG 170.A O.A no hydrogen 2.994 N/A GLU 96.A N ARG 170.A O.B no hydrogen 3.032 N/A GLY 98.A N TYR 95.A O no hydrogen 3.031 N/A ILE 100.A N VAL 123.A O no hydrogen 3.123 N/A CYS 101.A N MET 93.A O no hydrogen 2.940 N/A ASN 102.A N ASP 121.A O no hydrogen 2.927 N/A ALA 103.A N ARG 91.A O no hydrogen 2.864 N/A THR 104.A N ARG 119.A O no hydrogen 3.022 N/A ASN 105.A N TRP 89.A O no hydrogen 2.969 N/A ASP 106.A N GLU 117.A O no hydrogen 2.963 N/A ILE 107.A N TYR 87.A O no hydrogen 2.912 N/A THR 108.A N ILE 115.A O no hydrogen 2.974 N/A THR 108.A OG1 ILE 115.A O no hydrogen 3.480 N/A ASP 110.A N CYS 113.A O.A no hydrogen 2.804 N/A ASP 110.A N CYS 113.A O.B no hydrogen 3.034 N/A CYS 113.A N.A ASP 110.A O no hydrogen 3.000 N/A CYS 113.A N.B ASP 110.A O no hydrogen 2.993 N/A CYS 113.A SG.A ASP 112.A OD1.B no hydrogen 3.160 N/A CYS 113.A SG.B TYR 114.A O no hydrogen 3.504 N/A TYR 114.A N LYS 12.A O no hydrogen 2.836 N/A ILE 115.A N THR 108.A O no hydrogen 2.817 N/A TYR 116.A N LYS 14.A O no hydrogen 2.944 N/A GLU 117.A N ASP 106.A O no hydrogen 2.986 N/A ILE 118.A N ARG 16.A O no hydrogen 2.980 N/A ARG 119.A N THR 104.A O no hydrogen 3.157 N/A ARG 119.A NE ASP 121.A OD1 no hydrogen 3.424 N/A ARG 119.A NE ASP 121.A OD2 no hydrogen 2.750 N/A ARG 119.A NH1 ASP 121.A OD1 no hydrogen 2.781 N/A PHE 120.A N GLU 18.A O no hydrogen 3.023 N/A ASP 121.A N ASN 102.A O no hydrogen 2.915 N/A GLY 122.A N ALA 20.A O no hydrogen 2.943 N/A VAL 123.A N ILE 100.A O no hydrogen 2.983 N/A PHE 125.A N ASN 22.A OD1 no hydrogen 3.257 N/A GLY 129.A N PRO 126.A O no hydrogen 3.118 N/A GLN 133.A N.A GLY 129.A O no hydrogen 3.129 N/A GLN 133.A N.B GLY 129.A O no hydrogen 3.115 N/A LYS 134.A N VAL 131.A O no hydrogen 3.249 N/A LYS 134.A NZ LEU 53.A O no hydrogen 3.082 N/A ARG 135.A N PRO 130.A O no hydrogen 2.816 N/A ARG 135.A NE GLN 133.A OE1.B no hydrogen 2.658 N/A ARG 135.A NH1 ASN 128.A O no hydrogen 2.978 N/A ARG 135.A NH1 GLN 133.A OE1.B no hydrogen 2.987 N/A THR 136.A OG1 ASP 58.A OD2 no hydrogen 2.731 N/A VAL 137.A N SER 162.A O.A no hydrogen 2.861 N/A VAL 137.A N SER 162.A O.B no hydrogen 2.792 N/A TRP 139.A NE1 ASP 58.A O no hydrogen 2.843 N/A GLU 140.A N ALA 160.A O no hydrogen 2.945 N/A SER 142.A N.A HIS 193.A O no hydrogen 3.249 N/A SER 142.A N.B HIS 193.A O no hydrogen 3.233 N/A THR 143.A N SER 142.A OG.A no hydrogen 2.765 N/A THR 143.A OG1 ASP 192.A OD1 no hydrogen 2.734 N/A GLU 144.A N VAL 191.A O no hydrogen 2.817 N/A LYS 145.A N ASP 156.A O no hydrogen 2.734 N/A LEU 146.A N HIS 189.A O no hydrogen 2.755 N/A TYR 147.A N LYS 154.A O no hydrogen 3.028 N/A TYR 147.A OH ASP 156.A OD2 no hydrogen 3.014 N/A ARG 149.A N VAL 152.A O no hydrogen 3.038 N/A VAL 152.A N ARG 149.A O no hydrogen 3.087 N/A LYS 154.A N TYR 147.A O no hydrogen 2.829 N/A LYS 154.A NZ THR 176.A OG1 no hydrogen 3.260 N/A GLY 155.A N THR 175.A O no hydrogen 2.989 N/A ASP 156.A N LYS 145.A O no hydrogen 2.966 N/A VAL 157.A N PHE 173.A O no hydrogen 3.178 N/A MET 159.A N CYS 171.A O no hydrogen 2.784 N/A LEU 161.A N TYR 169.A O no hydrogen 2.895 N/A SER 162.A N.A LYS 138.A O no hydrogen 2.841 N/A SER 162.A N.B LYS 138.A O no hydrogen 2.857 N/A SER 162.A OG.B LYS 138.A O no hydrogen 3.205 N/A LEU 163.A N GLY 167.A O no hydrogen 2.929 N/A GLU 164.A N.A ARG 135.A O no hydrogen 2.780 N/A GLU 164.A N.B ARG 135.A O no hydrogen 2.767 N/A GLY 166.A N LEU 163.A O no hydrogen 3.086 N/A TYR 169.A N LEU 161.A O no hydrogen 2.831 N/A TYR 169.A OH ASP 97.A OD1 no hydrogen 2.556 N/A TYR 169.A OH ASP 97.A OD2 no hydrogen 3.407 N/A ARG 170.A N.A GLU 96.A OE1 no hydrogen 2.776 N/A ARG 170.A N.B GLU 96.A OE1 no hydrogen 2.764 N/A CYS 171.A N MET 159.A O no hydrogen 2.947 N/A ASP 172.A N ASN 94.A O no hydrogen 2.934 N/A PHE 173.A N VAL 157.A O no hydrogen 2.867 N/A LYS 174.A N SER 92.A O no hydrogen 2.972 N/A LYS 174.A NZ ASP 172.A OD2 no hydrogen 2.744 N/A THR 175.A N GLY 155.A O no hydrogen 2.828 N/A THR 176.A N GLU 90.A O.A no hydrogen 2.875 N/A THR 176.A N GLU 90.A O.B no hydrogen 2.872 N/A TYR 177.A N LEU 153.A O no hydrogen 2.935 N/A TYR 177.A OH GLU 144.A OE1 no hydrogen 3.407 N/A TYR 177.A OH GLU 144.A OE2 no hydrogen 2.514 N/A LYS 178.A N SER 88.A O no hydrogen 2.882 N/A LYS 178.A NZ GLU 90.A OE2.A no hydrogen 2.715 N/A LYS 178.A NZ GLU 90.A OE2.B no hydrogen 2.829 N/A ALA 179.A N TYR 78.A OH no hydrogen 2.943 N/A LYS 180.A N GLY 86.A O no hydrogen 3.104 N/A LYS 180.A NZ GLU 85.A O no hydrogen 3.350 N/A LYS 180.A NZ ILE 107.A O no hydrogen 3.391 N/A LYS 181.A NZ GLN 81.A O no hydrogen 3.181 N/A LYS 181.A NZ PHE 83.A O no hydrogen 3.010 N/A LYS 181.A NZ GLU 85.A OE1 no hydrogen 3.030 N/A TYR 188.A N ASP 187.A OD1.B no hydrogen 2.752 N/A HIS 189.A N LEU 146.A O no hydrogen 3.014 N/A HIS 189.A ND1 ASP 187.A O.A no hydrogen 2.926 N/A HIS 189.A ND1 ASP 187.A O.B no hydrogen 2.947 N/A HIS 189.A NE2 TYR 71.A OH no hydrogen 2.754 N/A PHE 190.A N HIS 216.A O no hydrogen 2.942 N/A VAL 191.A N GLU 144.A O no hydrogen 2.901 N/A ASP 192.A N GLU 214.A O no hydrogen 2.904 N/A HIS 193.A N SER 142.A O.A no hydrogen 2.889 N/A HIS 193.A N SER 142.A O.B no hydrogen 3.038 N/A HIS 194.A N HIS 212.A O no hydrogen 3.017 N/A HIS 194.A NE2 GLU 196.A OE2 no hydrogen 3.104 N/A GLU 196.A N HIS 210.A O.A no hydrogen 2.856 N/A GLU 196.A N HIS 210.A O.B no hydrogen 2.755 N/A LYS 198.A N ASN 208.A O no hydrogen 2.859 N/A LYS 198.A NZ GLU 196.A OE1 no hydrogen 3.197 N/A LYS 198.A NZ GLU 196.A OE2 no hydrogen 3.165 N/A SER 199.A N ASN 208.A O no hydrogen 3.513 N/A HIS 200.A ND1 ASP 201.A O no hydrogen 2.922 N/A ASP 201.A N ASN 206.A O no hydrogen 3.021 N/A TYR 204.A N ASP 201.A O no hydrogen 3.063 N/A SER 205.A N ASP 203.A OD1 no hydrogen 3.183 N/A SER 205.A OG ASP 201.A OD1 no hydrogen 3.131 N/A SER 205.A OG ASP 201.A OD2 no hydrogen 2.573 N/A SER 205.A OG ASP 203.A OD1 no hydrogen 2.818 N/A SER 205.A OG ASN 206.A OD1 no hydrogen 3.548 N/A ASN 206.A N ASP 201.A OD1 no hydrogen 2.956 N/A VAL 207.A N LEU 45.A O no hydrogen 3.036 N/A ASN 208.A N SER 199.A O no hydrogen 2.849 N/A ASN 208.A ND2 ASP 44.A OD1 no hydrogen 2.736 N/A LEU 209.A N MET 43.A O no hydrogen 2.874 N/A HIS 210.A N.A GLU 196.A O no hydrogen 2.802 N/A HIS 210.A N.B GLU 196.A O no hydrogen 2.802 N/A GLU 211.A N GLN 41.A O no hydrogen 3.054 N/A HIS 212.A N HIS 194.A O no hydrogen 3.063 N/A HIS 212.A ND1 GLU 214.A OE2 no hydrogen 2.818 N/A ALA 213.A N GLY 39.A O no hydrogen 2.813 N/A GLU 214.A N ASP 192.A O no hydrogen 3.001 N/A ALA 215.A N LYS 70.A O no hydrogen 2.702 N/A HIS 216.A N PHE 190.A O no hydrogen 2.780 N/A HIS 216.A NE2 ASP 192.A OD1 no hydrogen 2.768 N/A