Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7a8o_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 4.A N ASP 2.A OD1 no hydrogen 2.989 N/A VAL 5.A N ASP 2.A O no hydrogen 3.152 N/A LYS 7.A N GLU 10.A OE2.A no hydrogen 3.268 N/A LYS 7.A N GLU 10.A OE2.B no hydrogen 3.278 N/A GLY 8.A N MET 89.A O no hydrogen 3.076 N/A GLU 10.A N.A LYS 7.A O no hydrogen 3.072 N/A GLU 10.A N.B LYS 7.A O no hydrogen 3.078 N/A LEU 11.A N GLY 8.A O no hydrogen 3.027 N/A PHE 12.A N GLU 9.A O no hydrogen 3.037 N/A THR 13.A OG1 GLU 10.A O.A no hydrogen 3.568 N/A THR 13.A OG1 GLU 10.A O.B no hydrogen 3.373 N/A VAL 16.A N GLY 39.A O no hydrogen 2.893 N/A ILE 18.A N GLY 37.A O no hydrogen 2.952 N/A LEU 19.A N LEU 120.A O no hydrogen 2.984 N/A VAL 20.A N GLY 35.A O no hydrogen 2.865 N/A GLU 21.A N.A ASN 122.A O no hydrogen 2.888 N/A GLU 21.A N.B ASN 122.A O no hydrogen 2.874 N/A LEU 22.A N VAL 33.A O no hydrogen 2.899 N/A ASP 23.A N ILE 124.A O no hydrogen 3.028 N/A GLY 24.A N PHE 31.A O no hydrogen 2.862 N/A ASP 25.A N LEU 126.A O no hydrogen 2.962 N/A VAL 26.A N HIS 29.A O no hydrogen 2.951 N/A ASN 27.A N GLY 128.A O no hydrogen 3.009 N/A ASN 27.A ND2 PHE 131.A O no hydrogen 2.927 N/A HIS 29.A N VAL 26.A O no hydrogen 2.893 N/A PHE 31.A N GLY 24.A O no hydrogen 3.003 N/A SER 32.A N THR 54.A OG1 no hydrogen 3.158 N/A SER 32.A OG GLU 21.A OE2.A no hydrogen 2.696 N/A SER 32.A OG LEU 22.A O no hydrogen 3.343 N/A SER 32.A OG ASP 23.A OD1 no hydrogen 2.932 N/A VAL 33.A N LEU 22.A O no hydrogen 2.869 N/A ARG 34.A N ILE 51.A O no hydrogen 2.936 N/A GLY 35.A N VAL 20.A O no hydrogen 2.788 N/A GLU 36.A N.A LYS 49.A O no hydrogen 2.976 N/A GLU 36.A N.B LYS 49.A O no hydrogen 2.971 N/A GLY 37.A N ILE 18.A O no hydrogen 3.210 N/A GLU 38.A N THR 47.A O no hydrogen 2.989 N/A GLY 39.A N VAL 16.A O no hydrogen 2.854 N/A ASP 40.A N LYS 45.A O no hydrogen 2.807 N/A THR 42.A OG1 THR 13.A O no hydrogen 3.206 N/A ASN 43.A N ASP 40.A O no hydrogen 3.010 N/A ASN 43.A ND2 ASP 40.A OD2 no hydrogen 2.856 N/A GLY 44.A N ALA 41.A O no hydrogen 2.981 N/A LYS 45.A N ASP 40.A O no hydrogen 2.993 N/A LEU 46.A N GLU 223.A O no hydrogen 2.815 N/A THR 47.A N GLU 38.A O no hydrogen 3.074 N/A THR 47.A OG1 GLU 38.A O no hydrogen 3.534 N/A LEU 48.A N LEU 221.A O no hydrogen 2.905 N/A LYS 49.A N GLU 36.A O.A no hydrogen 2.988 N/A LYS 49.A N GLU 36.A O.B no hydrogen 2.916 N/A LYS 49.A NZ ASP 211.A OD2 no hydrogen 2.841 N/A LYS 49.A NZ GLU 214.A OE2 no hydrogen 2.672 N/A PHE 50.A N MET 219.A O no hydrogen 2.864 N/A ILE 51.A N ARG 34.A O no hydrogen 2.859 N/A CYS 52.A N ASP 217.A O no hydrogen 2.933 N/A CYS 52.A SG SER 32.A O no hydrogen 3.518 N/A CYS 52.A SG THR 54.A OG1 no hydrogen 3.475 N/A CYS 52.A SG GLY 55.A O no hydrogen 3.176 N/A THR 53.A N SER 32.A O no hydrogen 3.027 N/A THR 53.A OG1 SER 32.A O no hydrogen 3.400 N/A LEU 57.A N ASP 217.A OD2 no hydrogen 2.803 N/A TRP 61.A NE1 ASP 217.A OD1 no hydrogen 2.994 N/A THR 63.A N PRO 60.A O no hydrogen 2.974 N/A THR 63.A OG1 PRO 60.A O no hydrogen 2.764 N/A THR 63.A OG1 TYR 107.A OH no hydrogen 2.890 N/A LEU 64.A N TRP 61.A O no hydrogen 2.971 N/A VAL 65.A N PRO 62.A O no hydrogen 3.305 N/A THR 66.A OG1 HIS 182.A NE2 no hydrogen 2.692 N/A LEU 68.A N LEU 64.A O no hydrogen 2.898 N/A PHE 72.A N VAL 69.A O no hydrogen 3.085 N/A ALA 73.A N LEU 70.A O no hydrogen 3.101 N/A ARG 74.A N.A VAL 225.A O no hydrogen 2.910 N/A ARG 74.A N.B VAL 225.A O no hydrogen 2.894 N/A ARG 74.A NE.A THR 42.A O no hydrogen 2.722 N/A ARG 74.A NH2.A TYR 75.A O no hydrogen 2.828 N/A TYR 75.A OH HIS 200.A NE2 no hydrogen 2.740 N/A HIS 78.A NE2 ILE 230.A O no hydrogen 2.822 N/A MET 79.A N PRO 76.A O no hydrogen 2.792 N/A LYS 80.A N ASP 77.A O no hydrogen 3.465 N/A LYS 80.A NZ TYR 75.A O no hydrogen 3.062 N/A GLN 81.A N GLN 81.A OE1 no hydrogen 2.931 N/A HIS 82.A N MET 79.A O no hydrogen 2.853 N/A ASP 83.A N LYS 80.A O no hydrogen 3.390 N/A PHE 84.A N HIS 82.A O no hydrogen 3.258 N/A LYS 86.A N ASP 83.A OD1 no hydrogen 3.120 N/A LYS 86.A NZ CYS 71.A O no hydrogen 2.898 N/A LYS 86.A NZ ALA 73.A O no hydrogen 2.696 N/A LYS 86.A NZ ASP 83.A OD2 no hydrogen 2.784 N/A SER 87.A N ASP 83.A O no hydrogen 3.374 N/A SER 87.A OG PHE 84.A O no hydrogen 2.842 N/A ALA 88.A N PHE 84.A O no hydrogen 3.282 N/A MET 89.A N LYS 86.A O no hydrogen 2.964 N/A GLU 91.A N GLU 91.A OE1 no hydrogen 2.783 N/A GLY 92.A N ALA 88.A O no hydrogen 2.824 N/A TYR 93.A N VAL 113.A O no hydrogen 2.956 N/A VAL 94.A N THR 187.A O no hydrogen 2.758 N/A GLN 95.A N ALA 111.A O no hydrogen 2.853 N/A GLU 96.A N GLN 185.A O.A no hydrogen 2.847 N/A GLU 96.A N GLN 185.A O.B no hydrogen 2.865 N/A ARG 97.A N THR 109.A O no hydrogen 2.982 N/A ARG 97.A NE GLN 184.A OE1 no hydrogen 2.913 N/A ARG 97.A NH1 THR 66.A O no hydrogen 2.811 N/A ARG 97.A NH2 GLN 184.A OE1 no hydrogen 2.848 N/A THR 98.A N TYR 183.A O no hydrogen 3.048 N/A ILE 99.A N TYR 107.A O no hydrogen 2.823 N/A SER 100.A N ASP 181.A O no hydrogen 2.927 N/A PHE 101.A N GLY 105.A O no hydrogen 2.943 N/A LYS 102.A N LEU 179.A O no hydrogen 2.964 N/A ASP 104.A N PHE 101.A O no hydrogen 3.073 N/A GLY 105.A N ASP 104.A OD1 no hydrogen 2.854 N/A TYR 106.A N ILE 129.A O no hydrogen 2.968 N/A TYR 107.A N ILE 99.A O no hydrogen 2.821 N/A TYR 107.A OH THR 63.A OG1 no hydrogen 2.890 N/A LYS 108.A N LYS 127.A O no hydrogen 2.748 N/A THR 109.A N ARG 97.A O no hydrogen 2.834 N/A ARG 110.A N GLU 125.A O.A no hydrogen 3.021 N/A ARG 110.A N GLU 125.A O.B no hydrogen 3.031 N/A ALA 111.A N GLN 95.A O no hydrogen 2.904 N/A GLU 112.A N ARG 123.A O.A no hydrogen 2.930 N/A GLU 112.A N ARG 123.A O.B no hydrogen 2.958 N/A VAL 113.A N TYR 93.A O no hydrogen 2.928 N/A LYS 114.A N VAL 121.A O no hydrogen 3.058 N/A LYS 114.A NZ GLU 112.A OE1 no hydrogen 2.566 N/A PHE 115.A N PRO 90.A O no hydrogen 3.267 N/A GLU 116.A N THR 119.A O no hydrogen 2.863 N/A THR 119.A N GLU 116.A O no hydrogen 3.241 N/A THR 119.A OG1 ASP 118.A OD1.A no hydrogen 3.232 N/A LEU 120.A N PRO 17.A O no hydrogen 2.896 N/A VAL 121.A N LYS 114.A O no hydrogen 2.876 N/A ASN 122.A N LEU 19.A O no hydrogen 2.884 N/A ASN 122.A ND2 THR 67.A O no hydrogen 3.372 N/A ASN 122.A ND2 LEU 68.A O no hydrogen 2.949 N/A ARG 123.A N.A GLU 112.A O no hydrogen 3.011 N/A ARG 123.A N.B GLU 112.A O no hydrogen 2.993 N/A ARG 123.A NE.A GLU 116.A OE2 no hydrogen 3.083 N/A ARG 123.A NE.B GLU 21.A OE1.B no hydrogen 3.174 N/A ARG 123.A NH1.B GLU 116.A OE1 no hydrogen 3.117 N/A ARG 123.A NH1.B GLU 116.A OE2 no hydrogen 2.997 N/A ARG 123.A NH2.A GLU 116.A OE1 no hydrogen 3.052 N/A ARG 123.A NH2.B GLU 116.A OE2 no hydrogen 2.450 N/A ILE 124.A N GLU 21.A O.A no hydrogen 2.788 N/A ILE 124.A N GLU 21.A O.B no hydrogen 2.766 N/A GLU 125.A N.A ARG 110.A O no hydrogen 2.922 N/A GLU 125.A N.B ARG 110.A O no hydrogen 2.934 N/A LEU 126.A N ASP 23.A O no hydrogen 2.943 N/A LYS 127.A N LYS 108.A O no hydrogen 2.859 N/A LYS 127.A NZ ASP 25.A OD1 no hydrogen 3.223 N/A GLY 128.A N ASP 25.A O no hydrogen 2.699 N/A ILE 129.A N TYR 106.A O no hydrogen 2.896 N/A PHE 131.A N ASN 27.A OD1 no hydrogen 3.103 N/A LYS 132.A N ASP 104.A OD1 no hydrogen 2.824 N/A LYS 132.A NZ ASP 103.A O no hydrogen 2.745 N/A GLY 135.A N LYS 132.A O no hydrogen 3.018 N/A ASN 136.A ND2 GLN 178.A OE1 no hydrogen 3.107 N/A GLY 139.A N GLY 135.A O no hydrogen 2.937 N/A HIS 140.A N ILE 137.A O no hydrogen 3.038 N/A LYS 141.A N ASN 136.A O no hydrogen 2.979 N/A LYS 141.A NZ ASP 134.A O no hydrogen 2.836 N/A GLU 143.A N ASN 171.A O no hydrogen 2.904 N/A TYR 144.A OH SER 209.A O no hydrogen 2.676 N/A ASN 145.A N GLU 143.A O no hydrogen 2.935 N/A ASN 145.A ND2 GLU 143.A OE2 no hydrogen 2.981 N/A ASN 147.A ND2 ARG 169.A O no hydrogen 2.908 N/A ASN 147.A ND2 ASN 171.A OD1 no hydrogen 3.019 N/A HIS 149.A N THR 204.A O.A no hydrogen 2.953 N/A HIS 149.A N THR 204.A O.B no hydrogen 3.170 N/A ALA 151.A N LEU 202.A O no hydrogen 2.910 N/A ILE 153.A N HIS 200.A O no hydrogen 2.707 N/A THR 154.A N LYS 163.A O.A no hydrogen 3.044 N/A THR 154.A N LYS 163.A O.B no hydrogen 3.143 N/A THR 154.A OG1 LYS 163.A O.A no hydrogen 3.552 N/A ASP 156.A N GLY 161.A O no hydrogen 2.859 N/A LYS 159.A N ASP 156.A O no hydrogen 3.173 N/A ASN 160.A N LYS 157.A O no hydrogen 3.119 N/A GLY 161.A N ASP 156.A O no hydrogen 3.013 N/A ILE 162.A N ASN 186.A O no hydrogen 3.134 N/A LYS 163.A N.A THR 154.A O no hydrogen 2.888 N/A LYS 163.A N.B THR 154.A O no hydrogen 2.875 N/A LYS 163.A NZ.A THR 154.A OG1 no hydrogen 2.967 N/A LYS 163.A NZ.B TYR 183.A OH no hydrogen 3.077 N/A LYS 163.A NZ.B GLN 185.A OE1.B no hydrogen 2.437 N/A SER 164.A N GLN 184.A O no hydrogen 2.992 N/A SER 164.A OG TYR 152.A O.A no hydrogen 2.868 N/A SER 164.A OG TYR 152.A O.B no hydrogen 2.590 N/A PHE 166.A N HIS 182.A O no hydrogen 3.135 N/A ILE 168.A N ALA 180.A O no hydrogen 2.920 N/A ARG 169.A N HIS 149.A NE2 no hydrogen 3.035 N/A ARG 169.A NH2 SER 148.A O no hydrogen 2.940 N/A HIS 170.A N GLN 178.A O no hydrogen 2.853 N/A VAL 172.A N SER 176.A O no hydrogen 2.832 N/A GLU 173.A N.A LYS 141.A O no hydrogen 2.930 N/A GLU 173.A N.B LYS 141.A O no hydrogen 2.931 N/A GLY 175.A N VAL 172.A O no hydrogen 2.961 N/A SER 176.A N ASP 174.A OD2 no hydrogen 2.938 N/A SER 176.A OG ASP 174.A OD2 no hydrogen 2.641 N/A GLN 178.A N HIS 170.A O no hydrogen 2.784 N/A GLN 178.A NE2 LYS 102.A O no hydrogen 2.989 N/A GLN 178.A NE2 LEU 179.A O no hydrogen 3.087 N/A ALA 180.A N ILE 168.A O no hydrogen 2.869 N/A ASP 181.A N SER 100.A O no hydrogen 2.844 N/A HIS 182.A N PHE 166.A O no hydrogen 2.700 N/A HIS 182.A ND1 ALA 180.A O no hydrogen 2.887 N/A HIS 182.A NE2 THR 66.A OG1 no hydrogen 2.692 N/A TYR 183.A N THR 98.A O no hydrogen 2.957 N/A GLN 184.A N SER 164.A O no hydrogen 2.844 N/A GLN 184.A NE2 ASN 186.A OD1 no hydrogen 2.844 N/A GLN 185.A N.A GLU 96.A O no hydrogen 2.897 N/A GLN 185.A N.B GLU 96.A O no hydrogen 2.911 N/A ASN 186.A N ILE 162.A O no hydrogen 2.919 N/A ASN 186.A ND2 GLN 95.A OE1 no hydrogen 2.939 N/A THR 187.A N VAL 94.A O no hydrogen 2.966 N/A ILE 189.A N GLY 92.A O no hydrogen 2.863 N/A LEU 195.A N SER 87.A OG no hydrogen 3.130 N/A ASP 198.A N HIS 82.A ND1 no hydrogen 2.974 N/A HIS 200.A N ILE 153.A O no hydrogen 3.278 N/A HIS 200.A ND1 ASP 198.A O no hydrogen 2.942 N/A HIS 200.A NE2 TYR 75.A OH no hydrogen 2.740 N/A TYR 201.A N ALA 228.A O no hydrogen 2.980 N/A LEU 202.A N ALA 151.A O no hydrogen 2.864 N/A SER 203.A N.A THR 226.A O.A no hydrogen 2.761 N/A SER 203.A N.A THR 226.A O.B no hydrogen 2.648 N/A SER 203.A N.B THR 226.A O.A no hydrogen 2.765 N/A SER 203.A N.B THR 226.A O.B no hydrogen 2.655 N/A SER 203.A OG.B ASN 150.A OD1 no hydrogen 2.980 N/A THR 204.A N.A HIS 149.A O no hydrogen 2.941 N/A THR 204.A N.B HIS 149.A O no hydrogen 2.918 N/A THR 204.A OG1.B HIS 149.A O no hydrogen 3.140 N/A GLN 205.A N PHE 224.A O no hydrogen 2.977 N/A SER 206.A OG GLU 223.A OE1 no hydrogen 3.010 N/A ALA 207.A N LEU 222.A O no hydrogen 2.776 N/A SER 209.A N VAL 220.A O no hydrogen 2.877 N/A LYS 210.A NZ HIS 218.A O no hydrogen 2.756 N/A ASP 211.A N HIS 218.A NE2 no hydrogen 2.791 N/A ASN 213.A N ASP 211.A OD1 no hydrogen 3.011 N/A GLU 214.A N ASP 211.A O no hydrogen 3.024 N/A ARG 216.A N GLU 214.A OE1 no hydrogen 3.001 N/A HIS 218.A ND1 ARG 216.A O no hydrogen 2.831 N/A MET 219.A N PHE 50.A O no hydrogen 2.891 N/A VAL 220.A N SER 209.A O no hydrogen 3.007 N/A LEU 221.A N LEU 48.A O no hydrogen 2.821 N/A LEU 222.A N ALA 207.A O no hydrogen 2.997 N/A GLU 223.A N LEU 46.A O no hydrogen 2.985 N/A PHE 224.A N GLN 205.A O no hydrogen 2.876 N/A VAL 225.A N GLY 44.A O no hydrogen 2.874 N/A THR 226.A N.A SER 203.A O.A no hydrogen 2.898 N/A THR 226.A N.A SER 203.A O.B no hydrogen 2.921 N/A THR 226.A N.B SER 203.A O.A no hydrogen 2.878 N/A THR 226.A N.B SER 203.A O.B no hydrogen 2.903 N/A THR 226.A OG1.B SER 203.A O.A no hydrogen 3.529 N/A ALA 227.A N ARG 74.A O.A no hydrogen 2.976 N/A ALA 227.A N ARG 74.A O.B no hydrogen 2.890 N/A ALA 228.A N TYR 201.A O no hydrogen 2.895 N/A