Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4o8k_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 3.A N ALA 18.A O no hydrogen 2.862 N/A LEU 4.A N GLY 47.A O no hydrogen 2.941 N/A LEU 5.A N ALA 16.A O no hydrogen 2.791 N/A ILE 6.A N TRP 49.A O no hydrogen 2.908 N/A ASP 7.A N LYS 14.A O no hydrogen 2.801 N/A ALA 8.A N SER 51.A O no hydrogen 2.834 N/A GLY 9.A N ARG 12.A O no hydrogen 3.011 N/A SER 11.A OG GLU 31.A OE1 no hydrogen 3.376 N/A ILE 13.A N PHE 30.A O no hydrogen 2.796 N/A LYS 14.A N ASP 7.A O no hydrogen 2.855 N/A TRP 15.A N GLY 28.A O no hydrogen 2.918 N/A ALA 16.A N LEU 5.A O no hydrogen 2.926 N/A LEU 17.A N THR 26.A O no hydrogen 2.915 N/A ALA 18.A N CYS 3.A O no hydrogen 2.910 N/A ASP 19.A N HIS 23.A O no hydrogen 3.270 N/A ARG 22.A N THR 20.A OG1 no hydrogen 3.106 N/A HIS 23.A N THR 20.A OG1 no hydrogen 2.978 N/A HIS 23.A ND1 ASP 19.A OD1 no hydrogen 2.711 N/A VAL 25.A N LEU 17.A O no hydrogen 2.719 N/A GLY 28.A N TRP 15.A O no hydrogen 3.038 N/A PHE 30.A N ILE 13.A O no hydrogen 2.887 N/A GLU 31.A N ASP 35.A OD2 no hydrogen 3.046 N/A HIS 32.A N SER 11.A O no hydrogen 3.055 N/A HIS 32.A NE2 GLY 9.A O no hydrogen 2.880 N/A ASP 35.A N GLU 31.A O no hydrogen 3.054 N/A LEU 42.A N TRP 39.A O no hydrogen 3.208 N/A ARG 46.A N VAL 2.A O no hydrogen 2.775 N/A ARG 46.A NH2 ALA 251.A O no hydrogen 3.194 N/A ALA 48.A N PRO 74.A O no hydrogen 2.901 N/A TRP 49.A N LEU 4.A O no hydrogen 2.800 N/A ILE 50.A N THR 76.A O no hydrogen 2.846 N/A SER 51.A N ILE 6.A O no hydrogen 2.836 N/A SER 51.A OG SER 99.A OG no hydrogen 2.884 N/A ASN 52.A ND2 GLY 55.A O no hydrogen 3.058 N/A VAL 53.A N ALA 8.A O no hydrogen 3.071 N/A ALA 54.A N ASN 52.A OD1 no hydrogen 2.734 N/A ALA 59.A N GLY 55.A O no hydrogen 3.048 N/A ALA 60.A N ASP 56.A O no hydrogen 2.915 N/A ARG 61.A N ALA 57.A O no hydrogen 2.958 N/A ARG 61.A NH2 ASP 35.A O no hydrogen 2.947 N/A ARG 61.A NH2 THR 36.A OG1 no hydrogen 3.169 N/A ILE 62.A N ALA 58.A O no hydrogen 2.908 N/A ASP 63.A N ALA 59.A O no hydrogen 3.071 N/A ALA 64.A N ALA 60.A O no hydrogen 2.933 N/A LEU 65.A N ARG 61.A O no hydrogen 2.933 N/A ILE 66.A N ILE 62.A O no hydrogen 2.928 N/A ASP 67.A N ASP 63.A O no hydrogen 2.901 N/A ALA 68.A N ALA 64.A O no hydrogen 2.959 N/A HIS 69.A N ILE 66.A O no hydrogen 3.153 N/A HIS 69.A ND1 LEU 65.A O no hydrogen 2.814 N/A TRP 70.A N ILE 66.A O no hydrogen 2.838 N/A ALA 72.A N ASP 67.A OD1 no hydrogen 2.785 N/A LEU 73.A N TRP 70.A O no hydrogen 3.015 N/A ARG 75.A NE LEU 73.A O no hydrogen 2.986 N/A ARG 75.A NH1 ASP 63.A OD1 no hydrogen 2.930 N/A ARG 75.A NH1 ASP 67.A OD2 no hydrogen 3.103 N/A ARG 75.A NH2 ASP 67.A OD1 no hydrogen 2.799 N/A ARG 75.A NH2 ASP 67.A OD2 no hydrogen 3.508 N/A ARG 75.A NH2 LEU 73.A O no hydrogen 2.825 N/A THR 76.A N ALA 48.A O no hydrogen 2.802 N/A VAL 78.A N ILE 50.A O no hydrogen 2.775 N/A ARG 79.A NH1 ALA 80.A O no hydrogen 2.718 N/A CYS 81.A SG ALA 83.A O no hydrogen 3.585 N/A CYS 81.A SG GLN 84.A OE1 no hydrogen 3.690 N/A GLN 84.A N VAL 87.A O no hydrogen 2.931 N/A VAL 87.A N GLN 84.A O no hydrogen 2.959 N/A THR 88.A N GLY 135.A O no hydrogen 2.884 N/A ASN 89.A N ALA 82.A O no hydrogen 2.848 N/A ASN 89.A ND2 CYS 81.A O no hydrogen 2.993 N/A ASN 89.A ND2 PRO 94.A O no hydrogen 3.215 N/A GLY 90.A N PHE 137.A O no hydrogen 2.893 N/A TYR 91.A N ASN 89.A OD1 no hydrogen 3.002 N/A ARG 96.A N GLU 93.A O no hydrogen 2.816 N/A ARG 96.A NE GLU 93.A OE1.A no hydrogen 2.333 N/A ARG 96.A NE GLU 93.A OE1.B no hydrogen 2.942 N/A LEU 97.A N PRO 94.A O no hydrogen 3.068 N/A SER 99.A OG SER 51.A OG no hydrogen 2.884 N/A TRP 102.A N GLY 98.A O no hydrogen 2.965 N/A TRP 102.A NE1 GLN 84.A OE1 no hydrogen 3.013 N/A ALA 103.A N SER 99.A O no hydrogen 2.960 N/A GLY 104.A N ASP 100.A O no hydrogen 2.913 N/A LEU 105.A N ARG 101.A O no hydrogen 2.891 N/A ILE 106.A N TRP 102.A O no hydrogen 3.063 N/A GLY 107.A N ALA 103.A O no hydrogen 2.858 N/A ALA 108.A N GLY 104.A O no hydrogen 2.920 N/A HIS 109.A N LEU 105.A O no hydrogen 2.929 N/A ALA 110.A N ILE 106.A O no hydrogen 3.201 N/A ALA 111.A N GLY 107.A O no hydrogen 2.883 N/A PHE 112.A N ALA 108.A O no hydrogen 2.989 N/A GLU 115.A N PHE 112.A O no hydrogen 3.369 N/A LEU 117.A N LEU 131.A O no hydrogen 2.841 N/A LEU 118.A N ARG 217.A O no hydrogen 2.913 N/A ILE 119.A N GLU 129.A O no hydrogen 2.835 N/A ALA 120.A N VAL 219.A O no hydrogen 2.785 N/A THR 121.A N THR 127.A O no hydrogen 2.845 N/A PHE 122.A N SER 221.A O no hydrogen 3.099 N/A GLY 123.A N ALA 125.A O no hydrogen 2.857 N/A THR 126.A N ALA 143.A O no hydrogen 2.737 N/A THR 126.A OG1 GLN 197.A OE1 no hydrogen 2.723 N/A THR 127.A N THR 121.A O no hydrogen 3.000 N/A LEU 128.A N LEU 141.A O no hydrogen 2.813 N/A GLU 129.A N ILE 119.A O no hydrogen 2.847 N/A ALA 130.A N GLY 139.A O no hydrogen 2.992 N/A LEU 131.A N LEU 117.A O no hydrogen 2.961 N/A ARG 132.A N ARG 136.A O no hydrogen 2.813 N/A ARG 132.A NE.A ASP 134.A OD1 no hydrogen 3.026 N/A ARG 132.A NH2.A ASP 134.A OD1 no hydrogen 3.517 N/A ARG 132.A NH2.A ASP 134.A OD2 no hydrogen 2.902 N/A ALA 133.A N HIS 116.A ND1 no hydrogen 2.934 N/A GLY 135.A N ARG 132.A O no hydrogen 2.897 N/A ARG 136.A N ASP 134.A OD1 no hydrogen 3.008 N/A PHE 137.A N THR 88.A O no hydrogen 2.925 N/A THR 138.A N ALA 130.A O no hydrogen 3.002 N/A THR 138.A OG1 ALA 130.A O no hydrogen 3.503 N/A LEU 141.A N LEU 128.A O no hydrogen 2.863 N/A ALA 143.A N THR 126.A O no hydrogen 2.949 N/A GLY 145.A N THR 124.A O no hydrogen 2.901 N/A TRP 146.A NE1 SER 190.A O no hydrogen 3.182 N/A SER 150.A N LEU 148.A O no hydrogen 3.002 N/A SER 150.A OG LEU 148.A O no hydrogen 3.266 N/A THR 154.A OG1 SER 150.A O no hydrogen 2.806 N/A GLN 156.A N GLN 156.A OE1 no hydrogen 2.885 N/A LEU 157.A N THR 154.A O no hydrogen 3.129 N/A VAL 160.A N GLY 152.A O no hydrogen 2.886 N/A ALA 164.A N SER 161.A OG no hydrogen 2.941 N/A ALA 165.A N SER 161.A O no hydrogen 2.833 N/A THR 166.A N ILE 162.A O no hydrogen 3.155 N/A THR 166.A OG1 ILE 162.A O no hydrogen 3.514 N/A SER 167.A N ASP 163.A O no hydrogen 3.241 N/A LEU 168.A N ALA 164.A O no hydrogen 3.062 N/A LEU 169.A N ALA 165.A O no hydrogen 2.864 N/A ASP 170.A N THR 166.A O no hydrogen 2.963 N/A GLU 171.A N SER 167.A O no hydrogen 2.941 N/A LEU 172.A N LEU 168.A O no hydrogen 2.871 N/A ALA 173.A N LEU 169.A O no hydrogen 3.002 N/A ALA 174.A N ASP 170.A O no hydrogen 2.971 N/A ASN 175.A N GLU 171.A O no hydrogen 2.939 N/A ASN 175.A N LEU 172.A O no hydrogen 3.101 N/A ASP 176.A N ALA 173.A O no hydrogen 2.933 N/A ALA 177.A N LEU 172.A O no hydrogen 2.844 N/A HIS 187.A N ASP 184.A OD2 no hydrogen 3.195 N/A HIS 187.A ND1 ASP 184.A OD2 no hydrogen 2.694 N/A HIS 187.A NE2 GLU 171.A OE1 no hydrogen 2.593 N/A ALA 188.A N ASP 184.A O no hydrogen 2.994 N/A LEU 189.A N THR 185.A O no hydrogen 3.058 N/A SER 190.A N PRO 186.A O no hydrogen 3.110 N/A SER 190.A OG PRO 186.A O no hydrogen 3.379 N/A SER 190.A OG HIS 187.A O no hydrogen 3.148 N/A ALA 191.A N HIS 187.A O no hydrogen 2.877 N/A GLY 192.A N ALA 188.A O no hydrogen 2.919 N/A CYS 193.A N LEU 189.A O no hydrogen 2.948 N/A CYS 193.A SG LEU 189.A O no hydrogen 3.317 N/A LEU 194.A N SER 190.A O no hydrogen 2.994 N/A GLN 195.A N ALA 191.A O no hydrogen 2.836 N/A GLN 195.A NE2 ALA 179.A O no hydrogen 2.931 N/A ALA 196.A N GLY 192.A O no hydrogen 2.940 N/A GLN 197.A N CYS 193.A O no hydrogen 3.066 N/A GLN 197.A NE2 PRO 144.A O no hydrogen 2.791 N/A ALA 198.A N LEU 194.A O no hydrogen 2.940 N/A GLY 199.A N GLN 195.A O no hydrogen 2.796 N/A LEU 200.A N ALA 196.A O no hydrogen 2.919 N/A ILE 201.A N GLN 197.A O no hydrogen 3.175 N/A GLU 202.A N ALA 198.A O no hydrogen 2.919 N/A ARG 203.A N GLY 199.A O no hydrogen 2.901 N/A ALA 204.A N LEU 200.A O no hydrogen 2.999 N/A TRP 205.A N ILE 201.A O no hydrogen 2.973 N/A TRP 205.A NE1 VAL 216.A O no hydrogen 2.839 N/A ARG 206.A N GLU 202.A O no hydrogen 2.990 N/A ASP 207.A N ARG 203.A O no hydrogen 2.959 N/A LEU 208.A N ALA 204.A O no hydrogen 2.946 N/A GLU 209.A N TRP 205.A O no hydrogen 3.029 N/A LYS 210.A N ARG 206.A O no hydrogen 3.194 N/A ALA 211.A N ASP 207.A O no hydrogen 2.829 N/A TRP 212.A N LEU 208.A O no hydrogen 2.899 N/A LYS 213.A N GLU 209.A O no hydrogen 2.841 N/A LYS 213.A NZ LYS 210.A O no hydrogen 2.802 N/A LYS 213.A NZ ALA 211.A O no hydrogen 3.521 N/A VAL 216.A N GLU 209.A OE2 no hydrogen 2.912 N/A ARG 217.A N HIS 116.A O no hydrogen 2.889 N/A ARG 217.A NE GLU 115.A OE1 no hydrogen 2.781 N/A ARG 217.A NH1 THR 237.A OG1 no hydrogen 2.838 N/A ARG 217.A NH2 GLU 115.A OE1 no hydrogen 3.291 N/A ARG 217.A NH2 GLU 115.A OE2 no hydrogen 2.923 N/A VAL 219.A N LEU 118.A O no hydrogen 2.839 N/A LEU 220.A N THR 237.A O no hydrogen 2.811 N/A SER 221.A N ALA 120.A O no hydrogen 2.789 N/A GLY 223.A N PHE 122.A O no hydrogen 2.958 N/A VAL 229.A N ALA 225.A O no hydrogen 2.876 N/A ARG 230.A N ASP 226.A O no hydrogen 2.947 N/A ARG 230.A NE ASP 226.A OD1 no hydrogen 3.152 N/A ARG 230.A NE ASP 226.A OD2 no hydrogen 3.372 N/A ARG 230.A NH1 ASP 176.A OD1 no hydrogen 3.045 N/A ALA 231.A N ALA 227.A O no hydrogen 3.051 N/A ALA 231.A N ILE 228.A O no hydrogen 3.108 N/A LEU 232.A N ILE 228.A O no hydrogen 3.307 N/A LEU 232.A N VAL 229.A O no hydrogen 3.285 N/A THR 233.A N GLU 202.A OE2 no hydrogen 2.887 N/A THR 233.A OG1 GLU 202.A OE2 no hydrogen 3.278 N/A HIS 236.A ND1 VAL 234.A O no hydrogen 3.028 N/A THR 237.A N LEU 218.A O no hydrogen 2.888 N/A ARG 238.A NH1 GLY 222.A O no hydrogen 3.254 N/A ARG 238.A NH1 GLY 223.A O no hydrogen 3.059 N/A ARG 238.A NH1 ASP 240.A OD1 no hydrogen 3.549 N/A ARG 238.A NH2 GLY 223.A O no hydrogen 3.200 N/A HIS 239.A N LEU 220.A O no hydrogen 2.983 N/A THR 241.A N HIS 239.A ND1 no hydrogen 3.161 N/A THR 241.A OG1 THR 245.A OG1 no hydrogen 3.386 N/A THR 245.A N THR 241.A O no hydrogen 2.882 N/A THR 245.A OG1 THR 241.A O no hydrogen 2.812 N/A THR 245.A OG1 THR 241.A OG1 no hydrogen 3.386 N/A GLY 246.A N LEU 242.A O no hydrogen 2.932 N/A LEU 247.A N VAL 243.A O no hydrogen 2.917 N/A ALA 248.A N LEU 244.A O no hydrogen 2.961 N/A LEU 249.A N THR 245.A O no hydrogen 3.046 N/A ILE 250.A N GLY 246.A O no hydrogen 2.933 N/A ALA 251.A N LEU 247.A O no hydrogen 2.865 N/A HIS 252.A N ALA 248.A O no hydrogen 2.959 N/A HIS 252.A ND1 ALA 248.A O no hydrogen 3.010 N/A SER 253.A N ILE 250.A O no hydrogen 3.222 N/A SER 253.A OG ILE 250.A O no hydrogen 2.629 N/A