Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4o5f_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A OG VAL 4.A O no hydrogen 3.515 N/A SER 2.A OG ALA 46.A O no hydrogen 2.772 N/A VAL 4.A N SER 2.A OG no hydrogen 3.178 N/A CYS 5.A N ALA 20.A O no hydrogen 2.792 N/A LEU 6.A N GLY 49.A O no hydrogen 3.009 N/A LEU 7.A N ALA 18.A O no hydrogen 2.803 N/A ILE 8.A N TRP 51.A O no hydrogen 2.908 N/A ASP 9.A N LYS 16.A O no hydrogen 2.744 N/A ALA 10.A N SER 53.A O no hydrogen 2.800 N/A GLY 11.A N ARG 14.A O no hydrogen 2.895 N/A SER 13.A OG.A THR 126.A OG1 no hydrogen 2.645 N/A ARG 14.A NH1.B ASP 9.A OD2 no hydrogen 3.550 N/A ARG 14.A NH1.B ARG 14.A O no hydrogen 3.146 N/A ARG 14.A NH2.B ASP 9.A OD2 no hydrogen 3.071 N/A ILE 15.A N PHE 32.A O no hydrogen 2.916 N/A LYS 16.A N ASP 9.A O no hydrogen 2.886 N/A LYS 16.A NZ.B ARG 14.A O no hydrogen 3.080 N/A TRP 17.A N GLY 30.A O no hydrogen 2.901 N/A ALA 18.A N LEU 7.A O no hydrogen 2.925 N/A LEU 19.A N THR 28.A O no hydrogen 2.885 N/A ALA 20.A N CYS 5.A O no hydrogen 2.849 N/A ASP 21.A N ASP 21.A OD1 no hydrogen 2.697 N/A ASP 21.A N HIS 25.A O no hydrogen 3.328 N/A ARG 24.A N THR 22.A OG1 no hydrogen 3.085 N/A HIS 25.A N THR 22.A OG1 no hydrogen 2.939 N/A HIS 25.A ND1 ASP 21.A OD1 no hydrogen 2.660 N/A VAL 27.A N LEU 19.A O no hydrogen 2.736 N/A GLY 30.A N TRP 17.A O no hydrogen 3.021 N/A PHE 32.A N ILE 15.A O no hydrogen 2.849 N/A GLU 33.A N ASP 37.A OD2 no hydrogen 3.190 N/A HIS 34.A NE2 GLY 11.A O no hydrogen 2.811 N/A LEU 44.A N TRP 41.A O no hydrogen 3.092 N/A ARG 48.A N VAL 4.A O no hydrogen 2.876 N/A ARG 48.A NH2 ALA 256.A O no hydrogen 3.269 N/A ARG 48.A NH2 HIS 257.A ND1 no hydrogen 3.486 N/A ALA 50.A N PRO 76.A O no hydrogen 2.870 N/A TRP 51.A N LEU 6.A O no hydrogen 2.801 N/A ILE 52.A N THR 78.A O no hydrogen 2.847 N/A SER 53.A N ILE 8.A O no hydrogen 2.743 N/A SER 53.A OG SER 101.A OG no hydrogen 2.770 N/A ASN 54.A ND2 GLY 57.A O no hydrogen 3.008 N/A VAL 55.A N ALA 10.A O no hydrogen 3.032 N/A ALA 56.A N ASN 54.A OD1 no hydrogen 2.877 N/A ALA 61.A N GLY 57.A O no hydrogen 3.176 N/A ALA 62.A N ASP 58.A O no hydrogen 2.920 N/A ARG 63.A N ALA 59.A O no hydrogen 3.003 N/A ILE 64.A N ALA 60.A O no hydrogen 2.865 N/A ASP 65.A N ALA 61.A O no hydrogen 3.051 N/A ALA 66.A N ALA 62.A O no hydrogen 2.981 N/A LEU 67.A N ARG 63.A O no hydrogen 3.117 N/A ILE 68.A N ILE 64.A O no hydrogen 2.989 N/A ASP 69.A N ASP 65.A O no hydrogen 2.950 N/A ALA 70.A N ALA 66.A O no hydrogen 3.074 N/A HIS 71.A N ILE 68.A O no hydrogen 3.224 N/A HIS 71.A ND1 LEU 67.A O no hydrogen 2.676 N/A TRP 72.A N ILE 68.A O no hydrogen 2.791 N/A LEU 75.A N TRP 72.A O no hydrogen 3.148 N/A ARG 77.A NE LEU 75.A O no hydrogen 3.007 N/A ARG 77.A NH1 ASP 65.A OD1 no hydrogen 3.356 N/A ARG 77.A NH1 ASP 69.A OD1 no hydrogen 3.332 N/A ARG 77.A NH2 ASP 69.A OD1 no hydrogen 2.968 N/A ARG 77.A NH2 LEU 75.A O no hydrogen 2.878 N/A THR 78.A N ALA 50.A O no hydrogen 2.822 N/A VAL 80.A N ILE 52.A O no hydrogen 2.801 N/A ARG 81.A NH1.B ALA 82.A O no hydrogen 2.651 N/A CYS 83.A SG ALA 85.A O no hydrogen 3.666 N/A CYS 83.A SG GLN 86.A OE1 no hydrogen 3.598 N/A GLN 86.A N VAL 89.A O no hydrogen 2.906 N/A VAL 89.A N GLN 86.A O no hydrogen 2.975 N/A THR 90.A N GLY 137.A O no hydrogen 2.910 N/A ASN 91.A N ALA 84.A O no hydrogen 2.906 N/A ASN 91.A ND2 CYS 83.A O no hydrogen 3.019 N/A ASN 91.A ND2 PRO 96.A O no hydrogen 3.098 N/A GLY 92.A N PHE 139.A O no hydrogen 2.867 N/A TYR 93.A N ASN 91.A OD1 no hydrogen 2.991 N/A ARG 98.A N GLU 95.A O no hydrogen 2.804 N/A ARG 98.A NE GLU 95.A OE1 no hydrogen 3.079 N/A LEU 99.A N PRO 96.A O no hydrogen 3.103 N/A SER 101.A OG SER 53.A OG no hydrogen 2.770 N/A ARG 103.A N ASP 102.A OD1 no hydrogen 2.887 N/A ARG 103.A NE GLU 131.A OE2 no hydrogen 2.743 N/A ARG 103.A NH1 TYR 93.A OH no hydrogen 3.146 N/A ARG 103.A NH2 LEU 130.A O no hydrogen 3.145 N/A ARG 103.A NH2 GLU 131.A OE2 no hydrogen 3.050 N/A TRP 104.A N GLY 100.A O no hydrogen 3.024 N/A TRP 104.A NE1 GLN 86.A OE1 no hydrogen 3.017 N/A ALA 105.A N SER 101.A O no hydrogen 2.965 N/A GLY 106.A N ASP 102.A O no hydrogen 2.886 N/A LEU 107.A N ARG 103.A O no hydrogen 2.923 N/A ILE 108.A N TRP 104.A O no hydrogen 3.068 N/A GLY 109.A N ALA 105.A O no hydrogen 2.900 N/A ALA 110.A N GLY 106.A O no hydrogen 2.809 N/A HIS 111.A N LEU 107.A O no hydrogen 2.892 N/A ALA 112.A N ILE 108.A O no hydrogen 3.222 N/A ALA 113.A N GLY 109.A O no hydrogen 2.905 N/A PHE 114.A N ALA 110.A O no hydrogen 2.980 N/A LEU 119.A N LEU 133.A O no hydrogen 2.833 N/A LEU 120.A N ARG 222.A O no hydrogen 2.949 N/A ILE 121.A N GLU 131.A O no hydrogen 2.851 N/A ALA 122.A N VAL 224.A O no hydrogen 2.782 N/A THR 123.A N THR 129.A O no hydrogen 2.990 N/A THR 123.A OG1 SER 226.A OG.B no hydrogen 3.279 N/A PHE 124.A N SER 226.A O no hydrogen 2.907 N/A GLY 125.A N ALA 127.A O no hydrogen 2.797 N/A THR 126.A OG1 SER 13.A OG.A no hydrogen 2.645 N/A THR 128.A N ALA 145.A O no hydrogen 2.755 N/A THR 128.A OG1 GLN 202.A OE1 no hydrogen 2.625 N/A THR 129.A N THR 123.A O no hydrogen 2.981 N/A THR 129.A OG1 GLU 131.A OE2 no hydrogen 3.282 N/A LEU 130.A N LEU 143.A O no hydrogen 2.921 N/A GLU 131.A N ILE 121.A O no hydrogen 2.969 N/A ALA 132.A N GLY 141.A O no hydrogen 2.978 N/A LEU 133.A N LEU 119.A O no hydrogen 2.927 N/A ARG 134.A N ARG 138.A O no hydrogen 2.894 N/A ALA 135.A N HIS 118.A ND1 no hydrogen 2.952 N/A GLY 137.A N ARG 134.A O no hydrogen 2.883 N/A ARG 138.A N ASP 136.A OD1 no hydrogen 3.082 N/A ARG 138.A NE ASP 136.A OD2 no hydrogen 2.877 N/A ARG 138.A NH2 ASP 136.A OD2 no hydrogen 3.241 N/A PHE 139.A N THR 90.A O no hydrogen 2.905 N/A THR 140.A N ALA 132.A O no hydrogen 3.061 N/A LEU 143.A N LEU 130.A O no hydrogen 2.917 N/A ALA 145.A N THR 128.A O no hydrogen 2.860 N/A GLY 147.A N THR 126.A O no hydrogen 2.866 N/A TRP 148.A NE1 SER 195.A O no hydrogen 3.067 N/A MET 151.A N GLY 147.A O no hydrogen 2.899 N/A MET 152.A N TRP 148.A O no hydrogen 2.970 N/A ARG 153.A N ALA 149.A O no hydrogen 2.926 N/A SER 154.A N LEU 150.A O no hydrogen 2.936 N/A SER 154.A OG LEU 150.A O no hydrogen 3.552 N/A SER 154.A OG MET 151.A O no hydrogen 2.776 N/A LEU 155.A N MET 151.A O no hydrogen 3.272 N/A GLY 156.A N MET 152.A O no hydrogen 3.392 N/A MET 157.A N ARG 153.A O no hydrogen 2.957 N/A THR 159.A OG1 LEU 155.A O no hydrogen 2.776 N/A LEU 162.A N THR 159.A OG1 no hydrogen 3.230 N/A ALA 169.A N SER 166.A OG no hydrogen 2.945 N/A ALA 170.A N SER 166.A O no hydrogen 2.827 N/A THR 171.A N ILE 167.A O no hydrogen 3.016 N/A THR 171.A OG1 ILE 167.A O no hydrogen 3.116 N/A SER 172.A N ASP 168.A O no hydrogen 2.942 N/A SER 172.A OG ASP 168.A O no hydrogen 3.261 N/A LEU 173.A N ALA 169.A O no hydrogen 2.907 N/A LEU 174.A N ALA 170.A O no hydrogen 2.857 N/A ASP 175.A N THR 171.A O no hydrogen 2.937 N/A GLU 176.A N SER 172.A O no hydrogen 2.948 N/A LEU 177.A N LEU 173.A O no hydrogen 3.068 N/A ALA 178.A N LEU 174.A O no hydrogen 2.992 N/A ALA 179.A N ASP 175.A O no hydrogen 3.207 N/A ALA 179.A N GLU 176.A O no hydrogen 3.048 N/A ASN 180.A N LEU 177.A O no hydrogen 3.006 N/A HIS 192.A N ASP 189.A OD2 no hydrogen 3.272 N/A HIS 192.A ND1 ASP 189.A OD2 no hydrogen 2.682 N/A HIS 192.A NE2 GLU 176.A OE1 no hydrogen 2.608 N/A ALA 193.A N ASP 189.A O no hydrogen 2.891 N/A LEU 194.A N THR 190.A O no hydrogen 2.984 N/A SER 195.A N PRO 191.A O no hydrogen 2.963 N/A SER 195.A OG PRO 191.A O no hydrogen 3.471 N/A SER 195.A OG HIS 192.A O no hydrogen 3.275 N/A ALA 196.A N HIS 192.A O no hydrogen 2.943 N/A GLY 197.A N ALA 193.A O no hydrogen 2.940 N/A CYS 198.A N LEU 194.A O no hydrogen 2.962 N/A CYS 198.A SG LEU 194.A O no hydrogen 3.364 N/A LEU 199.A N SER 195.A O no hydrogen 2.981 N/A GLN 200.A N ALA 196.A O no hydrogen 2.796 N/A ALA 201.A N GLY 197.A O no hydrogen 3.023 N/A GLN 202.A N CYS 198.A O no hydrogen 3.136 N/A GLN 202.A NE2 PRO 146.A O no hydrogen 2.879 N/A ALA 203.A N LEU 199.A O no hydrogen 2.921 N/A GLY 204.A N GLN 200.A O no hydrogen 2.777 N/A LEU 205.A N ALA 201.A O no hydrogen 2.990 N/A ILE 206.A N GLN 202.A O no hydrogen 3.112 N/A GLU 207.A N ALA 203.A O no hydrogen 2.966 N/A ARG 208.A N GLY 204.A O no hydrogen 3.070 N/A ALA 209.A N LEU 205.A O no hydrogen 2.992 N/A TRP 210.A N ILE 206.A O no hydrogen 2.943 N/A TRP 210.A NE1 VAL 221.A O no hydrogen 2.858 N/A ARG 211.A N GLU 207.A O no hydrogen 2.999 N/A ASP 212.A N ARG 208.A O no hydrogen 2.984 N/A LEU 213.A N ALA 209.A O no hydrogen 2.920 N/A GLU 214.A N TRP 210.A O no hydrogen 2.971 N/A LYS 215.A N ARG 211.A O no hydrogen 3.000 N/A ALA 216.A N ASP 212.A O no hydrogen 2.879 N/A TRP 217.A N LEU 213.A O no hydrogen 2.878 N/A LYS 218.A N GLU 214.A O no hydrogen 2.817 N/A LYS 218.A NZ LYS 215.A O no hydrogen 3.437 N/A VAL 221.A N GLU 214.A OE2 no hydrogen 2.879 N/A ARG 222.A N HIS 118.A O no hydrogen 2.915 N/A ARG 222.A NE GLU 117.A OE1 no hydrogen 2.839 N/A ARG 222.A NH1 THR 242.A OG1 no hydrogen 2.897 N/A ARG 222.A NH2 GLU 117.A OE1 no hydrogen 3.413 N/A ARG 222.A NH2 GLU 117.A OE2 no hydrogen 2.866 N/A VAL 224.A N LEU 120.A O no hydrogen 2.874 N/A LEU 225.A N THR 242.A O no hydrogen 2.795 N/A SER 226.A N ALA 122.A O no hydrogen 3.001 N/A SER 226.A OG.A HIS 244.A O no hydrogen 3.329 N/A SER 226.A OG.B ALA 122.A O no hydrogen 3.445 N/A GLY 227.A N ASP 245.A OD1 no hydrogen 3.067 N/A ALA 230.A N GLY 227.A O no hydrogen 2.964 N/A ILE 233.A N ALA 229.A O no hydrogen 2.940 N/A VAL 234.A N ALA 230.A O no hydrogen 2.849 N/A ARG 235.A NH1 ALA 178.A O no hydrogen 2.945 N/A ALA 236.A N ILE 233.A O no hydrogen 2.972 N/A LEU 237.A N ILE 233.A O no hydrogen 2.996 N/A LEU 237.A N VAL 234.A O no hydrogen 3.251 N/A THR 238.A N GLU 207.A OE2 no hydrogen 2.751 N/A THR 238.A OG1 GLU 207.A OE2 no hydrogen 3.505 N/A THR 242.A N LEU 223.A O no hydrogen 2.849 N/A ARG 243.A NE ASP 245.A OD1 no hydrogen 2.827 N/A ARG 243.A NH1 ASP 231.A OD1 no hydrogen 2.761 N/A ARG 243.A NH2 ASP 231.A OD1 no hydrogen 3.546 N/A HIS 244.A N LEU 225.A O no hydrogen 2.949 N/A THR 246.A N HIS 244.A ND1 no hydrogen 3.215 N/A THR 250.A N THR 246.A O no hydrogen 2.858 N/A THR 250.A OG1 THR 246.A O no hydrogen 2.790 N/A GLY 251.A N LEU 247.A O no hydrogen 2.876 N/A LEU 252.A N VAL 248.A O no hydrogen 2.907 N/A ALA 253.A N LEU 249.A O no hydrogen 2.906 N/A LEU 254.A N THR 250.A O no hydrogen 2.913 N/A ILE 255.A N GLY 251.A O no hydrogen 2.957 N/A ALA 256.A N LEU 252.A O no hydrogen 2.824 N/A HIS 257.A N ALA 253.A O no hydrogen 2.923 N/A HIS 257.A NE2 ALA 20.A O no hydrogen 3.154 N/A SER 258.A N ILE 255.A O no hydrogen 3.149 N/A SER 258.A OG ILE 255.A O no hydrogen 2.612 N/A