Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8a2d_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 5.A N LEU 78.A O no hydrogen 3.027 N/A ARG 5.A NE ALA 2.A O no hydrogen 3.234 N/A ARG 5.A NH2 GLU 36.A OE2 no hydrogen 3.351 N/A LEU 7.A N ILE 80.A O no hydrogen 2.795 N/A LYS 8.A N GLU 11.A OE1 no hydrogen 2.867 N/A LYS 8.A NZ GLU 34.A OE1 no hydrogen 2.817 N/A GLU 11.A N LYS 8.A O no hydrogen 3.033 N/A PHE 12.A N GLU 9.A O no hydrogen 3.434 N/A LYS 13.A N LEU 30.A O no hydrogen 2.919 N/A LYS 14.A NZ GLU 46.A OE1 no hydrogen 2.602 N/A ILE 15.A N LYS 28.A O no hydrogen 2.750 N/A LYS 16.A N LYS 28.A O no hydrogen 3.161 N/A LEU 18.A N VAL 26.A O no hydrogen 2.776 N/A GLY 19.A N VAL 26.A O no hydrogen 3.328 N/A SER 20.A OG THR 25.A OG1 no hydrogen 2.644 N/A GLY 21.A N GLY 24.A O no hydrogen 2.879 N/A THR 25.A N GLU 46.A O no hydrogen 2.893 N/A THR 25.A OG1 SER 20.A OG no hydrogen 2.644 N/A VAL 26.A N GLY 19.A O no hydrogen 2.830 N/A TYR 27.A N ILE 44.A O no hydrogen 2.825 N/A LYS 28.A N LYS 16.A O no hydrogen 2.778 N/A GLY 29.A N VAL 42.A O no hydrogen 2.807 N/A LEU 30.A N LYS 13.A O no hydrogen 2.991 N/A TRP 31.A N ILE 40.A O no hydrogen 2.941 N/A TRP 31.A NE1 GLU 11.A OE2 no hydrogen 2.898 N/A ILE 32.A N GLU 11.A O no hydrogen 2.858 N/A GLU 34.A N GLU 11.A OE2 no hydrogen 3.047 N/A GLU 36.A N PRO 33.A O no hydrogen 2.894 N/A ILE 40.A N TRP 31.A O no hydrogen 2.797 N/A VAL 42.A N GLY 29.A O no hydrogen 2.973 N/A ALA 43.A N THR 90.A O no hydrogen 2.877 N/A ILE 44.A N TYR 27.A O no hydrogen 2.816 N/A LYS 45.A N LEU 88.A O no hydrogen 2.811 N/A LYS 45.A NZ ASP 155.A OD2 no hydrogen 3.360 N/A GLU 46.A N THR 25.A O no hydrogen 2.785 N/A LEU 47.A N VAL 86.A O no hydrogen 2.898 N/A ARG 48.A NH2 ALA 22.A O no hydrogen 3.026 N/A ARG 48.A NH2 GLU 161.A OE2 no hydrogen 3.101 N/A THR 51.A N SER 84.A O no hydrogen 2.972 N/A THR 51.A OG1 ASN 56.A OD1 no hydrogen 2.654 N/A ALA 55.A N SER 52.A OG no hydrogen 3.036 N/A ASN 56.A N SER 52.A O no hydrogen 2.887 N/A LYS 57.A N PRO 53.A O no hydrogen 3.211 N/A LYS 57.A N LYS 54.A O no hydrogen 3.167 N/A ILE 59.A N ALA 55.A O no hydrogen 3.047 N/A LEU 60.A N ASN 56.A O no hydrogen 2.823 N/A ASP 61.A N LYS 57.A O no hydrogen 2.999 N/A GLU 62.A N GLU 58.A O no hydrogen 3.235 N/A ALA 63.A N ILE 59.A O no hydrogen 2.808 N/A TYR 64.A N LEU 60.A O no hydrogen 2.927 N/A VAL 65.A N ASP 61.A O no hydrogen 3.426 N/A MET 66.A N GLU 62.A O no hydrogen 2.883 N/A ALA 67.A N ALA 63.A O no hydrogen 2.846 N/A SER 68.A N VAL 65.A O no hydrogen 2.983 N/A SER 68.A OG VAL 65.A O no hydrogen 2.664 N/A VAL 69.A N MET 66.A O no hydrogen 3.347 N/A ASP 70.A N TYR 127.A OH no hydrogen 2.963 N/A HIS 73.A N ASN 71.A OD1 no hydrogen 2.827 N/A HIS 73.A ND1 VAL 151.A O no hydrogen 2.949 N/A VAL 74.A N ASN 71.A O no hydrogen 3.292 N/A CYS 75.A N ILE 153.A O no hydrogen 2.876 N/A CYS 75.A SG ILE 153.A O no hydrogen 3.824 N/A ARG 76.A NH2 LEU 3.A O no hydrogen 2.880 N/A ARG 76.A NH2 ALA 67.A O no hydrogen 2.939 N/A LEU 77.A N MET 66.A O no hydrogen 3.200 N/A LEU 78.A N ILE 89.A O no hydrogen 2.843 N/A GLY 79.A N ILE 89.A O no hydrogen 3.295 N/A ILE 80.A N ARG 5.A O no hydrogen 2.945 N/A CYS 81.A N GLN 87.A O no hydrogen 2.802 N/A CYS 81.A SG LEU 7.A O no hydrogen 3.431 N/A THR 83.A OG1 CYS 81.A O no hydrogen 3.430 N/A THR 83.A OG1 THR 85.A O no hydrogen 2.693 N/A THR 85.A OG1.A GLU 46.A OE2 no hydrogen 3.016 N/A GLN 87.A N CYS 81.A O no hydrogen 3.017 N/A GLN 87.A NE2 GLU 9.A OE2 no hydrogen 2.857 N/A GLN 87.A NE2 THR 83.A OG1 no hydrogen 2.986 N/A LEU 88.A N LYS 45.A O no hydrogen 2.819 N/A ILE 89.A N GLY 79.A O no hydrogen 2.936 N/A THR 90.A N ALA 43.A O no hydrogen 3.003 N/A THR 90.A OG1 GLN 91.A O no hydrogen 3.140 N/A LEU 92.A N PRO 41.A O no hydrogen 3.026 N/A PHE 95.A N VAL 145.A O no hydrogen 3.079 N/A GLY 96.A N MET 93.A O no hydrogen 3.200 N/A CYS 97.A SG ASP 100.A OD2 no hydrogen 3.349 N/A LEU 98.A N VAL 143.A O no hydrogen 2.767 N/A LEU 99.A N ALA 140.A O no hydrogen 3.314 N/A TYR 101.A N CYS 97.A O no hydrogen 2.974 N/A VAL 102.A N LEU 98.A O no hydrogen 2.921 N/A ARG 103.A N LEU 99.A O no hydrogen 3.202 N/A ARG 103.A NE GLY 201.A O no hydrogen 2.821 N/A ARG 103.A NH2 GLY 201.A O no hydrogen 2.983 N/A GLU 104.A N ASP 100.A O no hydrogen 2.878 N/A HIS 105.A N TYR 101.A O no hydrogen 2.914 N/A ASN 108.A N HIS 105.A O no hydrogen 2.874 N/A SER 111.A N ASP 274.A OD2 no hydrogen 2.894 N/A SER 111.A OG ASP 274.A OD2 no hydrogen 2.723 N/A GLN 112.A NE2 ILE 278.A O no hydrogen 3.583 N/A LEU 114.A N GLY 110.A O no hydrogen 3.275 N/A LEU 115.A N SER 111.A O no hydrogen 2.973 N/A ASN 116.A N GLN 112.A O no hydrogen 2.944 N/A ASN 116.A ND2.A GLN 112.A O no hydrogen 2.821 N/A TRP 117.A N TYR 113.A O no hydrogen 2.937 N/A TRP 117.A NE1 PRO 148.A O no hydrogen 2.822 N/A CYS 118.A N LEU 114.A O no hydrogen 3.114 N/A CYS 118.A SG LEU 114.A O no hydrogen 3.383 N/A VAL 119.A N LEU 115.A O no hydrogen 3.001 N/A GLN 120.A N ASN 116.A O no hydrogen 2.922 N/A GLN 120.A NE2 GLN 149.A O no hydrogen 2.962 N/A ILE 121.A N TRP 117.A O no hydrogen 2.905 N/A ALA 122.A N CYS 118.A O no hydrogen 3.054 N/A LYS 123.A N VAL 119.A O no hydrogen 2.884 N/A GLY 124.A N GLN 120.A O no hydrogen 2.954 N/A MET 125.A N ILE 121.A O no hydrogen 2.918 N/A ASN 126.A N ALA 122.A O no hydrogen 2.835 N/A TYR 127.A N LYS 123.A O no hydrogen 3.071 N/A LEU 128.A N GLY 124.A O no hydrogen 3.042 N/A GLU 129.A N MET 125.A O no hydrogen 2.881 N/A ASP 130.A N ASN 126.A O no hydrogen 2.869 N/A ARG 131.A N TYR 127.A O no hydrogen 2.933 N/A ARG 131.A NH1 SER 68.A OG no hydrogen 3.124 N/A ARG 131.A NH1 TYR 127.A OH no hydrogen 2.986 N/A ARG 131.A NH2 SER 68.A OG no hydrogen 2.911 N/A ARG 132.A N GLU 129.A O no hydrogen 2.884 N/A LEU 133.A N LEU 128.A O no hydrogen 2.872 N/A HIS 135.A N ASP 186.A OD2 no hydrogen 2.805 N/A HIS 135.A NE2 THR 154.A O no hydrogen 2.832 N/A ARG 136.A N ASP 186.A OD1 no hydrogen 2.995 N/A ASP 137.A N HIS 135.A ND1 no hydrogen 2.950 N/A ALA 140.A N GLU 196.A OE1 no hydrogen 2.869 N/A ARG 141.A NE TYR 164.A OH no hydrogen 2.869 N/A ARG 141.A NH1 ASP 137.A OD1 no hydrogen 2.937 N/A ARG 141.A NH1 TYR 164.A OH no hydrogen 3.500 N/A ASN 142.A N ALA 139.A O no hydrogen 2.866 N/A ASN 142.A ND2 ASP 137.A O no hydrogen 2.841 N/A ASN 142.A ND2 ASP 137.A OD2 no hydrogen 3.216 N/A VAL 143.A N ALA 140.A O no hydrogen 3.270 N/A LEU 144.A N LYS 152.A O no hydrogen 2.762 N/A VAL 145.A N GLY 96.A O no hydrogen 2.798 N/A LYS 146.A N HIS 150.A O no hydrogen 2.883 N/A THR 147.A N HIS 150.A O no hydrogen 3.262 N/A GLN 149.A N THR 147.A OG1 no hydrogen 3.148 N/A GLN 149.A NE2 THR 147.A OG1 no hydrogen 3.284 N/A HIS 150.A N THR 147.A O no hydrogen 2.934 N/A HIS 150.A NE2 PRO 72.A O no hydrogen 2.780 N/A VAL 151.A N GLN 120.A OE1 no hydrogen 2.864 N/A LYS 152.A N LEU 144.A O no hydrogen 2.863 N/A ILE 153.A N HIS 73.A O no hydrogen 2.861 N/A THR 154.A N ASN 142.A O no hydrogen 2.915 N/A THR 154.A OG1 ASP 155.A OD1 no hydrogen 3.380 N/A GLY 157.A N HIS 135.A O no hydrogen 2.771 N/A ARG 158.A NE GLU 62.A OE1.A no hydrogen 2.306 N/A ARG 158.A NE GLU 62.A OE2.A no hydrogen 3.087 N/A ARG 158.A NH1 GLU 62.A OE2.B no hydrogen 3.290 N/A GLU 163.A N GLU 160.A O no hydrogen 3.026 N/A TYR 164.A N GLU 161.A O no hydrogen 3.173 N/A TYR 164.A OH ASP 137.A OD1 no hydrogen 3.333 N/A TYR 164.A OH ASP 137.A OD2 no hydrogen 2.456 N/A HIS 165.A N VAL 166.A O no hydrogen 2.789 N/A ILE 168.A N VAL 166.A O no hydrogen 2.861 N/A LYS 169.A NZ TYR 205.A O no hydrogen 2.904 N/A LYS 169.A NZ ILE 208.A O no hydrogen 2.806 N/A TRP 170.A N PRO 167.A O no hydrogen 2.938 N/A TRP 170.A NE1 GLU 196.A OE1 no hydrogen 2.878 N/A MET 171.A N ILE 168.A O no hydrogen 3.141 N/A GLU 174.A N GLU 174.A OE1 no hydrogen 2.791 N/A SER 175.A N ALA 172.A O no hydrogen 2.914 N/A SER 175.A OG ILE 180.A O no hydrogen 2.650 N/A ILE 176.A N ALA 172.A O no hydrogen 3.086 N/A LEU 177.A N LEU 173.A O no hydrogen 2.900 N/A HIS 178.A N GLU 174.A O no hydrogen 2.942 N/A ARG 179.A N SER 175.A O no hydrogen 2.910 N/A ILE 180.A N GLU 174.A O no hydrogen 3.457 N/A THR 182.A N SER 185.A OG no hydrogen 2.819 N/A GLN 184.A NE2 ALA 245.A O no hydrogen 3.099 N/A GLN 184.A NE2 ARG 248.A O no hydrogen 3.365 N/A GLN 184.A NE2 PRO 249.A O no hydrogen 3.290 N/A SER 185.A N THR 182.A OG1 no hydrogen 3.121 N/A SER 185.A OG THR 182.A O no hydrogen 2.944 N/A ASP 186.A N THR 182.A O no hydrogen 3.093 N/A VAL 187.A N HIS 183.A O no hydrogen 3.035 N/A TRP 188.A N GLN 184.A O no hydrogen 3.337 N/A SER 189.A N SER 185.A O no hydrogen 3.170 N/A SER 189.A OG TRP 170.A O no hydrogen 2.724 N/A SER 189.A OG SER 185.A O no hydrogen 3.430 N/A TYR 190.A N ASP 186.A O no hydrogen 2.824 N/A TYR 190.A OH CYS 118.A O no hydrogen 2.761 N/A GLY 191.A N VAL 187.A O no hydrogen 3.001 N/A VAL 192.A N TRP 188.A O no hydrogen 3.137 N/A THR 193.A N SER 189.A O no hydrogen 2.879 N/A THR 193.A OG1 SER 189.A O no hydrogen 2.901 N/A VAL 194.A N TYR 190.A O no hydrogen 2.874 N/A TRP 195.A N GLY 191.A O no hydrogen 3.013 N/A TRP 195.A NE1 PRO 224.A O no hydrogen 2.792 N/A GLU 196.A N VAL 192.A O no hydrogen 2.827 N/A LEU 197.A N THR 193.A O no hydrogen 2.989 N/A MET 198.A N VAL 194.A O no hydrogen 2.934 N/A THR 199.A N TRP 195.A O no hydrogen 3.078 N/A THR 199.A OG1 TRP 195.A O no hydrogen 2.927 N/A THR 199.A OG1 GLU 196.A O no hydrogen 3.170 N/A PHE 200.A N LEU 197.A O no hydrogen 3.008 N/A GLY 201.A N GLU 196.A O no hydrogen 2.715 N/A SER 202.A N THR 199.A OG1 no hydrogen 3.155 N/A SER 202.A OG THR 199.A O no hydrogen 2.829 N/A ILE 208.A N TYR 205.A O no hydrogen 3.096 N/A GLU 212.A N PRO 209.A O no hydrogen 2.891 N/A ILE 213.A N ALA 210.A O no hydrogen 3.164 N/A ILE 216.A N GLU 212.A O no hydrogen 3.121 N/A LEU 217.A N ILE 213.A O no hydrogen 2.949 N/A GLU 218.A N SER 214.A O no hydrogen 2.927 N/A LYS 219.A N SER 215.A O no hydrogen 3.052 N/A GLY 220.A N LEU 217.A O no hydrogen 2.993 N/A GLU 221.A N ILE 216.A O no hydrogen 3.038 N/A ARG 222.A NE TRP 241.A O no hydrogen 2.927 N/A ARG 222.A NH1 LEU 217.A O no hydrogen 3.015 N/A ARG 222.A NH1 GLU 221.A O no hydrogen 2.846 N/A ARG 222.A NH2 TRP 241.A O no hydrogen 2.932 N/A GLN 225.A NE2 CYS 229.A O no hydrogen 2.911 N/A CYS 229.A N PRO 226.A O no hydrogen 2.938 N/A CYS 229.A SG.B THR 230.A O no hydrogen 3.507 N/A THR 230.A N TYR 268.A O no hydrogen 3.150 N/A THR 230.A OG1 TYR 268.A O no hydrogen 2.783 N/A TYR 234.A N THR 230.A O no hydrogen 3.174 N/A TYR 234.A OH LEU 223.A O no hydrogen 2.648 N/A MET 235.A N ILE 231.A O no hydrogen 2.822 N/A MET 237.A N VAL 233.A O no hydrogen 3.280 N/A ARG 238.A N TYR 234.A O no hydrogen 2.892 N/A ARG 238.A NH1 TYR 234.A OH no hydrogen 3.053 N/A LYS 239.A N MET 235.A O no hydrogen 2.955 N/A CYS 240.A N ILE 236.A O no hydrogen 3.179 N/A CYS 240.A SG ILE 236.A O no hydrogen 3.481 N/A TRP 241.A N ARG 238.A O no hydrogen 3.016 N/A MET 242.A N LYS 239.A O no hydrogen 3.421 N/A ASP 246.A N ASP 244.A OD1 no hydrogen 3.089 N/A SER 247.A N ASP 244.A O no hydrogen 2.978 N/A SER 247.A OG.B ASP 244.A O no hydrogen 2.933 N/A ARG 248.A N ALA 245.A O no hydrogen 3.257 N/A ARG 248.A NE MET 242.A O no hydrogen 2.858 N/A ARG 248.A NH1 GLU 174.A OE2 no hydrogen 2.835 N/A ARG 248.A NH1 GLN 184.A O no hydrogen 2.985 N/A ARG 248.A NH2 GLU 174.A OE1 no hydrogen 2.839 N/A ARG 248.A NH2 GLU 174.A OE2 no hydrogen 3.522 N/A ARG 248.A NH2 MET 242.A O no hydrogen 2.992 N/A LYS 250.A N GLU 253.A OE1 no hydrogen 2.881 N/A LYS 250.A NZ GLU 129.A OE2 no hydrogen 2.613 N/A LYS 250.A NZ GLN 184.A OE1 no hydrogen 2.802 N/A LEU 254.A N LYS 250.A O no hydrogen 2.981 N/A ILE 255.A N PHE 251.A O no hydrogen 2.950 N/A ILE 256.A N ARG 252.A O no hydrogen 3.217 N/A GLU 257.A N GLU 253.A O no hydrogen 2.960 N/A PHE 258.A N LEU 254.A O no hydrogen 2.927 N/A SER 259.A N ILE 255.A O no hydrogen 2.917 N/A SER 259.A OG ILE 255.A O no hydrogen 2.732 N/A LYS 260.A N ILE 256.A O no hydrogen 3.038 N/A MET 261.A N GLU 257.A O no hydrogen 3.113 N/A ALA 262.A N PHE 258.A O no hydrogen 2.904 N/A ARG 263.A N LYS 260.A O no hydrogen 3.008 N/A ASP 264.A N MET 261.A O no hydrogen 2.999 N/A GLN 266.A NE2 ASP 274.A OD1 no hydrogen 3.477 N/A ARG 267.A N ASP 264.A O no hydrogen 3.068 N/A ARG 267.A NE ARG 267.A O no hydrogen 2.976 N/A TYR 268.A N PRO 265.A O no hydrogen 3.036 N/A LEU 269.A N PRO 265.A O no hydrogen 3.089 N/A VAL 270.A N ILE 228.A O no hydrogen 2.855 N/A ASP 274.A N ILE 271.A O no hydrogen 3.037 N/A ARG 276.A NE ASP 264.A OD1 no hydrogen 2.998 N/A ARG 276.A NH1 ASP 264.A OD2 no hydrogen 3.026 N/A ILE 278.A N ASN 116.A OD1.A no hydrogen 2.971 N/A GLN 281.A N ARG 263.A O no hydrogen 2.889 N/A