Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8aau_L.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 5.A N ILE 73.A O no hydrogen 3.129 N/A ARG 5.A NH1 GLU 36.A OE1 no hydrogen 2.948 N/A ARG 5.A NH2 GLU 36.A OE2 no hydrogen 3.023 N/A PHE 7.A N VAL 75.A O no hydrogen 2.975 N/A ARG 8.A N ASP 11.A OD2 no hydrogen 2.771 N/A ASP 11.A N ARG 8.A O no hydrogen 2.832 N/A LEU 12.A N PRO 9.A O no hydrogen 3.447 N/A ILE 13.A N THR 30.A O no hydrogen 2.794 N/A HIS 14.A ND1 LEU 12.A O no hydrogen 3.087 N/A GLY 15.A N LYS 28.A O no hydrogen 2.854 N/A LEU 18.A N ALA 26.A O no hydrogen 2.777 N/A GLY 19.A N ALA 26.A O no hydrogen 3.258 N/A GLN 25.A N GLU 42.A O no hydrogen 2.967 N/A GLN 25.A NE2 GLU 42.A OE2 no hydrogen 2.894 N/A ALA 26.A N GLY 19.A O no hydrogen 2.810 N/A ILE 27.A N MET 40.A O no hydrogen 2.965 N/A LYS 28.A N GLU 16.A O no hydrogen 2.919 N/A LYS 28.A NZ GLU 16.A OE2 no hydrogen 2.793 N/A VAL 29.A N MET 38.A O no hydrogen 2.962 N/A THR 30.A N ILE 13.A O no hydrogen 3.150 N/A HIS 31.A N GLU 36.A O no hydrogen 2.946 N/A ARG 32.A N ASP 11.A O no hydrogen 2.960 N/A ARG 32.A NE SER 10.A O no hydrogen 3.019 N/A GLU 33.A N HIS 31.A ND1 no hydrogen 3.108 N/A THR 34.A N HIS 31.A ND1 no hydrogen 3.105 N/A GLY 35.A N HIS 31.A O no hydrogen 2.903 N/A GLU 36.A N THR 34.A OG1 no hydrogen 3.219 N/A MET 38.A N VAL 29.A O no hydrogen 2.818 N/A VAL 39.A N THR 86.A O no hydrogen 2.951 N/A MET 40.A N ILE 27.A O no hydrogen 2.935 N/A LYS 41.A N PHE 84.A O no hydrogen 2.880 N/A LYS 41.A NZ GLU 57.A OE1 no hydrogen 2.979 N/A GLU 42.A N GLN 25.A O no hydrogen 2.939 N/A ILE 44.A N PHE 23.A O no hydrogen 2.733 N/A ARG 45.A N PHE 23.A O no hydrogen 3.221 N/A GLN 51.A N ASP 47.A O no hydrogen 3.058 N/A ARG 52.A N GLU 48.A O no hydrogen 3.039 N/A THR 53.A N GLU 49.A O no hydrogen 3.208 N/A PHE 54.A N THR 50.A O no hydrogen 3.141 N/A LEU 55.A N GLN 51.A O no hydrogen 3.110 N/A LYS 56.A N ARG 52.A O no hydrogen 3.327 N/A GLU 57.A N THR 53.A O no hydrogen 3.273 N/A VAL 58.A N PHE 54.A O no hydrogen 3.168 N/A LYS 59.A N LEU 55.A O no hydrogen 3.001 N/A VAL 60.A N LYS 56.A O no hydrogen 2.996 N/A MET 61.A N GLU 57.A O no hydrogen 2.997 N/A ARG 62.A N VAL 58.A O no hydrogen 2.933 N/A CYS 63.A SG VAL 60.A O no hydrogen 3.412 N/A LEU 64.A N MET 61.A O no hydrogen 3.306 N/A GLU 65.A N TYR 123.A OH no hydrogen 2.856 N/A ASN 68.A N HIS 66.A ND1 no hydrogen 2.975 N/A ASN 68.A ND2 VAL 147.A O no hydrogen 2.888 N/A VAL 69.A N HIS 66.A O no hydrogen 3.117 N/A LEU 70.A N VAL 149.A O no hydrogen 2.997 N/A LYS 71.A N GLU 87.A OE2 no hydrogen 2.998 N/A ILE 73.A N ILE 85.A O no hydrogen 2.803 N/A GLY 74.A N ILE 85.A O no hydrogen 3.274 N/A VAL 75.A N ARG 5.A O no hydrogen 3.015 N/A LEU 76.A N ASN 83.A O no hydrogen 3.177 N/A LYS 78.A N ARG 81.A O no hydrogen 3.002 N/A ARG 81.A N LYS 78.A O no hydrogen 2.866 N/A ASN 83.A N LEU 76.A O no hydrogen 2.726 N/A ASN 83.A ND2 GLU 42.A OE1 no hydrogen 3.542 N/A PHE 84.A N LYS 41.A O no hydrogen 3.216 N/A ILE 85.A N GLY 74.A O no hydrogen 2.893 N/A THR 86.A N VAL 39.A O no hydrogen 2.799 N/A THR 86.A OG1 GLU 87.A O no hydrogen 2.915 N/A GLU 87.A N LYS 71.A O no hydrogen 3.083 N/A GLY 92.A N VAL 141.A O no hydrogen 3.158 N/A LEU 94.A N CYS 139.A O no hydrogen 2.904 N/A ARG 95.A N SER 136.A O no hydrogen 3.057 N/A GLY 96.A N THR 93.A OG1 no hydrogen 2.965 N/A ILE 97.A N THR 93.A O no hydrogen 3.089 N/A ILE 98.A N LEU 94.A O no hydrogen 2.913 N/A LYS 99.A N ARG 95.A O no hydrogen 2.968 N/A SER 100.A N GLY 96.A O no hydrogen 3.359 N/A SER 100.A N ILE 97.A O no hydrogen 3.092 N/A SER 100.A OG ILE 97.A O no hydrogen 2.783 N/A MET 101.A N ILE 98.A O no hydrogen 3.059 N/A GLN 104.A N ASP 102.A OD1 no hydrogen 2.919 N/A TYR 105.A N ASP 102.A O no hydrogen 3.207 N/A ARG 110.A N PRO 106.A O no hydrogen 3.161 N/A ARG 110.A NE TYR 105.A O no hydrogen 3.091 N/A ARG 110.A NH1 ILE 199.A O no hydrogen 3.151 N/A ARG 110.A NH2 TYR 105.A O no hydrogen 3.041 N/A VAL 111.A N TRP 107.A O no hydrogen 2.950 N/A SER 112.A N SER 108.A O no hydrogen 2.983 N/A PHE 113.A N GLN 109.A O no hydrogen 2.931 N/A ALA 114.A N ARG 110.A O no hydrogen 3.173 N/A LYS 115.A N VAL 111.A O no hydrogen 2.878 N/A ASP 116.A N SER 112.A O no hydrogen 2.973 N/A ILE 117.A N PHE 113.A O no hydrogen 3.158 N/A ALA 118.A N ALA 114.A O no hydrogen 2.970 N/A SER 119.A N LYS 115.A O no hydrogen 2.894 N/A SER 119.A OG HIS 66.A NE2 no hydrogen 3.182 N/A SER 119.A OG GLU 258.A OE2 no hydrogen 2.866 N/A GLY 120.A N ASP 116.A O no hydrogen 3.079 N/A MET 121.A N ILE 117.A O no hydrogen 2.983 N/A ALA 122.A N ALA 118.A O no hydrogen 2.831 N/A TYR 123.A N SER 119.A O no hydrogen 3.145 N/A LEU 124.A N GLY 120.A O no hydrogen 2.994 N/A HIS 125.A N MET 121.A O no hydrogen 2.958 N/A HIS 125.A NE2 ASP 188.A OD2 no hydrogen 2.877 N/A SER 126.A N ALA 122.A O no hydrogen 3.035 N/A SER 126.A OG TYR 123.A O no hydrogen 2.691 N/A MET 127.A N TYR 123.A O no hydrogen 3.274 N/A MET 127.A N LEU 124.A O no hydrogen 3.001 N/A ASN 128.A N HIS 125.A O no hydrogen 2.948 N/A ILE 129.A N LEU 124.A O no hydrogen 3.251 N/A ILE 130.A N ARG 156.A O no hydrogen 2.972 N/A HIS 131.A N ASP 188.A OD2 no hydrogen 2.888 N/A HIS 131.A NE2 ALA 150.A O no hydrogen 2.991 N/A ARG 132.A N ASP 188.A OD1 no hydrogen 2.945 N/A ARG 132.A NE LEU 154.A O no hydrogen 2.838 N/A ARG 132.A NH1 TYR 183.A OH no hydrogen 3.016 N/A ARG 132.A NH2 LEU 154.A O no hydrogen 2.885 N/A ASP 133.A N HIS 131.A ND1 no hydrogen 3.000 N/A SER 136.A OG GLU 198.A OE1 no hydrogen 2.688 N/A SER 136.A OG GLU 198.A OE2 no hydrogen 3.245 N/A HIS 137.A N ASN 135.A OD1 no hydrogen 2.953 N/A ASN 138.A N ASN 135.A O no hydrogen 3.222 N/A ASN 138.A ND2 ASP 133.A O no hydrogen 2.974 N/A CYS 139.A SG ASN 135.A O no hydrogen 3.530 N/A LEU 140.A N VAL 148.A O no hydrogen 2.868 N/A VAL 141.A N GLY 92.A O no hydrogen 2.778 N/A ARG 142.A N ASN 146.A O no hydrogen 2.889 N/A ARG 142.A NH2 GLU 87.A OE1 no hydrogen 2.984 N/A LYS 145.A N ARG 142.A O no hydrogen 2.884 N/A ASN 146.A N ASN 144.A OD1 no hydrogen 3.041 N/A VAL 147.A N ASP 116.A OD2 no hydrogen 2.965 N/A VAL 148.A N LEU 140.A O no hydrogen 2.822 N/A VAL 149.A N ASN 68.A O no hydrogen 2.853 N/A ALA 150.A N ASN 138.A O no hydrogen 3.018 N/A GLY 153.A N ASP 151.A OD1 no hydrogen 3.072 N/A ALA 155.A N PHE 152.A O no hydrogen 3.266 N/A ARG 156.A N ILE 130.A O no hydrogen 2.952 N/A MET 158.A N ASN 128.A O no hydrogen 2.796 N/A LYS 161.A N ASP 159.A OD1 no hydrogen 3.036 N/A LYS 162.A N TYR 183.A O no hydrogen 3.081 N/A TYR 171.A N ASN 169.A OD1 no hydrogen 2.858 N/A TRP 172.A N ASN 169.A O no hydrogen 3.105 N/A TRP 172.A NE1 GLU 198.A OE2 no hydrogen 2.865 N/A MET 173.A N PRO 170.A O no hydrogen 3.321 N/A GLU 176.A N GLU 176.A OE1 no hydrogen 2.832 N/A ILE 178.A N ALA 174.A O no hydrogen 2.948 N/A ASN 179.A N PRO 175.A O no hydrogen 2.953 N/A GLY 180.A N MET 177.A O no hydrogen 2.958 N/A ARG 181.A N GLU 176.A O no hydrogen 2.998 N/A TYR 183.A N LYS 162.A O no hydrogen 2.911 N/A TYR 183.A OH THR 165.A O no hydrogen 2.746 N/A GLU 185.A N GLU 185.A OE1 no hydrogen 2.845 N/A LYS 186.A N ASP 184.A OD1 no hydrogen 2.978 N/A LYS 186.A NZ PRO 248.A O no hydrogen 3.109 N/A LYS 186.A NZ ARG 251.A O no hydrogen 2.888 N/A VAL 187.A N ASP 184.A O no hydrogen 3.256 N/A ASP 188.A N GLU 185.A O no hydrogen 3.098 N/A VAL 189.A N LYS 186.A O no hydrogen 3.042 N/A PHE 190.A N LYS 186.A O no hydrogen 3.319 N/A SER 191.A N VAL 187.A O no hydrogen 3.158 N/A SER 191.A OG TRP 172.A O no hydrogen 2.800 N/A SER 191.A OG VAL 187.A O no hydrogen 3.403 N/A PHE 192.A N ASP 188.A O no hydrogen 2.985 N/A GLY 193.A N VAL 189.A O no hydrogen 2.919 N/A ILE 194.A N PHE 190.A O no hydrogen 3.081 N/A VAL 195.A N SER 191.A O no hydrogen 3.100 N/A LEU 196.A N PHE 192.A O no hydrogen 2.886 N/A CYS 197.A N GLY 193.A O no hydrogen 3.051 N/A CYS 197.A SG GLY 193.A O no hydrogen 3.512 N/A GLU 198.A N ILE 194.A O no hydrogen 3.045 N/A ILE 199.A N VAL 195.A O no hydrogen 3.028 N/A ILE 200.A N LEU 196.A O no hydrogen 2.961 N/A GLY 201.A N CYS 197.A O no hydrogen 2.940 N/A ARG 202.A NH1 MET 101.A O no hydrogen 2.825 N/A ASP 206.A N ASN 204.A OD1 no hydrogen 2.846 N/A ASP 208.A N ASP 206.A OD1 no hydrogen 2.807 N/A TYR 209.A N ASP 206.A O no hydrogen 2.776 N/A LEU 210.A N ASP 206.A O no hydrogen 3.028 N/A ARG 212.A NH1.A ALA 205.A O no hydrogen 3.127 N/A ARG 212.A NH1.A LEU 210.A O no hydrogen 3.359 N/A ARG 212.A NH2.A TYR 171.A O no hydrogen 2.636 N/A THR 213.A N GLY 217.A O no hydrogen 2.927 N/A THR 213.A OG1 ASP 215.A OD1 no hydrogen 2.367 N/A PHE 216.A N THR 213.A O no hydrogen 3.018 N/A GLY 217.A N ASP 215.A OD1 no hydrogen 3.240 N/A ASN 219.A N PRO 211.A O no hydrogen 2.891 N/A GLY 222.A N ASN 219.A OD1 no hydrogen 2.955 N/A PHE 223.A N ASN 219.A O no hydrogen 2.907 N/A LEU 224.A N VAL 220.A O no hydrogen 2.873 N/A ASP 225.A N ARG 221.A O no hydrogen 2.996 N/A ARG 226.A N GLY 222.A O no hydrogen 3.051 N/A TYR 227.A N PHE 223.A O no hydrogen 2.871 N/A TYR 227.A OH TYR 209.A O no hydrogen 3.242 N/A CYS 228.A N PHE 223.A O no hydrogen 3.023 N/A CYS 228.A SG PRO 229.A O no hydrogen 3.847 N/A CYS 232.A N PRO 229.A O no hydrogen 3.309 N/A CYS 232.A SG PRO 233.A O no hydrogen 3.978 N/A SER 235.A N ASP 282.A OD1 no hydrogen 2.862 N/A SER 235.A OG PRO 234.A O no hydrogen 2.636 N/A PHE 236.A N PRO 233.A O no hydrogen 3.368 N/A ILE 239.A N SER 235.A O no hydrogen 2.920 N/A THR 240.A N PHE 236.A O no hydrogen 3.172 N/A THR 240.A OG1 PHE 236.A O no hydrogen 2.979 N/A VAL 241.A N PHE 237.A O no hydrogen 2.945 N/A ARG 242.A N PRO 238.A O no hydrogen 3.103 N/A ARG 242.A NE LYS 250.A O no hydrogen 2.813 N/A ARG 242.A NH2 LYS 250.A O no hydrogen 3.031 N/A CYS 243.A N ILE 239.A O no hydrogen 3.080 N/A CYS 243.A SG ILE 239.A O no hydrogen 3.513 N/A CYS 244.A N THR 240.A O no hydrogen 3.175 N/A CYS 244.A SG THR 240.A O no hydrogen 3.568 N/A ASP 245.A N ARG 242.A O no hydrogen 3.199 N/A ASP 247.A N ASP 245.A OD1 no hydrogen 2.922 N/A GLU 249.A N ASP 247.A OD1 no hydrogen 2.948 N/A LYS 250.A N ASP 247.A O no hydrogen 2.943 N/A ARG 251.A N PRO 248.A O no hydrogen 3.127 N/A ARG 251.A NE ASP 245.A O no hydrogen 2.823 N/A ARG 251.A NH1 GLU 176.A OE2 no hydrogen 2.901 N/A ARG 251.A NH1 LYS 186.A O no hydrogen 3.019 N/A ARG 251.A NH2 GLU 176.A OE1 no hydrogen 2.839 N/A ARG 251.A NH2 ASP 245.A O no hydrogen 3.070 N/A LYS 256.A N SER 253.A OG no hydrogen 3.073 N/A LEU 257.A N SER 253.A O no hydrogen 2.999 N/A GLU 258.A N PHE 254.A O no hydrogen 2.852 N/A HIS 259.A N VAL 255.A O no hydrogen 3.308 N/A TRP 260.A N LYS 256.A O no hydrogen 2.970 N/A TRP 260.A NE1 GLN 277.A OE1 no hydrogen 3.042 N/A LEU 261.A N LEU 257.A O no hydrogen 2.903 N/A GLU 262.A N GLU 258.A O no hydrogen 3.076 N/A THR 263.A N HIS 259.A O no hydrogen 3.058 N/A THR 263.A OG1 HIS 259.A O no hydrogen 2.932 N/A LEU 264.A N TRP 260.A O no hydrogen 2.994 N/A ARG 265.A N LEU 261.A O no hydrogen 2.874 N/A ARG 265.A NE GLU 262.A OE1 no hydrogen 3.003 N/A ARG 265.A NH2 GLU 262.A OE2 no hydrogen 3.013 N/A MET 266.A N GLU 262.A O no hydrogen 2.974 N/A HIS 267.A N THR 263.A O no hydrogen 2.969 N/A HIS 267.A ND1 LEU 272.A O no hydrogen 2.967 N/A LEU 268.A N LEU 264.A O no hydrogen 3.067 N/A ALA 269.A N ARG 265.A O no hydrogen 2.807 N/A GLY 270.A N MET 266.A O no hydrogen 2.798 N/A HIS 271.A N HIS 267.A O no hydrogen 2.899 N/A LEU 272.A N MET 266.A O no hydrogen 3.486 N/A GLU 279.A N GLY 275.A O no hydrogen 3.120 N/A GLN 280.A N PRO 276.A O no hydrogen 3.008 N/A LEU 281.A N GLN 277.A O no hydrogen 3.118 N/A ASP 282.A N LEU 278.A O no hydrogen 3.048 N/A ARG 283.A N GLU 279.A O no hydrogen 3.014 N/A GLY 284.A N GLN 280.A O no hydrogen 2.824 N/A PHE 285.A N LEU 281.A O no hydrogen 3.117 N/A TRP 286.A N ASP 282.A O no hydrogen 3.279 N/A GLU 287.A N ARG 283.A O no hydrogen 3.019 N/A THR 288.A N GLY 284.A O no hydrogen 3.137 N/A THR 288.A OG1 GLY 284.A O no hydrogen 3.304 N/A TYR 289.A N PHE 285.A O no hydrogen 2.829 N/A ARG 290.A N TRP 286.A O no hydrogen 3.074 N/A ARG 291.A N GLU 287.A O no hydrogen 3.231 N/A ARG 291.A N THR 288.A O no hydrogen 3.103 N/A