Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2dkn_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N HIS 25.A ND1 no hydrogen 2.857 N/A SER 1.A OG HIS 25.A ND1 no hydrogen 3.054 N/A VAL 2.A N ASP 63.A OD1 no hydrogen 2.923 N/A ILE 3.A N THR 26.A O no hydrogen 2.861 N/A ALA 4.A N GLY 64.A O no hydrogen 2.949 N/A ILE 5.A N ILE 28.A O no hydrogen 2.916 N/A THR 6.A N VAL 66.A O no hydrogen 2.875 N/A GLY 7.A N ILE 30.A O no hydrogen 2.733 N/A SER 8.A N ILE 30.A O no hydrogen 3.504 N/A ALA 9.A N ASP 31.A OD1 no hydrogen 2.936 N/A ALA 14.A N SER 10.A O no hydrogen 3.036 N/A ALA 15.A N GLY 11.A O no hydrogen 3.024 N/A LEU 16.A N ILE 12.A O no hydrogen 2.910 N/A LYS 17.A N GLY 13.A O no hydrogen 2.863 N/A LYS 17.A NZ SER 8.A O no hydrogen 2.986 N/A GLU 18.A N ALA 14.A O no hydrogen 3.101 N/A LEU 19.A N ALA 15.A O no hydrogen 2.920 N/A LEU 20.A N LEU 16.A O no hydrogen 2.886 N/A ALA 21.A N LYS 17.A O no hydrogen 3.016 N/A ARG 22.A N GLU 18.A O no hydrogen 3.037 N/A ALA 23.A N LEU 19.A O no hydrogen 3.168 N/A GLY 24.A N ALA 21.A O no hydrogen 2.916 N/A HIS 25.A N LEU 20.A O no hydrogen 2.997 N/A THR 26.A N SER 1.A O no hydrogen 2.838 N/A ILE 28.A N ILE 3.A O no hydrogen 2.866 N/A GLY 29.A N ASP 36.A OD1 no hydrogen 2.817 N/A ILE 30.A N ILE 5.A O no hydrogen 2.951 N/A ASP 31.A N ILE 37.A O no hydrogen 3.036 N/A ARG 32.A N ASP 31.A OD2 no hydrogen 2.711 N/A ILE 37.A N GLY 29.A O no hydrogen 2.910 N/A ALA 39.A N ASP 31.A O no hydrogen 2.900 N/A SER 42.A N ASP 40.A OD2 no hydrogen 3.053 N/A SER 42.A OG ASP 40.A OD1 no hydrogen 3.269 N/A SER 42.A OG ASP 40.A OD2 no hydrogen 2.763 N/A THR 43.A N ASP 40.A O no hydrogen 3.492 N/A GLY 46.A N THR 43.A OG1 no hydrogen 3.125 N/A ARG 47.A N THR 43.A O no hydrogen 2.980 N/A ARG 47.A NE LEU 41.A O no hydrogen 2.828 N/A ARG 47.A NH1 GLU 135.A OE1 no hydrogen 3.455 N/A ARG 47.A NH1 GLU 135.A OE2 no hydrogen 2.866 N/A ARG 47.A NH2 ALA 83.A O no hydrogen 2.943 N/A ARG 47.A NH2 GLU 135.A OE1 no hydrogen 2.715 N/A GLU 48.A N PRO 44.A O no hydrogen 2.955 N/A THR 49.A N GLY 45.A O no hydrogen 3.093 N/A THR 49.A OG1 GLY 45.A O no hydrogen 3.226 N/A ALA 50.A N GLY 46.A O no hydrogen 2.991 N/A VAL 51.A N ARG 47.A O no hydrogen 2.861 N/A ALA 52.A N GLU 48.A O no hydrogen 3.002 N/A ALA 53.A N THR 49.A O no hydrogen 2.897 N/A VAL 54.A N ALA 50.A O no hydrogen 2.827 N/A LEU 55.A N VAL 51.A O no hydrogen 2.908 N/A ASP 56.A N ALA 52.A O no hydrogen 2.980 N/A ARG 57.A N ALA 53.A O no hydrogen 2.993 N/A CYS 58.A N VAL 54.A O no hydrogen 2.971 N/A CYS 58.A SG VAL 54.A O no hydrogen 3.359 N/A CYS 58.A SG LEU 55.A O no hydrogen 3.875 N/A CYS 58.A SG VAL 61.A O no hydrogen 3.415 N/A GLY 59.A N ASP 56.A O no hydrogen 3.378 N/A GLY 60.A N LEU 55.A O no hydrogen 2.907 N/A VAL 61.A N CYS 58.A O no hydrogen 3.285 N/A LEU 62.A N ALA 99.A O no hydrogen 3.047 N/A ASP 63.A N VAL 2.A O no hydrogen 2.981 N/A GLY 64.A N VAL 2.A O no hydrogen 3.173 N/A LEU 65.A N ALA 107.A O no hydrogen 3.239 N/A VAL 66.A N ALA 4.A O no hydrogen 2.807 N/A CYS 67.A N VAL 109.A O no hydrogen 2.894 N/A CYS 68.A N THR 6.A O no hydrogen 3.267 N/A CYS 68.A N THR 6.A OG1 no hydrogen 2.877 N/A ALA 69.A N THR 6.A OG1 no hydrogen 3.001 N/A VAL 71.A N ASN 85.A OD1 no hydrogen 2.939 N/A ALA 75.A N GLY 72.A O no hydrogen 2.991 N/A GLY 79.A N GLU 143.A OE2 no hydrogen 2.758 N/A LEU 80.A N ASN 77.A O no hydrogen 3.222 N/A VAL 81.A N ASN 77.A O no hydrogen 3.397 N/A VAL 82.A N SER 78.A O no hydrogen 3.238 N/A ALA 83.A N GLY 79.A O no hydrogen 2.976 N/A VAL 84.A N LEU 80.A O no hydrogen 2.959 N/A ASN 85.A N VAL 81.A O no hydrogen 2.786 N/A ASN 85.A ND2 VAL 71.A O no hydrogen 2.988 N/A ASN 85.A ND2 SER 155.A OG no hydrogen 3.383 N/A TYR 86.A N VAL 82.A O no hydrogen 3.043 N/A TYR 86.A OH MET 130.A O no hydrogen 3.187 N/A PHE 87.A N VAL 82.A O no hydrogen 3.344 N/A GLY 88.A N ALA 83.A O no hydrogen 2.853 N/A VAL 89.A N TYR 86.A O no hydrogen 3.150 N/A SER 90.A N TYR 86.A O no hydrogen 2.851 N/A SER 90.A OG TYR 86.A O no hydrogen 3.411 N/A SER 90.A OG PHE 87.A O no hydrogen 3.559 N/A ALA 91.A N PHE 87.A O no hydrogen 2.994 N/A LEU 93.A N VAL 89.A O no hydrogen 2.935 N/A ASP 94.A N SER 90.A O no hydrogen 2.839 N/A GLY 95.A N ALA 91.A O no hydrogen 2.949 N/A LEU 96.A N LEU 92.A O no hydrogen 3.013 N/A LEU 100.A N LEU 96.A O no hydrogen 2.898 N/A SER 101.A N ALA 97.A O no hydrogen 2.903 N/A SER 101.A OG GLU 98.A O no hydrogen 2.582 N/A ARG 102.A N GLU 98.A O no hydrogen 3.250 N/A ARG 102.A N ALA 99.A O no hydrogen 3.156 N/A GLY 103.A N LEU 100.A O no hydrogen 2.998 N/A GLN 104.A N ASP 63.A OD2 no hydrogen 2.794 N/A ALA 107.A N ASP 63.A O no hydrogen 3.164 N/A ALA 108.A N ARG 176.A O no hydrogen 2.809 N/A VAL 109.A N LEU 65.A O no hydrogen 2.871 N/A ILE 110.A N ASN 178.A O no hydrogen 2.980 N/A VAL 111.A N CYS 67.A O no hydrogen 3.027 N/A GLY 112.A N VAL 180.A O no hydrogen 2.725 N/A ILE 114.A N PRO 182.A O no hydrogen 3.031 N/A ALA 115.A N SER 113.A OG no hydrogen 2.940 N/A ALA 116.A N SER 113.A O no hydrogen 2.945 N/A THR 117.A N ILE 114.A O no hydrogen 2.927 N/A THR 117.A OG1 ILE 114.A O no hydrogen 2.629 N/A GLN 118.A N ALA 115.A O no hydrogen 3.059 N/A ALA 121.A N GLN 118.A O no hydrogen 3.104 N/A GLU 123.A N GLY 120.A O no hydrogen 3.077 N/A LEU 124.A N ALA 121.A O no hydrogen 3.277 N/A VAL 127.A N LEU 124.A O no hydrogen 2.985 N/A ALA 129.A N PRO 125.A O no hydrogen 3.478 N/A MET 130.A N MET 126.A O no hydrogen 2.912 N/A LEU 131.A N VAL 127.A O no hydrogen 2.959 N/A ALA 132.A N GLU 128.A O no hydrogen 2.937 N/A GLY 133.A N MET 130.A O no hydrogen 2.851 N/A ASP 134.A N ALA 129.A O no hydrogen 3.001 N/A ARG 137.A N ASP 134.A OD1 no hydrogen 3.152 N/A ARG 137.A NH1 GLU 140.A OE1 no hydrogen 2.825 N/A ALA 138.A N ASP 134.A O no hydrogen 2.917 N/A ILE 139.A N GLU 135.A O no hydrogen 2.920 N/A GLU 140.A N ALA 136.A O no hydrogen 3.015 N/A LEU 141.A N ARG 137.A O no hydrogen 2.914 N/A ALA 142.A N ALA 138.A O no hydrogen 2.836 N/A GLU 143.A N ILE 139.A O no hydrogen 2.911 N/A GLN 144.A N GLU 140.A O no hydrogen 2.923 N/A GLN 145.A N LEU 141.A O no hydrogen 2.818 N/A GLY 146.A N ALA 142.A O no hydrogen 3.268 N/A THR 148.A OG1 VAL 73.A O no hydrogen 2.728 N/A HIS 149.A N TYR 199.A OH no hydrogen 3.241 N/A HIS 149.A ND1 TYR 199.A OH no hydrogen 2.945 N/A LEU 150.A N GLN 147.A O no hydrogen 3.001 N/A ALA 151.A N GLN 147.A O no hydrogen 3.249 N/A TYR 152.A N THR 148.A O no hydrogen 2.734 N/A ALA 153.A N HIS 149.A O no hydrogen 2.992 N/A GLY 154.A N LEU 150.A O no hydrogen 2.796 N/A SER 155.A N ALA 151.A O no hydrogen 2.869 N/A SER 155.A OG ALA 151.A O no hydrogen 2.831 N/A SER 155.A OG TYR 152.A O no hydrogen 3.029 N/A LYS 156.A N TYR 152.A O no hydrogen 2.991 N/A LYS 156.A NZ VAL 111.A O no hydrogen 2.838 N/A LYS 156.A NZ GLY 112.A O no hydrogen 3.332 N/A TYR 157.A N ALA 153.A O no hydrogen 2.834 N/A ALA 158.A N GLY 154.A O no hydrogen 2.884 N/A VAL 159.A N SER 155.A O no hydrogen 2.957 N/A THR 160.A N LYS 156.A O no hydrogen 3.101 N/A THR 160.A OG1 LYS 156.A O no hydrogen 2.785 N/A CYS 161.A N TYR 157.A O no hydrogen 2.989 N/A CYS 161.A SG TYR 157.A O no hydrogen 3.660 N/A LEU 162.A N ALA 158.A O no hydrogen 2.852 N/A ALA 163.A N VAL 159.A O no hydrogen 3.229 N/A ARG 164.A N THR 160.A O no hydrogen 3.266 N/A ARG 165.A N CYS 161.A O no hydrogen 2.688 N/A ARG 165.A NH1 LEU 131.A O no hydrogen 2.868 N/A ASN 166.A N LEU 162.A O no hydrogen 3.079 N/A VAL 167.A N ARG 164.A O no hydrogen 3.305 N/A TRP 170.A N ASN 166.A O no hydrogen 3.081 N/A ALA 171.A N VAL 167.A O no hydrogen 3.027 N/A GLY 172.A N VAL 168.A O no hydrogen 2.873 N/A ARG 173.A N ASP 169.A O no hydrogen 3.159 N/A GLY 174.A N ALA 171.A O no hydrogen 2.915 N/A VAL 175.A N TRP 170.A O no hydrogen 3.025 N/A ARG 176.A N PRO 106.A O no hydrogen 3.239 N/A ARG 176.A NH1 LEU 226.A O no hydrogen 2.978 N/A ARG 176.A NH1 ILE 234.A O no hydrogen 3.031 N/A ARG 176.A NH2 LEU 226.A O no hydrogen 2.959 N/A LEU 177.A N HIS 235.A ND1 no hydrogen 2.942 N/A ASN 178.A N ALA 108.A O no hydrogen 3.141 N/A ASN 178.A ND2 ILE 234.A O no hydrogen 2.948 N/A VAL 179.A N SER 237.A O no hydrogen 2.899 N/A VAL 180.A N ILE 110.A O no hydrogen 2.907 N/A ALA 181.A N LEU 239.A O no hydrogen 2.851 N/A GLY 183.A N VAL 241.A O no hydrogen 3.255 N/A GLU 186.A N SER 214.A O no hydrogen 3.058 N/A THR 187.A N VAL 185.A O no hydrogen 2.649 N/A LEU 189.A N THR 187.A OG1 no hydrogen 3.137 N/A GLN 191.A N THR 187.A O no hydrogen 2.972 N/A ALA 192.A N PRO 188.A O no hydrogen 3.017 N/A SER 193.A N LEU 189.A O no hydrogen 3.167 N/A SER 193.A OG LEU 189.A O no hydrogen 3.339 N/A LYS 194.A N LEU 190.A O no hydrogen 2.876 N/A ALA 195.A N GLN 191.A O no hydrogen 3.181 N/A ASP 196.A N SER 193.A O no hydrogen 3.170 N/A ARG 198.A NH1 ARG 198.A O no hydrogen 3.314 N/A TYR 199.A N ASP 196.A OD2 no hydrogen 2.807 N/A TYR 199.A OH HIS 149.A ND1 no hydrogen 2.945 N/A GLY 200.A N ASP 196.A O no hydrogen 2.802 N/A THR 203.A N TYR 199.A O no hydrogen 2.783 N/A THR 203.A OG1 TYR 199.A O no hydrogen 2.822 N/A ARG 204.A N GLY 200.A O no hydrogen 2.857 N/A ARG 204.A N GLU 201.A O no hydrogen 3.128 N/A ARG 204.A NH2 LYS 194.A O no hydrogen 2.634 N/A ARG 205.A NE GLU 201.A OE2 no hydrogen 2.876 N/A ARG 205.A NH2 GLU 201.A OE1 no hydrogen 2.652 N/A LEU 210.A N GLY 243.A O no hydrogen 3.015 N/A GLY 211.A N ALA 208.A O no hydrogen 2.784 N/A ARG 212.A NH1 GLY 213.A O no hydrogen 3.047 N/A ARG 212.A NH1 GLU 218.A OE2 no hydrogen 2.749 N/A ARG 212.A NH2 GLU 218.A OE1 no hydrogen 2.775 N/A ARG 212.A NH2 GLU 218.A OE2 no hydrogen 3.471 N/A SER 214.A N ALA 184.A O no hydrogen 2.937 N/A SER 214.A OG GLU 215.A O no hydrogen 2.895 N/A SER 214.A OG GLU 218.A OE2 no hydrogen 3.553 N/A GLU 215.A N GLU 218.A OE2 no hydrogen 2.774 N/A ARG 217.A NE GLU 221.A OE1 no hydrogen 3.395 N/A GLU 218.A N GLU 215.A O no hydrogen 2.888 N/A ALA 220.A N PRO 216.A O no hydrogen 2.961 N/A GLU 221.A N ARG 217.A O no hydrogen 2.900 N/A ALA 222.A N GLU 218.A O no hydrogen 3.407 N/A ILE 223.A N VAL 219.A O no hydrogen 3.031 N/A ALA 224.A N ALA 220.A O no hydrogen 2.813 N/A PHE 225.A N GLU 221.A O no hydrogen 3.002 N/A LEU 226.A N ALA 222.A O no hydrogen 3.109 N/A LEU 227.A N ILE 223.A O no hydrogen 2.927 N/A GLY 228.A N ALA 224.A O no hydrogen 3.172 N/A GLY 228.A N PHE 225.A O no hydrogen 3.154 N/A ALA 231.A N GLY 228.A O no hydrogen 3.097 N/A SER 232.A OG PRO 229.A O no hydrogen 3.406 N/A ILE 234.A N ALA 231.A O no hydrogen 2.957 N/A HIS 235.A NE2 VAL 167.A O no hydrogen 2.823 N/A GLY 236.A N LEU 177.A O no hydrogen 2.773 N/A SER 237.A N ASN 178.A OD1 no hydrogen 2.914 N/A LEU 239.A N VAL 179.A O no hydrogen 2.780 N/A VAL 241.A N ALA 181.A O no hydrogen 2.969 N/A GLY 244.A N ASP 242.A OD1 no hydrogen 2.956 N/A MET 245.A N ASP 242.A O no hydrogen 3.218 N/A ASP 246.A N ASP 242.A OD2 no hydrogen 2.763 N/A LEU 248.A N GLY 244.A O no hydrogen 2.912 N/A MET 249.A N MET 245.A O no hydrogen 2.954 N/A ARG 250.A N ASP 246.A O no hydrogen 2.794 N/A ARG 250.A NE ASP 246.A OD1 no hydrogen 2.707 N/A ARG 250.A NH2 ASP 246.A OD1 no hydrogen 3.206 N/A THR 253.A N ARG 250.A O no hydrogen 3.192 N/A