Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1tke_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N ASP 54.A OD1 no hydrogen 3.014 N/A ILE 4.A N ARG 12.A O no hydrogen 2.841 N/A THR 5.A N ALA 55.A O no hydrogen 2.934 N/A THR 5.A OG1 GLN 11.A OE1 no hydrogen 3.243 N/A LEU 6.A N SER 10.A O no hydrogen 2.920 N/A GLY 9.A N LEU 6.A O no hydrogen 2.911 N/A SER 10.A N ASP 8.A OD1 no hydrogen 2.869 N/A SER 10.A OG ASP 8.A OD1 no hydrogen 2.742 N/A ARG 12.A N ILE 4.A O no hydrogen 2.796 N/A TYR 14.A N PRO 2.A O no hydrogen 3.000 N/A TYR 14.A OH ASP 26.A OD2 no hydrogen 2.636 N/A HIS 16.A ND1 ASP 15.A OD1 no hydrogen 2.874 N/A VAL 18.A N ILE 51.A O no hydrogen 3.347 N/A SER 19.A N ASP 22.A OD2 no hydrogen 2.944 N/A SER 19.A OG ALA 47.A O no hydrogen 3.305 N/A MET 21.A N ALA 47.A O no hydrogen 2.998 N/A ASP 22.A N SER 19.A OG no hydrogen 3.024 N/A VAL 23.A N SER 19.A O no hydrogen 3.092 N/A ALA 24.A N PRO 20.A O no hydrogen 2.863 N/A LEU 25.A N MET 21.A O no hydrogen 2.937 N/A ASP 26.A N ASP 22.A O no hydrogen 3.147 N/A ILE 27.A N VAL 23.A O no hydrogen 3.059 N/A ILE 27.A N ALA 24.A O no hydrogen 3.098 N/A GLY 28.A N ALA 24.A O no hydrogen 2.967 N/A ALA 32.A N GLY 28.A O no hydrogen 3.232 N/A LYS 33.A N PRO 29.A O no hydrogen 3.037 N/A ALA 34.A N GLY 30.A O no hydrogen 3.080 N/A CYS 35.A N LEU 31.A O no hydrogen 2.901 N/A CYS 35.A N ALA 32.A O no hydrogen 3.353 N/A CYS 35.A SG ALA 37.A O no hydrogen 3.740 N/A ILE 36.A N ILE 60.A O no hydrogen 2.794 N/A ALA 37.A N ILE 60.A O no hydrogen 3.295 N/A GLY 38.A N VAL 45.A O no hydrogen 3.044 N/A ARG 39.A N SER 58.A O no hydrogen 2.938 N/A ARG 39.A NH1 GLY 42.A O no hydrogen 2.900 N/A ARG 39.A NH2 GLU 66.A OE2 no hydrogen 2.739 N/A VAL 40.A N GLU 43.A O no hydrogen 2.776 N/A ASN 41.A N GLN 56.A O no hydrogen 2.868 N/A ASN 41.A ND2 ASP 54.A O no hydrogen 3.512 N/A GLU 43.A N VAL 40.A O no hydrogen 2.962 N/A VAL 45.A N GLY 38.A O no hydrogen 2.861 N/A ASP 46.A N ASP 49.A OD2 no hydrogen 2.867 N/A ASP 49.A N ASP 46.A O no hydrogen 3.048 N/A ILE 51.A N VAL 18.A O no hydrogen 2.693 N/A ALA 55.A N VAL 3.A O no hydrogen 3.051 N/A GLN 56.A N ASN 41.A OD1 no hydrogen 2.966 N/A LEU 57.A N THR 5.A O no hydrogen 2.863 N/A SER 58.A N ARG 39.A O no hydrogen 3.046 N/A ILE 60.A N ALA 37.A O no hydrogen 2.865 N/A THR 61.A N ASP 64.A OD2 no hydrogen 2.793 N/A LYS 63.A N THR 61.A OG1 no hydrogen 3.128 N/A ASP 64.A N THR 61.A O no hydrogen 3.009 N/A GLU 66.A N GLU 66.A OE1 no hydrogen 2.798 N/A LEU 68.A N ASP 64.A O no hydrogen 3.170 N/A GLU 69.A N GLU 65.A O no hydrogen 3.160 N/A ILE 70.A N GLU 66.A O no hydrogen 3.029 N/A ILE 71.A N GLY 67.A O no hydrogen 2.937 N/A ARG 72.A N LEU 68.A O no hydrogen 3.017 N/A ARG 72.A NE ALA 222.A O no hydrogen 2.875 N/A ARG 72.A NH2 ALA 222.A O no hydrogen 3.337 N/A HIS 73.A N GLU 69.A O no hydrogen 2.895 N/A SER 74.A N ILE 70.A O no hydrogen 2.897 N/A SER 74.A OG ILE 70.A O no hydrogen 3.351 N/A SER 74.A OG HIS 186.A ND1 no hydrogen 2.817 N/A CYS 75.A N ILE 71.A O no hydrogen 3.018 N/A CYS 75.A N ARG 72.A O no hydrogen 3.118 N/A CYS 75.A SG ILE 71.A O no hydrogen 3.411 N/A ALA 76.A N ARG 72.A O no hydrogen 3.256 N/A ALA 76.A N HIS 73.A O no hydrogen 2.992 N/A HIS 77.A N HIS 73.A O no hydrogen 3.280 N/A HIS 77.A ND1 HIS 175.A NE2 no hydrogen 3.024 N/A LEU 78.A N SER 74.A O no hydrogen 2.852 N/A LEU 79.A N CYS 75.A O no hydrogen 2.960 N/A GLY 80.A N ALA 76.A O no hydrogen 3.146 N/A HIS 81.A N HIS 77.A O no hydrogen 2.888 N/A ALA 82.A N LEU 78.A O no hydrogen 2.946 N/A ILE 83.A N LEU 79.A O no hydrogen 2.779 N/A LYS 84.A N GLY 80.A O no hydrogen 2.950 N/A LYS 84.A NZ PRO 88.A O no hydrogen 3.058 N/A LYS 84.A NZ THR 90.A O no hydrogen 2.795 N/A LYS 84.A NZ GLU 153.A OE2 no hydrogen 2.818 N/A GLN 85.A N ALA 82.A O no hydrogen 3.020 N/A LEU 86.A N ALA 82.A O no hydrogen 3.114 N/A TRP 87.A N ILE 83.A O no hydrogen 2.849 N/A THR 90.A N TRP 87.A O no hydrogen 2.941 N/A THR 90.A OG1 TRP 87.A O no hydrogen 2.734 N/A LYS 91.A N ASP 107.A O no hydrogen 2.895 N/A LYS 91.A NZ SER 154.A OG no hydrogen 3.226 N/A MET 92.A N GLU 153.A OE1 no hydrogen 2.842 N/A ALA 93.A N ASP 105.A O no hydrogen 2.989 N/A ILE 98.A N GLY 101.A O no hydrogen 2.930 N/A GLY 101.A N ILE 98.A O no hydrogen 3.093 N/A PHE 102.A N GLY 220.A O no hydrogen 3.022 N/A TYR 103.A N PRO 96.A O no hydrogen 3.183 N/A TYR 104.A N ILE 218.A O no hydrogen 2.971 N/A TYR 104.A OH ASP 180.A OD1 no hydrogen 3.286 N/A TYR 104.A OH ASP 180.A OD2 no hydrogen 2.576 N/A ASP 105.A N ILE 94.A O no hydrogen 2.904 N/A VAL 106.A N GLN 216.A O no hydrogen 2.878 N/A ASP 107.A N LYS 91.A O no hydrogen 2.876 N/A ASP 109.A N HIS 89.A NE2.A no hydrogen 3.350 N/A ARG 110.A NE ASP 116.A OD2 no hydrogen 2.827 N/A ARG 110.A NH2 ASP 116.A OD2 no hydrogen 3.462 N/A LEU 112.A N GLN 216.A OE1 no hydrogen 3.012 N/A THR 113.A N ASP 116.A OD2 no hydrogen 2.971 N/A ASP 116.A N THR 113.A OG1 no hydrogen 3.064 N/A VAL 117.A N THR 113.A O no hydrogen 3.052 N/A GLU 118.A N GLN 114.A O no hydrogen 2.923 N/A ALA 119.A N GLU 115.A O no hydrogen 2.914 N/A LEU 120.A N ASP 116.A O no hydrogen 2.855 N/A GLU 121.A N VAL 117.A O no hydrogen 2.919 N/A LYS 122.A N GLU 118.A O no hydrogen 2.951 N/A ARG 123.A N ALA 119.A O no hydrogen 3.069 N/A ARG 123.A NE GLU 126.A OE1 no hydrogen 3.160 N/A MET 124.A N LEU 120.A O no hydrogen 2.978 N/A HIS 125.A N GLU 121.A O no hydrogen 2.982 N/A GLU 126.A N LYS 122.A O no hydrogen 3.099 N/A LEU 127.A N ARG 123.A O no hydrogen 2.942 N/A ALA 128.A N MET 124.A O no hydrogen 2.939 N/A GLU 129.A N HIS 125.A O no hydrogen 3.003 N/A LYS 130.A N LEU 127.A O no hydrogen 3.089 N/A LYS 130.A NZ GLU 176.A OE1 no hydrogen 2.896 N/A LYS 130.A NZ GLU 176.A OE2 no hydrogen 3.155 N/A ASN 131.A N ALA 128.A O no hydrogen 2.949 N/A ASN 131.A ND2 ALA 128.A O no hydrogen 3.238 N/A ASN 131.A ND2 HIS 194.A NE2 no hydrogen 2.777 N/A TYR 132.A OH HIS 175.A ND1 no hydrogen 3.194 N/A VAL 134.A N PRO 188.A O no hydrogen 2.935 N/A ILE 135.A N PHE 174.A O no hydrogen 3.048 N/A LYS 136.A NZ ASP 46.A OD2 no hydrogen 2.773 N/A LYS 136.A NZ ASP 49.A OD1 no hydrogen 2.964 N/A LYS 136.A NZ ASP 49.A OD2 no hydrogen 2.877 N/A LYS 136.A NZ TYR 173.A OH no hydrogen 3.540 N/A LYS 137.A N LEU 172.A O no hydrogen 2.876 N/A LYS 137.A NZ GLU 143.A OE2 no hydrogen 2.810 N/A VAL 139.A N PRO 170.A O no hydrogen 2.988 N/A TRP 141.A NE1 LEU 160.A O no hydrogen 2.861 N/A GLU 143.A N SER 140.A OG no hydrogen 2.998 N/A ALA 144.A N SER 140.A O no hydrogen 3.020 N/A ARG 145.A N TRP 141.A O no hydrogen 2.985 N/A ARG 145.A NE ASP 161.A OD1 no hydrogen 2.803 N/A ARG 145.A NH2 ASP 161.A OD2 no hydrogen 2.957 N/A GLU 146.A N HIS 142.A O no hydrogen 3.026 N/A THR 147.A N GLU 143.A O no hydrogen 2.925 N/A THR 147.A OG1 GLU 143.A O no hydrogen 2.824 N/A PHE 148.A N ALA 144.A O no hydrogen 3.171 N/A ALA 149.A N ARG 145.A O no hydrogen 2.833 N/A ASN 150.A N GLU 146.A O no hydrogen 2.931 N/A ARG 151.A N PHE 148.A O no hydrogen 3.057 N/A ARG 151.A NH1 GLU 177.A O no hydrogen 3.071 N/A GLY 152.A N ALA 149.A O no hydrogen 2.977 N/A GLU 153.A N PHE 148.A O no hydrogen 2.938 N/A SER 154.A N GLY 152.A O no hydrogen 3.025 N/A TYR 155.A OH ASP 107.A OD2 no hydrogen 2.600 N/A LYS 156.A NZ ALA 93.A O no hydrogen 2.738 N/A LYS 156.A NZ TYR 104.A OH no hydrogen 2.923 N/A LYS 156.A NZ ASP 180.A OD1 no hydrogen 3.143 N/A VAL 157.A N GLU 153.A O no hydrogen 3.032 N/A SER 158.A N SER 154.A O no hydrogen 2.910 N/A ILE 159.A N TYR 155.A O no hydrogen 2.920 N/A LEU 160.A N LYS 156.A O no hydrogen 3.104 N/A ASP 161.A N VAL 157.A O no hydrogen 2.815 N/A GLU 162.A N SER 158.A O no hydrogen 2.948 N/A ASN 163.A N ILE 159.A O no hydrogen 2.799 N/A ASP 168.A N ALA 165.A O no hydrogen 3.009 N/A LEU 172.A N LYS 137.A O no hydrogen 2.867 N/A TYR 173.A N ASP 180.A O no hydrogen 2.884 N/A TYR 173.A OH ASP 46.A OD2 no hydrogen 2.621 N/A PHE 174.A N ILE 135.A O no hydrogen 2.722 N/A HIS 175.A N TYR 178.A O no hydrogen 2.781 N/A HIS 175.A ND1 TYR 132.A OH no hydrogen 3.194 N/A HIS 175.A NE2 HIS 77.A ND1 no hydrogen 3.024 N/A GLU 177.A N GLU 177.A OE1 no hydrogen 2.739 N/A TYR 178.A N HIS 175.A O no hydrogen 2.888 N/A TYR 178.A OH ASP 180.A OD2 no hydrogen 2.647 N/A ASP 180.A N TYR 173.A O no hydrogen 2.960 N/A MET 181.A N ASP 180.A OD1 no hydrogen 2.774 N/A CYS 182.A N GLY 171.A O no hydrogen 2.908 N/A CYS 182.A SG HIS 186.A NE2 no hydrogen 3.264 N/A ARG 183.A NH1 LEU 44.A O no hydrogen 3.118 N/A ARG 183.A NH1 ARG 183.A O no hydrogen 2.867 N/A ARG 183.A NH1 GLY 184.A O no hydrogen 3.543 N/A ARG 183.A NH2 LEU 44.A O no hydrogen 2.834 N/A HIS 186.A N ASP 46.A OD1 no hydrogen 2.867 N/A HIS 186.A ND1 SER 74.A OG no hydrogen 2.817 N/A VAL 187.A N SER 74.A OG no hydrogen 2.913 N/A ASN 189.A ND2 ASN 131.A O no hydrogen 2.922 N/A ASN 189.A ND2 ASP 133.A OD1 no hydrogen 2.843 N/A MET 190.A N TYR 132.A O no hydrogen 2.946 N/A ARG 191.A N ASN 189.A OD1 no hydrogen 2.836 N/A ARG 191.A NH1 LYS 33.A O no hydrogen 3.456 N/A ARG 191.A NH2 LYS 33.A O no hydrogen 2.771 N/A PHE 192.A N ASN 189.A O no hydrogen 3.384 N/A CYS 193.A N MET 190.A O no hydrogen 2.859 N/A CYS 193.A SG ILE 71.A O no hydrogen 3.834 N/A HIS 195.A ND1 ALA 224.A O no hydrogen 3.125 N/A HIS 195.A ND1 ALA 224.A OXT no hydrogen 3.247 N/A LYS 197.A N THR 221.A O no hydrogen 3.002 N/A LEU 198.A N GLU 121.A OE1 no hydrogen 2.941 N/A MET 199.A N TYR 219.A O no hydrogen 2.767 N/A ALA 202.A N ARG 217.A O no hydrogen 2.886 N/A ALA 204.A N LEU 215.A O no hydrogen 3.053 N/A TRP 206.A N LYS 213.A O no hydrogen 2.969 N/A ARG 207.A NH1 ASN 163.A OD1 no hydrogen 2.870 N/A ARG 207.A NH2 SER 158.A OG no hydrogen 3.009 N/A ARG 207.A NH2 ASN 163.A OD1 no hydrogen 2.951 N/A GLY 208.A N TYR 205.A O no hydrogen 2.799 N/A ASP 209.A N TRP 206.A O no hydrogen 3.210 N/A ASN 211.A N ASP 209.A OD1 no hydrogen 2.730 N/A ASN 212.A N ASP 209.A O no hydrogen 2.849 N/A ASN 212.A ND2 TRP 206.A O no hydrogen 2.978 N/A LEU 215.A N ALA 204.A O no hydrogen 2.859 N/A GLN 216.A N VAL 106.A O no hydrogen 3.025 N/A GLN 216.A NE2 LEU 108.A O no hydrogen 3.568 N/A GLN 216.A NE2 ARG 110.A O no hydrogen 2.923 N/A ARG 217.A N ALA 202.A O no hydrogen 2.720 N/A ARG 217.A NE ASP 105.A OD1 no hydrogen 2.687 N/A ARG 217.A NH2 ASP 105.A OD2 no hydrogen 2.835 N/A ILE 218.A N TYR 104.A O no hydrogen 2.949 N/A TYR 219.A N LYS 200.A O no hydrogen 2.961 N/A GLY 220.A N PHE 102.A O no hydrogen 2.903 N/A THR 221.A N LYS 197.A O no hydrogen 2.975 N/A THR 221.A OG1 ASN 100.A O no hydrogen 2.909 N/A TRP 223.A N HIS 195.A O no hydrogen 2.972 N/A