Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ki0_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 4.A N SER 2.A OG no hydrogen 3.429 N/A CYS 4.A SG SER 2.A OG no hydrogen 3.332 N/A LYS 5.A N LEU 80.A O no hydrogen 2.824 N/A GLY 9.A N THR 6.A O no hydrogen 2.830 N/A LYS 10.A NZ LYS 10.A O no hydrogen 3.098 N/A LYS 10.A NZ GLU 46.A OE1 no hydrogen 2.417 N/A LYS 10.A NZ ASN 55.A O no hydrogen 3.098 N/A TYR 12.A N GLY 9.A O no hydrogen 2.950 N/A ARG 13.A NH1 LYS 10.A O no hydrogen 3.438 N/A ARG 13.A NH1 TYR 12.A O no hydrogen 2.990 N/A ARG 13.A NH2 SER 45.A O no hydrogen 3.332 N/A THR 15.A N GLU 3.A OE2 no hydrogen 2.681 N/A THR 15.A OG1 GLU 3.A OE2 no hydrogen 3.061 N/A MET 16.A N TYR 12.A OH no hydrogen 3.107 N/A LYS 18.A NZ GLY 22.A O no hydrogen 3.093 N/A LYS 18.A NZ THR 24.A OG1 no hydrogen 2.902 N/A THR 19.A N ILE 23.A O no hydrogen 2.763 N/A LYS 20.A N TYR 76.A O no hydrogen 2.871 N/A ASN 21.A N THR 19.A OG1 no hydrogen 3.132 N/A GLY 22.A N THR 19.A O no hydrogen 2.815 N/A ILE 23.A N THR 19.A OG1 no hydrogen 3.254 N/A CYS 25.A N SER 17.A O no hydrogen 2.780 N/A GLN 26.A N TYR 66.A O no hydrogen 2.810 N/A GLN 26.A NE2 LYS 27.A O no hydrogen 3.626 N/A GLN 26.A NE2 SER 30.A O no hydrogen 2.874 N/A GLN 26.A NE2 HIS 34.A O no hydrogen 2.840 N/A TRP 28.A N GLU 50.A O no hydrogen 3.067 N/A TRP 28.A NE1 TYR 52.A O no hydrogen 2.754 N/A SER 30.A N LYS 27.A O no hydrogen 3.008 N/A SER 30.A OG SER 32.A O no hydrogen 3.352 N/A HIS 34.A N GLN 26.A OE1 no hydrogen 2.895 N/A ARG 37.A N TYR 66.A OH no hydrogen 2.982 N/A THR 42.A N SER 39.A O no hydrogen 3.165 N/A THR 42.A OG1 SER 39.A O no hydrogen 3.237 N/A THR 42.A OG1 HIS 43.A ND1 no hydrogen 2.877 N/A HIS 43.A N SER 39.A O no hydrogen 2.709 N/A HIS 43.A ND1 THR 42.A OG1 no hydrogen 2.877 N/A SER 45.A OG GLU 46.A OE2 no hydrogen 3.548 N/A GLU 46.A N HIS 43.A O no hydrogen 3.320 N/A GLU 49.A N GLY 47.A O no hydrogen 2.733 N/A ASN 51.A ND2 CYS 25.A O no hydrogen 3.003 N/A TYR 52.A N GLU 49.A O no hydrogen 3.189 N/A CYS 53.A N MET 16.A O no hydrogen 2.852 N/A CYS 53.A SG MET 16.A O no hydrogen 3.419 N/A CYS 53.A SG LYS 18.A O no hydrogen 3.803 N/A ARG 54.A N TRP 64.A O no hydrogen 2.939 N/A ARG 54.A NE GLY 47.A O no hydrogen 2.753 N/A ARG 54.A NH1 GLY 14.A O no hydrogen 3.076 N/A ARG 54.A NH1 CYS 53.A O no hydrogen 2.764 N/A ARG 54.A NH2 GLY 14.A O no hydrogen 3.273 N/A ASN 55.A ND2 ASN 8.A O no hydrogen 2.896 N/A ASN 55.A ND2 ASP 59.A O no hydrogen 2.878 N/A ASN 58.A N ASN 55.A O no hydrogen 3.433 N/A ASP 59.A N ASN 55.A OD1 no hydrogen 2.680 N/A GLN 61.A N ASP 59.A OD1 no hydrogen 2.923 N/A GLY 62.A N ASP 59.A O no hydrogen 2.965 N/A TRP 64.A N ARG 54.A O no hydrogen 2.816 N/A TRP 64.A NE1 ASP 57.A OD1 no hydrogen 2.970 N/A CYS 65.A N ASP 75.A O no hydrogen 2.955 N/A CYS 65.A SG TYR 66.A O no hydrogen 3.451 N/A THR 67.A N ARG 73.A O no hydrogen 3.027 N/A THR 67.A OG1 ASP 69.A O no hydrogen 3.374 N/A THR 67.A OG1 LYS 72.A O no hydrogen 2.517 N/A THR 68.A N THR 24.A O no hydrogen 3.080 N/A THR 68.A OG1 THR 24.A O no hydrogen 2.802 N/A ASP 69.A N THR 67.A OG1 no hydrogen 3.084 N/A GLU 71.A N ASP 69.A OD1 no hydrogen 2.851 N/A LYS 72.A N ASP 69.A O no hydrogen 2.898 N/A ARG 73.A NH1 ARG 35.A O no hydrogen 2.877 N/A ARG 73.A NH2 ARG 35.A O no hydrogen 3.233 N/A TYR 74.A OH TYR 76.A OH no hydrogen 2.737 N/A ASP 75.A N CYS 65.A O no hydrogen 3.036 N/A TYR 76.A N ASP 75.A OD1 no hydrogen 2.928 N/A TYR 76.A OH ASP 59.A OD1 no hydrogen 3.430 N/A TYR 76.A OH ASP 59.A OD2 no hydrogen 2.587 N/A TYR 76.A OH TYR 74.A OH no hydrogen 2.737 N/A CYS 77.A N PRO 63.A O no hydrogen 3.041 N/A CYS 77.A SG LYS 18.A O no hydrogen 3.611 N/A CYS 82.A N LYS 5.A O no hydrogen 2.875 N/A CYS 82.A SG LYS 5.A O no hydrogen 3.379 N/A MET 87.A N PRO 161.A O no hydrogen 2.816 N/A HIS 88.A N GLU 83.A OE1 no hydrogen 3.019 N/A SER 90.A N GLU 92.A OE2 no hydrogen 2.746 N/A SER 90.A OG GLU 92.A OE2 no hydrogen 2.593 N/A GLY 91.A N HIS 88.A O no hydrogen 2.940 N/A TYR 94.A N GLY 91.A O no hydrogen 3.116 N/A ASP 95.A N GLU 83.A O no hydrogen 2.827 N/A ILE 98.A N TYR 94.A OH no hydrogen 3.400 N/A SER 99.A OG GLU 106.A OE1 no hydrogen 3.109 N/A LYS 100.A NZ GLU 106.A OE2 no hydrogen 2.662 N/A THR 101.A N LEU 105.A O no hydrogen 2.816 N/A THR 101.A OG1 GLU 156.A OE1 no hydrogen 2.747 N/A MET 102.A N LEU 157.A O no hydrogen 2.827 N/A SER 103.A N GLU 156.A OE1 no hydrogen 3.380 N/A SER 103.A OG GLU 156.A OE1 no hydrogen 2.549 N/A GLY 104.A N THR 101.A O no hydrogen 2.819 N/A LEU 105.A N THR 101.A OG1 no hydrogen 3.118 N/A CYS 107.A N SER 99.A O no hydrogen 2.932 N/A GLN 108.A N PHE 147.A O no hydrogen 2.822 N/A GLN 108.A NE2 SER 112.A O no hydrogen 3.000 N/A GLN 108.A NE2 HIS 116.A O no hydrogen 2.974 N/A TRP 110.A N LYS 132.A O no hydrogen 3.072 N/A TRP 110.A NE1 TYR 134.A O no hydrogen 2.821 N/A SER 112.A N ALA 109.A O no hydrogen 3.048 N/A SER 112.A OG SER 114.A O no hydrogen 3.071 N/A GLN 113.A NE2 HIS 118.A O no hydrogen 3.251 N/A SER 114.A N SER 112.A OG no hydrogen 3.221 N/A HIS 116.A N GLN 108.A OE1 no hydrogen 2.967 N/A HIS 116.A NE2 ASP 150.A O no hydrogen 2.847 N/A HIS 118.A N GLN 113.A OE1 no hydrogen 3.038 N/A HIS 118.A NE2 TRP 110.A O no hydrogen 3.071 N/A LYS 124.A N ILE 121.A O no hydrogen 2.779 N/A PHE 125.A N ILE 121.A O no hydrogen 3.151 N/A PHE 125.A N PRO 122.A O no hydrogen 3.188 N/A LYS 128.A N PHE 125.A O no hydrogen 3.107 N/A LYS 128.A NZ PRO 138.A O no hydrogen 3.254 N/A LYS 131.A N ASN 129.A O no hydrogen 2.792 N/A LYS 131.A NZ ASP 95.A OD1 no hydrogen 2.714 N/A LYS 131.A NZ ASP 95.A OD2 no hydrogen 3.211 N/A TYR 134.A N LYS 131.A O no hydrogen 3.083 N/A CYS 135.A N ILE 98.A O no hydrogen 2.869 N/A CYS 135.A SG ILE 98.A O no hydrogen 3.305 N/A CYS 135.A SG LYS 100.A O no hydrogen 3.748 N/A ARG 136.A N TRP 145.A O no hydrogen 2.930 N/A ARG 136.A NE ASN 129.A O no hydrogen 2.882 N/A ARG 136.A NH1 GLY 96.A O no hydrogen 2.940 N/A ARG 136.A NH1 CYS 135.A O no hydrogen 2.801 N/A ARG 136.A NH2 GLY 96.A O no hydrogen 3.059 N/A ASN 137.A ND2 SER 90.A O no hydrogen 2.950 N/A ASN 137.A ND2 GLU 141.A O no hydrogen 2.995 N/A ARG 140.A NE ASP 139.A OD1 no hydrogen 2.916 N/A ARG 140.A NH2 ASP 139.A OD1 no hydrogen 3.554 N/A ARG 140.A NH2 ASP 139.A OD2 no hydrogen 2.846 N/A GLU 141.A N ASN 137.A OD1 no hydrogen 2.805 N/A LEU 142.A N GLU 141.A OE1 no hydrogen 2.988 N/A TRP 145.A N ARG 136.A O no hydrogen 2.896 N/A CYS 146.A N GLU 156.A O no hydrogen 3.290 N/A CYS 146.A SG PHE 147.A O no hydrogen 3.314 N/A THR 148.A N ARG 154.A O no hydrogen 3.055 N/A THR 148.A OG1 ASP 150.A O no hydrogen 3.264 N/A THR 148.A OG1 LYS 153.A O no hydrogen 2.844 N/A THR 149.A N GLU 106.A O no hydrogen 3.035 N/A THR 149.A OG1 GLU 106.A O no hydrogen 3.188 N/A ASP 150.A N THR 148.A OG1 no hydrogen 2.940 N/A ASN 152.A N ASP 150.A OD2 no hydrogen 3.038 N/A LYS 153.A N ASP 150.A O no hydrogen 3.082 N/A ARG 154.A NH1 ALA 117.A O no hydrogen 3.137 N/A ARG 154.A NH2 ALA 117.A O no hydrogen 2.545 N/A GLU 156.A N CYS 146.A O no hydrogen 3.117 N/A CYS 158.A N PRO 144.A O no hydrogen 2.871 N/A CYS 158.A SG LYS 100.A O no hydrogen 3.604 N/A ARG 162.A NH2 CYS 89.A O no hydrogen 2.667 N/A CYS 163.A N MET 87.A O no hydrogen 2.801 N/A CYS 163.A SG MET 87.A O no hydrogen 3.365 N/A TYR 174.A N ASN 183.A O no hydrogen 2.824 N/A GLN 175.A NE2 ARG 185.A O no hydrogen 3.637 N/A LEU 177.A N PRO 251.A O no hydrogen 2.587 N/A THR 180.A OG1 GLU 182.A OE1 no hydrogen 3.419 N/A GLY 181.A N LYS 178.A O no hydrogen 3.406 N/A TYR 184.A N GLY 181.A O no hydrogen 3.122 N/A ARG 185.A N TYR 174.A O no hydrogen 2.819 N/A ARG 185.A NH1 GLU 182.A O no hydrogen 3.301 N/A ARG 185.A NH1 TYR 184.A O no hydrogen 2.793 N/A VAL 188.A N TYR 184.A OH no hydrogen 3.132 N/A THR 191.A N HIS 195.A O no hydrogen 2.930 N/A THR 191.A OG1 GLU 246.A OE1 no hydrogen 2.405 N/A VAL 192.A N TYR 247.A O no hydrogen 3.037 N/A SER 193.A N GLU 246.A OE1 no hydrogen 2.953 N/A SER 193.A OG GLU 246.A OE2 no hydrogen 2.652 N/A GLY 194.A N THR 191.A O no hydrogen 3.103 N/A HIS 195.A N THR 191.A OG1 no hydrogen 2.916 N/A CYS 197.A N ALA 189.A O no hydrogen 3.181 N/A GLN 198.A N HIS 237.A O no hydrogen 2.703 N/A GLN 198.A NE2 ALA 202.A O no hydrogen 2.818 N/A GLN 198.A NE2 HIS 206.A O no hydrogen 2.911 N/A TRP 200.A N GLU 222.A O no hydrogen 3.071 N/A TRP 200.A NE1 TYR 224.A O no hydrogen 2.728 N/A ALA 202.A N HIS 199.A O no hydrogen 3.092 N/A GLN 203.A NE2 HIS 208.A O no hydrogen 3.322 N/A HIS 206.A N GLN 198.A OE1 no hydrogen 2.975 N/A HIS 208.A NE2 TRP 200.A O no hydrogen 2.994 N/A ARG 210.A NH2 ASP 229.A OD2 no hydrogen 3.421 N/A THR 211.A OG1 GLU 213.A OE2 no hydrogen 3.408 N/A ASN 214.A N THR 211.A OG1 no hydrogen 3.168 N/A ASN 214.A ND2 GLU 209.A O no hydrogen 2.814 N/A PHE 215.A N THR 211.A O no hydrogen 2.868 N/A LYS 218.A N PHE 215.A O no hydrogen 3.031 N/A ASN 223.A ND2 CYS 197.A O no hydrogen 2.860 N/A TYR 224.A N ASP 221.A O no hydrogen 3.097 N/A CYS 225.A N VAL 188.A O no hydrogen 2.813 N/A CYS 225.A SG VAL 188.A O no hydrogen 3.357 N/A CYS 225.A SG VAL 190.A O no hydrogen 3.614 N/A ARG 226.A N TRP 235.A O no hydrogen 3.071 N/A ARG 226.A NE ASN 219.A O no hydrogen 2.735 N/A ARG 226.A NH1 GLY 186.A O no hydrogen 3.165 N/A ARG 226.A NH1 CYS 225.A O no hydrogen 2.595 N/A ARG 226.A NH2 GLY 186.A O no hydrogen 3.098 N/A ASN 227.A ND2 THR 180.A O no hydrogen 2.708 N/A ASN 227.A ND2 LYS 231.A O no hydrogen 2.677 N/A LYS 231.A N ASN 227.A OD1 no hydrogen 3.219 N/A LYS 231.A NZ ASP 229.A OD2 no hydrogen 2.777 N/A ARG 232.A N TYR 247.A OH no hydrogen 3.331 N/A TRP 235.A N ARG 226.A O no hydrogen 2.924 N/A TRP 235.A NE1 ASP 229.A OD1 no hydrogen 2.822 N/A CYS 236.A N GLU 246.A O no hydrogen 3.181 N/A CYS 236.A SG HIS 237.A O no hydrogen 3.485 N/A THR 238.A N ARG 244.A O no hydrogen 3.066 N/A THR 238.A OG1 ASN 240.A O no hydrogen 3.407 N/A THR 238.A OG1 VAL 243.A O no hydrogen 2.635 N/A THR 239.A N THR 196.A O no hydrogen 2.784 N/A THR 239.A OG1 THR 196.A O no hydrogen 3.374 N/A ASN 240.A N THR 238.A OG1 no hydrogen 3.147 N/A GLN 242.A N ASN 240.A OD1 no hydrogen 2.721 N/A VAL 243.A N ASN 240.A O no hydrogen 3.163 N/A ARG 244.A NH1 THR 207.A O no hydrogen 2.784 N/A ARG 244.A NH2 THR 207.A O no hydrogen 2.760 N/A GLU 246.A N CYS 236.A O no hydrogen 3.104 N/A CYS 248.A N PRO 234.A O no hydrogen 2.931 N/A CYS 248.A SG VAL 190.A O no hydrogen 3.518 N/A CYS 253.A N LEU 177.A O no hydrogen 2.586 N/A CYS 253.A SG LEU 177.A O no hydrogen 3.741 N/A