Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3bki_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 2.A N LYS 46.A O no hydrogen 2.805 N/A VAL 3.A N ASP 80.A OD2 no hydrogen 2.818 N/A VAL 4.A N LYS 48.A O no hydrogen 2.785 N/A THR 5.A N ILE 81.A O no hydrogen 2.882 N/A THR 5.A OG1 GLU 73.A OE1 no hydrogen 2.739 N/A THR 6.A N THR 50.A O no hydrogen 2.941 N/A THR 6.A OG1 ILE 83.A O no hydrogen 2.661 N/A TYR 12.A N GLU 9.A O no hydrogen 2.783 N/A VAL 13.A N GLU 9.A O no hydrogen 3.132 N/A MET 14.A N GLU 29.A O no hydrogen 2.884 N/A LYS 16.A N ARG 27.A O no hydrogen 2.846 N/A LYS 16.A NZ GLU 26.A O no hydrogen 3.288 N/A HIS 19.A N LYS 16.A O no hydrogen 2.665 N/A MET 21.A N ASN 18.A O no hydrogen 3.054 N/A LEU 22.A N HIS 19.A O no hydrogen 3.006 N/A ASN 25.A ND2 TYR 47.A O no hydrogen 2.969 N/A GLU 26.A N GLU 23.A O no hydrogen 2.943 N/A ARG 27.A N GLY 24.A O no hydrogen 3.031 N/A ARG 27.A NE GLY 24.A O no hydrogen 2.706 N/A TYR 28.A N ASN 25.A O no hydrogen 3.439 N/A GLU 29.A N MET 14.A O no hydrogen 3.071 N/A TYR 31.A N PRO 11.A O no hydrogen 2.993 N/A CYS 32.A N TYR 12.A O no hydrogen 2.889 N/A ASP 34.A N GLY 30.A O no hydrogen 2.903 N/A LEU 35.A N TYR 31.A O no hydrogen 2.778 N/A ALA 36.A N CYS 32.A O no hydrogen 2.889 N/A ALA 37.A N VAL 33.A O no hydrogen 3.178 N/A GLU 38.A N ASP 34.A O no hydrogen 3.194 N/A ILE 39.A N LEU 35.A O no hydrogen 2.800 N/A ALA 40.A N ALA 36.A O no hydrogen 2.965 N/A LYS 41.A N ALA 37.A O no hydrogen 2.954 N/A LYS 41.A NZ GLU 38.A OE1 no hydrogen 3.159 N/A HIS 42.A N GLU 38.A O no hydrogen 2.906 N/A HIS 42.A ND1 GLU 38.A O no hydrogen 3.046 N/A CYS 43.A N ILE 39.A O no hydrogen 2.909 N/A CYS 43.A N ALA 40.A O no hydrogen 3.286 N/A CYS 43.A SG ILE 39.A O no hydrogen 3.434 N/A PHE 45.A N ALA 40.A O no hydrogen 3.179 N/A LYS 46.A NZ THR 1.A OG1 no hydrogen 3.154 N/A LYS 48.A N VAL 2.A O no hydrogen 2.953 N/A LEU 49.A N ASN 25.A OD1 no hydrogen 2.969 N/A THR 50.A N VAL 4.A O no hydrogen 2.744 N/A THR 50.A OG1 VAL 4.A O no hydrogen 3.140 N/A VAL 52.A N THR 6.A O no hydrogen 2.738 N/A GLY 53.A N GLU 73.A OE2 no hydrogen 3.200 N/A GLY 55.A N VAL 52.A O no hydrogen 3.037 N/A LYS 56.A N ASP 54.A OD1 no hydrogen 2.979 N/A TYR 57.A OH GLU 9.A OE1 no hydrogen 2.382 N/A ALA 59.A N ASN 68.A OD1 no hydrogen 2.894 N/A ASP 61.A N ILE 66.A O no hydrogen 3.063 N/A ASP 63.A N ASP 61.A OD1 no hydrogen 3.028 N/A THR 64.A N ASP 61.A OD1 no hydrogen 3.162 N/A LYS 65.A N ASP 61.A O no hydrogen 2.913 N/A LYS 65.A NZ ALA 62.A O no hydrogen 3.490 N/A TRP 67.A N TYR 76.A OH no hydrogen 3.006 N/A ASN 68.A N ALA 59.A O no hydrogen 3.029 N/A GLY 69.A N ASP 54.A OD2 no hydrogen 2.780 N/A MET 70.A N LYS 56.A O no hydrogen 3.006 N/A VAL 71.A N TYR 57.A O no hydrogen 3.162 N/A GLY 72.A N ASN 68.A O no hydrogen 2.998 N/A GLU 73.A N GLY 69.A O no hydrogen 3.090 N/A LEU 74.A N MET 70.A O no hydrogen 3.039 N/A VAL 75.A N VAL 71.A O no hydrogen 2.835 N/A TYR 76.A N GLY 72.A O no hydrogen 2.874 N/A GLY 77.A N LEU 74.A O no hydrogen 3.249 N/A LYS 78.A N GLU 73.A O no hydrogen 2.791 N/A ALA 79.A N GLU 73.A O no hydrogen 3.105 N/A ASP 80.A N VAL 3.A O no hydrogen 2.962 N/A ALA 82.A N ALA 219.A O no hydrogen 2.768 N/A ILE 83.A N THR 5.A O no hydrogen 3.196 N/A LEU 86.A N ALA 84.A O no hydrogen 2.728 N/A ILE 88.A N GLY 215.A O no hydrogen 2.939 N/A ARG 92.A N THR 89.A OG1 no hydrogen 3.390 N/A ARG 92.A NE GLY 58.A O no hydrogen 3.004 N/A ARG 92.A NH1 THR 87.A O no hydrogen 3.004 N/A ARG 92.A NH2 GLY 58.A O no hydrogen 2.992 N/A GLU 93.A N THR 89.A O no hydrogen 2.800 N/A GLU 94.A N LEU 90.A O no hydrogen 3.019 N/A VAL 95.A N ARG 92.A O no hydrogen 2.954 N/A ILE 96.A N ARG 92.A O no hydrogen 2.960 N/A ASP 97.A N THR 220.A O no hydrogen 2.759 N/A PHE 98.A N GLU 93.A OE2 no hydrogen 3.412 N/A SER 99.A N ILE 218.A O no hydrogen 2.829 N/A SER 99.A OG LYS 100.A O no hydrogen 2.710 N/A LYS 100.A N ASN 231.A OD1 no hydrogen 2.825 N/A PHE 102.A N TYR 216.A O no hydrogen 2.877 N/A LEU 105.A N LYS 214.A O no hydrogen 2.974 N/A GLY 106.A N SER 190.A OG no hydrogen 2.972 N/A ILE 107.A N ASP 212.A OD1 no hydrogen 2.778 N/A SER 108.A N LEU 188.A O no hydrogen 2.850 N/A SER 108.A OG LEU 188.A O no hydrogen 2.769 N/A MET 110.A N TYR 186.A O no hydrogen 2.762 N/A ILE 111.A N MET 205.A O no hydrogen 3.027 N/A LYS 112.A NZ ARG 178.A O no hydrogen 2.960 N/A LYS 112.A NZ ASP 203.A OD2 no hydrogen 2.730 N/A LYS 113.A N ASP 203.A O no hydrogen 2.858 N/A LYS 113.A NZ CYS 202.A O no hydrogen 3.218 N/A THR 115.A N LYS 112.A O no hydrogen 3.115 N/A THR 115.A OG1 LYS 112.A O no hydrogen 2.811 N/A ILE 117.A N THR 115.A O no hydrogen 2.733 N/A GLU 118.A N ASP 122.A OD1 no hydrogen 2.862 N/A ASP 122.A N SER 119.A OG no hydrogen 3.121 N/A LEU 123.A N SER 119.A O no hydrogen 3.067 N/A SER 124.A N ALA 120.A O no hydrogen 2.811 N/A SER 124.A OG GLU 121.A O no hydrogen 2.668 N/A LYS 125.A N GLU 121.A O no hydrogen 3.098 N/A LYS 125.A N ASP 122.A O no hydrogen 3.312 N/A GLN 126.A N LEU 123.A O no hydrogen 3.350 N/A GLN 126.A NE2 LEU 123.A O no hydrogen 3.119 N/A GLN 126.A NE2 ILE 129.A O no hydrogen 2.808 N/A ILE 129.A N GLN 126.A OE1 no hydrogen 2.750 N/A ALA 130.A N LYS 183.A O no hydrogen 2.985 N/A GLY 132.A N ALA 185.A O no hydrogen 3.232 N/A THR 133.A OG1 LEU 134.A O no hydrogen 2.761 N/A ASP 135.A N VAL 167.A O no hydrogen 2.800 N/A LYS 140.A NZ ASP 135.A O no hydrogen 3.033 N/A GLU 141.A N GLY 137.A O no hydrogen 3.227 N/A PHE 142.A N SER 138.A O no hydrogen 2.823 N/A PHE 143.A N THR 139.A O no hydrogen 3.441 N/A ARG 144.A N LYS 140.A O no hydrogen 3.123 N/A ARG 144.A NE GLU 141.A OE1 no hydrogen 3.244 N/A ARG 144.A NE GLU 141.A OE2 no hydrogen 3.090 N/A ARG 145.A N GLU 141.A O no hydrogen 2.906 N/A SER 146.A N PHE 143.A O no hydrogen 3.320 N/A ILE 148.A N SER 146.A OG no hydrogen 3.172 N/A ASP 152.A N ILE 148.A O no hydrogen 2.846 N/A LYS 153.A N ALA 149.A O no hydrogen 2.925 N/A MET 154.A N VAL 150.A O no hydrogen 2.990 N/A TRP 155.A N PHE 151.A O no hydrogen 2.909 N/A THR 156.A N ASP 152.A O no hydrogen 2.972 N/A THR 156.A OG1 ASP 152.A O no hydrogen 2.997 N/A TYR 157.A N LYS 153.A O no hydrogen 3.084 N/A MET 158.A N MET 154.A O no hydrogen 2.888 N/A ARG 159.A N TRP 155.A O no hydrogen 2.928 N/A SER 160.A N TYR 157.A O no hydrogen 3.109 N/A ALA 161.A N MET 158.A O no hydrogen 3.417 N/A PHE 166.A N SER 164.A OG no hydrogen 3.256 N/A VAL 167.A N THR 133.A O no hydrogen 3.113 N/A GLU 172.A N THR 169.A OG1 no hydrogen 3.059 N/A GLY 173.A N THR 169.A O no hydrogen 3.015 N/A VAL 174.A N THR 170.A O no hydrogen 2.987 N/A ALA 175.A N ALA 171.A O no hydrogen 2.929 N/A ARG 176.A N GLU 172.A O no hydrogen 2.838 N/A ARG 176.A NH1 SER 164.A O no hydrogen 2.893 N/A ARG 176.A NH2 SER 164.A O no hydrogen 2.926 N/A VAL 177.A N GLY 173.A O no hydrogen 3.070 N/A ARG 178.A N VAL 174.A O no hydrogen 2.983 N/A ARG 178.A NE ASP 203.A OD1 no hydrogen 2.968 N/A LYS 179.A N ALA 175.A O no hydrogen 2.818 N/A SER 180.A OG ARG 176.A O no hydrogen 2.775 N/A LYS 183.A N SER 180.A O no hydrogen 2.917 N/A TYR 184.A OH VAL 165.A O no hydrogen 2.629 N/A ALA 185.A N ALA 130.A O no hydrogen 2.912 N/A TYR 186.A N MET 110.A O no hydrogen 2.952 N/A LEU 187.A N GLY 132.A O no hydrogen 2.964 N/A LEU 188.A N SER 108.A O no hydrogen 3.033 N/A SER 190.A N GLY 106.A O no hydrogen 2.717 N/A SER 190.A OG GLY 106.A O no hydrogen 3.378 N/A THR 191.A OG1 TYR 216.A OH no hydrogen 2.648 N/A ASN 193.A N GLU 189.A O no hydrogen 3.054 N/A ASN 193.A ND2 SER 108.A OG no hydrogen 2.996 N/A ASN 193.A ND2 ILE 109.A O no hydrogen 2.929 N/A GLU 194.A N SER 190.A O no hydrogen 2.750 N/A TYR 195.A N THR 191.A O no hydrogen 2.976 N/A ILE 196.A N MET 192.A O no hydrogen 2.986 N/A GLU 197.A N ASN 193.A O no hydrogen 3.187 N/A GLN 198.A N TYR 195.A O no hydrogen 2.951 N/A ARG 199.A N ILE 196.A O no hydrogen 2.936 N/A ARG 199.A NH2 LYS 254.A O no hydrogen 3.045 N/A LYS 200.A N GLU 256.A OE1 no hydrogen 2.918 N/A CYS 202.A N ARG 199.A O no hydrogen 2.850 N/A CYS 202.A SG ARG 199.A O no hydrogen 3.880 N/A CYS 202.A SG GLU 256.A O no hydrogen 3.704 N/A MET 205.A N ILE 111.A O no hydrogen 2.940 N/A LYS 206.A N GLU 197.A OE2 no hydrogen 2.883 N/A VAL 207.A N ILE 109.A O no hydrogen 3.050 N/A LEU 211.A N ILE 107.A O no hydrogen 2.744 N/A LYS 214.A N LEU 105.A O no hydrogen 2.852 N/A TYR 216.A N MET 103.A O no hydrogen 3.022 N/A TYR 216.A OH THR 191.A OG1 no hydrogen 2.648 N/A GLY 217.A N LEU 86.A O no hydrogen 2.997 N/A ILE 218.A N SER 99.A OG no hydrogen 2.998 N/A ALA 219.A N ALA 82.A O no hydrogen 3.213 N/A THR 220.A N ASP 97.A O no hydrogen 2.901 N/A LYS 222.A NZ GLU 94.A O no hydrogen 3.134 N/A GLY 223.A N ASP 97.A OD2 no hydrogen 3.278 N/A SER 224.A N PRO 221.A O no hydrogen 2.909 N/A LEU 226.A N SER 224.A OG no hydrogen 3.044 N/A GLY 227.A N SER 224.A O no hydrogen 3.256 N/A VAL 230.A N LEU 226.A O no hydrogen 3.117 N/A ASN 231.A N GLY 227.A O no hydrogen 2.890 N/A LEU 232.A N ASN 228.A O no hydrogen 3.071 N/A ALA 233.A N ALA 229.A O no hydrogen 2.882 N/A VAL 234.A N VAL 230.A O no hydrogen 2.998 N/A LEU 235.A N ASN 231.A O no hydrogen 3.254 N/A LYS 236.A N LEU 232.A O no hydrogen 2.931 N/A LEU 237.A N ALA 233.A O no hydrogen 2.909 N/A ASN 238.A N VAL 234.A O no hydrogen 3.018 N/A GLU 239.A N LEU 235.A O no hydrogen 2.889 N/A GLN 240.A N LYS 236.A O no hydrogen 2.880 N/A GLY 241.A N ASN 238.A O no hydrogen 2.876 N/A LEU 242.A N LEU 237.A O no hydrogen 2.906 N/A LEU 243.A N LEU 237.A O no hydrogen 3.472 N/A LYS 245.A N GLY 241.A O no hydrogen 2.952 N/A LEU 246.A N LEU 242.A O no hydrogen 2.900 N/A LYS 247.A N LEU 243.A O no hydrogen 3.006 N/A LYS 247.A NZ GLU 194.A OE1 no hydrogen 3.115 N/A ASN 248.A N ASP 244.A O no hydrogen 2.941 N/A ASN 248.A ND2 ASP 253.A OD1 no hydrogen 3.097 N/A LYS 249.A N LYS 245.A O no hydrogen 2.943 N/A LYS 249.A NZ ASP 34.A OD2 no hydrogen 2.978 N/A TRP 250.A N LEU 246.A O no hydrogen 3.016 N/A TRP 250.A NE1 ASP 34.A OD2 no hydrogen 2.734 N/A TRP 251.A N LYS 247.A O no hydrogen 2.945 N/A TRP 251.A NE1 THR 191.A O no hydrogen 3.019 N/A TYR 252.A N ASN 248.A O no hydrogen 2.935 N/A ASP 253.A N ASN 248.A O no hydrogen 2.881 N/A LYS 254.A N LYS 249.A O no hydrogen 3.130 N/A GLY 255.A N TYR 252.A O no hydrogen 2.894 N/A GLU 256.A N GLN 198.A O no hydrogen 2.739 N/A CYS 257.A SG GLU 197.A O no hydrogen 3.361 N/A