Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ke8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 4.A N MET 1.A O no hydrogen 3.151 N/A GLN 5.A N ARG 22.A O no hydrogen 2.977 N/A LYS 6.A NZ PHE 4.A O no hydrogen 3.403 N/A VAL 7.A N LYS 20.A O no hydrogen 2.843 N/A ILE 10.A N VAL 18.A O no hydrogen 2.772 N/A VAL 18.A N GLY 11.A O no hydrogen 2.837 N/A TYR 19.A N LEU 32.A O no hydrogen 2.722 N/A LYS 20.A N GLU 8.A O no hydrogen 3.050 N/A ALA 21.A N VAL 30.A O no hydrogen 2.879 N/A ARG 22.A N GLN 5.A O no hydrogen 3.016 N/A ARG 22.A NH2 GLY 27.A O no hydrogen 3.351 N/A ASN 23.A N GLU 28.A O no hydrogen 2.978 N/A LYS 24.A N ASN 3.A O no hydrogen 2.843 N/A THR 26.A N ASN 23.A OD1 no hydrogen 3.292 N/A GLY 27.A N ASN 23.A O no hydrogen 2.639 N/A VAL 30.A N ALA 21.A O no hydrogen 2.856 N/A ALA 31.A N PHE 73.A O no hydrogen 2.896 N/A LEU 32.A N TYR 19.A O no hydrogen 2.683 N/A LYS 33.A N LEU 71.A O no hydrogen 2.835 N/A LYS 34.A N VAL 17.A O no hydrogen 2.989 N/A ILE 35.A N LEU 69.A O no hydrogen 3.006 N/A ARG 36.A N TYR 15.A O no hydrogen 3.185 N/A ALA 41.A N PRO 38.A O no hydrogen 3.274 N/A ILE 42.A N PRO 38.A O no hydrogen 3.465 N/A ARG 43.A N SER 39.A O no hydrogen 3.023 N/A GLU 44.A N THR 40.A O no hydrogen 3.039 N/A ILE 45.A N ALA 41.A O no hydrogen 2.772 N/A SER 46.A N ILE 42.A O no hydrogen 2.990 N/A SER 46.A OG ILE 42.A O no hydrogen 2.890 N/A LEU 47.A N ARG 43.A O no hydrogen 3.208 N/A LEU 47.A N GLU 44.A O no hydrogen 3.220 N/A LYS 49.A N ILE 45.A O no hydrogen 3.356 N/A GLU 50.A N LEU 47.A O no hydrogen 2.981 N/A LEU 51.A N LEU 48.A O no hydrogen 2.899 N/A ASN 55.A ND2 GLN 103.A OE1 no hydrogen 3.110 N/A ASN 55.A ND2 ILE 134.A O no hydrogen 3.095 N/A ILE 56.A N HIS 53.A O no hydrogen 3.067 N/A VAL 57.A N LEU 136.A O no hydrogen 2.913 N/A LYS 58.A N GLU 74.A OE2 no hydrogen 2.948 N/A LYS 58.A NZ ASN 52.A OD1 no hydrogen 2.688 N/A LEU 60.A N VAL 72.A O no hydrogen 2.743 N/A ASP 61.A N VAL 72.A O no hydrogen 3.212 N/A ILE 63.A N TYR 70.A O no hydrogen 2.830 N/A THR 65.A N LYS 68.A O no hydrogen 3.002 N/A LYS 68.A N THR 65.A O no hydrogen 2.642 N/A TYR 70.A N ILE 63.A O no hydrogen 2.863 N/A LEU 71.A N LYS 33.A O no hydrogen 2.876 N/A VAL 72.A N ASP 61.A O no hydrogen 2.861 N/A PHE 73.A N ALA 31.A O no hydrogen 2.869 N/A GLU 74.A N LYS 58.A O no hydrogen 3.052 N/A GLN 78.A NE2 ARG 281.A O no hydrogen 3.678 N/A LEU 80.A N LEU 126.A O no hydrogen 2.719 N/A LYS 82.A N ASP 79.A OD2 no hydrogen 2.718 N/A PHE 83.A N ASP 79.A O no hydrogen 3.222 N/A MET 84.A N LEU 80.A O no hydrogen 2.898 N/A ASP 85.A N LYS 81.A O no hydrogen 3.135 N/A ALA 86.A N LYS 82.A O no hydrogen 3.074 N/A SER 87.A N MET 84.A O no hydrogen 3.025 N/A SER 87.A OG PHE 83.A O no hydrogen 2.953 N/A ALA 88.A N ASP 85.A O no hydrogen 3.247 N/A THR 90.A N SER 87.A O no hydrogen 3.231 N/A THR 90.A OG1 GLY 91.A O no hydrogen 3.282 N/A GLY 91.A N SER 87.A O no hydrogen 2.567 N/A LEU 96.A N PRO 93.A O no hydrogen 2.945 N/A ILE 97.A N PRO 93.A O no hydrogen 2.973 N/A LYS 98.A N LEU 94.A O no hydrogen 2.852 N/A LYS 98.A NZ PHE 269.A O no hydrogen 3.052 N/A LYS 98.A NZ ASP 272.A OD1 no hydrogen 2.870 N/A SER 99.A N PRO 95.A O no hydrogen 3.017 N/A SER 99.A OG THR 274.A O no hydrogen 3.393 N/A TYR 100.A N LEU 96.A O no hydrogen 2.938 N/A LEU 101.A N ILE 97.A O no hydrogen 2.959 N/A PHE 102.A N LYS 98.A O no hydrogen 3.025 N/A GLN 103.A N SER 99.A O no hydrogen 3.039 N/A GLN 103.A NE2 SER 99.A O no hydrogen 3.490 N/A GLN 103.A NE2 SER 99.A OG no hydrogen 3.150 N/A GLN 103.A NE2 GLY 132.A O no hydrogen 3.021 N/A LEU 104.A N TYR 100.A O no hydrogen 2.901 N/A LEU 105.A N LEU 101.A O no hydrogen 2.963 N/A GLN 106.A N PHE 102.A O no hydrogen 3.117 N/A GLY 107.A N GLN 103.A O no hydrogen 2.992 N/A LEU 108.A N LEU 104.A O no hydrogen 2.929 N/A ALA 109.A N LEU 105.A O no hydrogen 2.860 N/A PHE 110.A N GLN 106.A O no hydrogen 3.071 N/A CYS 111.A N GLY 107.A O no hydrogen 2.981 N/A CYS 111.A SG GLY 107.A O no hydrogen 3.653 N/A HIS 112.A N LEU 108.A O no hydrogen 2.683 N/A SER 113.A N ALA 109.A O no hydrogen 3.119 N/A SER 113.A OG ALA 109.A O no hydrogen 3.460 N/A SER 113.A OG PHE 110.A O no hydrogen 2.769 N/A SER 113.A OG HIS 114.A ND1 no hydrogen 3.214 N/A HIS 114.A N CYS 111.A O no hydrogen 2.929 N/A HIS 114.A ND1 PHE 110.A O no hydrogen 2.890 N/A ARG 115.A N HIS 112.A O no hydrogen 2.996 N/A ARG 115.A NH2 HIS 114.A O no hydrogen 3.431 N/A VAL 116.A N CYS 111.A O no hydrogen 3.020 N/A HIS 118.A N ASP 169.A OD2 no hydrogen 2.801 N/A HIS 118.A NE2 ASN 125.A OD1 no hydrogen 3.223 N/A ARG 119.A N ASP 169.A OD1 no hydrogen 2.886 N/A LYS 122.A NZ ASP 120.A O no hydrogen 3.344 N/A LYS 122.A NZ ASP 120.A OD2 no hydrogen 2.538 N/A LYS 122.A NZ ASN 125.A OD1 no hydrogen 2.821 N/A ASN 125.A N LYS 122.A O no hydrogen 2.843 N/A LEU 126.A N PRO 123.A O no hydrogen 3.135 N/A LEU 127.A N LYS 135.A O no hydrogen 2.928 N/A ILE 128.A N GLN 78.A O no hydrogen 2.805 N/A ASN 129.A N ALA 133.A O no hydrogen 3.335 N/A GLY 132.A N ASN 129.A O no hydrogen 3.494 N/A ALA 133.A N ASN 129.A OD1 no hydrogen 3.070 N/A ILE 134.A N GLN 103.A OE1 no hydrogen 3.159 N/A LYS 135.A N LEU 127.A O no hydrogen 2.693 N/A LYS 135.A NZ GLU 74.A OE1 no hydrogen 3.099 N/A LYS 135.A NZ GLU 74.A OE2 no hydrogen 3.130 N/A LEU 136.A N ASN 55.A O no hydrogen 2.924 N/A ALA 137.A N ASN 125.A O no hydrogen 2.895 N/A GLY 140.A N LEU 117.A O no hydrogen 3.240 N/A ALA 144.A N GLY 140.A O no hydrogen 3.405 N/A PHE 145.A N LEU 141.A O no hydrogen 3.167 N/A TRP 151.A NE1 GLY 189.A O no hydrogen 2.892 N/A TYR 152.A OH GLU 179.A OE2 no hydrogen 2.573 N/A ARG 153.A N LEU 150.A O no hydrogen 3.047 N/A GLU 156.A N GLU 156.A OE1 no hydrogen 2.652 N/A ILE 157.A N ALA 154.A O no hydrogen 3.112 N/A LEU 158.A N ALA 154.A O no hydrogen 3.296 N/A LEU 159.A N PRO 155.A O no hydrogen 2.915 N/A GLY 160.A N ILE 157.A O no hydrogen 3.174 N/A CYS 161.A N GLU 156.A O no hydrogen 2.932 N/A ALA 167.A N SER 165.A OG no hydrogen 3.242 N/A VAL 168.A N SER 165.A O no hydrogen 3.064 N/A ASP 169.A N THR 166.A O no hydrogen 3.093 N/A TRP 171.A N ALA 167.A O no hydrogen 3.165 N/A SER 172.A N VAL 168.A O no hydrogen 3.216 N/A SER 172.A OG TYR 152.A O no hydrogen 2.729 N/A SER 172.A OG VAL 168.A O no hydrogen 3.242 N/A LEU 173.A N ASP 169.A O no hydrogen 3.035 N/A GLY 174.A N ILE 170.A O no hydrogen 2.962 N/A CYS 175.A N TRP 171.A O no hydrogen 3.037 N/A CYS 175.A SG TRP 171.A O no hydrogen 3.591 N/A ILE 176.A N SER 172.A O no hydrogen 3.017 N/A PHE 177.A N LEU 173.A O no hydrogen 2.765 N/A ALA 178.A N GLY 174.A O no hydrogen 3.080 N/A GLU 179.A N CYS 175.A O no hydrogen 3.105 N/A MET 180.A N ILE 176.A O no hydrogen 3.001 N/A VAL 181.A N PHE 177.A O no hydrogen 3.237 N/A THR 182.A N ALA 178.A O no hydrogen 2.967 N/A THR 182.A OG1 ALA 178.A O no hydrogen 3.063 N/A THR 182.A OG1 ARG 184.A O no hydrogen 3.228 N/A ARG 183.A N GLU 179.A O no hydrogen 2.665 N/A ARG 183.A NH1 ALA 88.A O no hydrogen 3.341 N/A GLY 189.A N PHE 187.A O no hydrogen 2.990 N/A GLY 189.A N GLN 195.A OE1 no hydrogen 2.952 N/A ASP 190.A N ASP 194.A OD2 no hydrogen 3.092 N/A ASP 194.A N SER 191.A OG no hydrogen 3.200 N/A GLN 195.A N SER 191.A O no hydrogen 2.793 N/A GLN 195.A NE2 TRP 151.A O no hydrogen 3.398 N/A GLN 195.A NE2 PHE 187.A O no hydrogen 3.059 N/A LEU 196.A N GLU 192.A O no hydrogen 3.101 N/A PHE 197.A N ILE 193.A O no hydrogen 3.002 N/A ARG 198.A N ASP 194.A O no hydrogen 2.929 N/A ARG 198.A NH1 ASP 194.A OD2 no hydrogen 3.316 N/A ILE 199.A N GLN 195.A O no hydrogen 3.119 N/A PHE 200.A N LEU 196.A O no hydrogen 2.890 N/A ARG 201.A N PHE 197.A O no hydrogen 2.819 N/A THR 202.A N ILE 199.A O no hydrogen 3.079 N/A THR 202.A OG1 ARG 198.A O no hydrogen 3.135 N/A LEU 203.A N ILE 199.A O no hydrogen 2.764 N/A THR 205.A N TRP 227.A O no hydrogen 3.090 N/A THR 205.A OG1 PRO 225.A O no hydrogen 2.752 N/A VAL 209.A N ASP 207.A OD1 no hydrogen 3.024 N/A VAL 210.A N ASP 207.A OD1 no hydrogen 3.212 N/A TRP 211.A N ASP 207.A O no hydrogen 2.888 N/A GLY 213.A N GLU 208.A OE1 no hydrogen 2.807 N/A VAL 214.A N TRP 211.A O no hydrogen 2.934 N/A THR 215.A N GLU 208.A OE2 no hydrogen 3.076 N/A THR 215.A OG1 GLU 208.A OE2 no hydrogen 2.577 N/A SER 216.A N GLY 213.A O no hydrogen 2.951 N/A MET 217.A N VAL 214.A O no hydrogen 3.314 N/A ASP 219.A N LEU 159.A O no hydrogen 2.843 N/A TYR 220.A N MET 217.A O no hydrogen 3.188 N/A PHE 224.A N LYS 221.A O no hydrogen 2.956 N/A TRP 227.A N THR 205.A OG1 no hydrogen 2.993 N/A ARG 229.A NH2 LEU 203.A O no hydrogen 3.029 N/A GLN 230.A N THR 202.A O no hydrogen 2.829 N/A SER 233.A OG ASP 231.A OD2 no hydrogen 2.232 N/A LYS 234.A N ASP 231.A O no hydrogen 3.003 N/A VAL 236.A N PHE 232.A O no hydrogen 3.101 N/A LEU 239.A N VAL 236.A O no hydrogen 3.050 N/A GLY 243.A N ASP 240.A OD2 no hydrogen 2.943 N/A ARG 244.A N ASP 240.A O no hydrogen 2.953 N/A ARG 244.A NH1 LEU 239.A O no hydrogen 2.677 N/A SER 245.A N GLU 241.A O no hydrogen 2.877 N/A LEU 246.A N ASP 242.A O no hydrogen 3.017 N/A LEU 247.A N GLY 243.A O no hydrogen 2.880 N/A SER 248.A N ARG 244.A O no hydrogen 2.978 N/A SER 248.A OG ARG 244.A O no hydrogen 3.463 N/A SER 248.A OG SER 245.A O no hydrogen 2.707 N/A GLN 249.A N SER 245.A O no hydrogen 3.326 N/A MET 250.A N LEU 246.A O no hydrogen 3.152 N/A MET 250.A N LEU 247.A O no hydrogen 3.031 N/A LEU 251.A N LEU 247.A O no hydrogen 3.020 N/A TYR 253.A OH GLY 204.A O no hydrogen 2.661 N/A ASN 256.A N ASP 254.A OD1 no hydrogen 2.868 N/A LYS 257.A N ASP 254.A O no hydrogen 2.866 N/A LYS 257.A NZ VAL 210.A O no hydrogen 2.990 N/A ARG 258.A N ASP 254.A O no hydrogen 3.111 N/A ARG 258.A NE HIS 252.A O no hydrogen 2.954 N/A ARG 258.A NH1 GLU 156.A OE1 no hydrogen 2.951 N/A ARG 258.A NH1 GLU 156.A OE2 no hydrogen 3.527 N/A ARG 258.A NH1 HIS 252.A O no hydrogen 3.267 N/A ARG 258.A NH1 TYR 253.A O no hydrogen 3.059 N/A ARG 258.A NH2 GLU 156.A OE1 no hydrogen 3.568 N/A ARG 258.A NH2 GLU 156.A OE2 no hydrogen 2.841 N/A ARG 258.A NH2 ALA 167.A O no hydrogen 2.852 N/A ILE 259.A N GLN 249.A O no hydrogen 2.973 N/A LYS 262.A NZ LYS 262.A O no hydrogen 3.554 N/A ALA 263.A N SER 260.A OG no hydrogen 3.125 N/A ALA 264.A N SER 260.A O no hydrogen 2.996 N/A LEU 265.A N ALA 261.A O no hydrogen 3.196 N/A ALA 266.A N ALA 263.A O no hydrogen 3.193 N/A HIS 267.A N ALA 264.A O no hydrogen 3.077 N/A PHE 269.A N HIS 267.A ND1 no hydrogen 3.007 N/A PHE 270.A N HIS 267.A O no hydrogen 3.072 N/A GLN 271.A N PRO 268.A O no hydrogen 3.059 N/A VAL 273.A N PHE 270.A O no hydrogen 3.272 N/A