Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ke9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 5.A N ARG 22.A O no hydrogen 3.137 N/A VAL 7.A N LYS 20.A O no hydrogen 2.892 N/A GLU 8.A N LYS 20.A O no hydrogen 3.429 N/A LYS 9.A NZ GLU 12.A OE1 no hydrogen 3.301 N/A LYS 9.A NZ GLU 12.A OE2 no hydrogen 3.111 N/A ILE 10.A N VAL 18.A O no hydrogen 2.782 N/A GLY 11.A N VAL 18.A O no hydrogen 3.299 N/A GLY 13.A N GLY 16.A O no hydrogen 2.567 N/A THR 14.A OG1 ASP 120.A OD2 no hydrogen 3.535 N/A GLY 16.A N GLY 13.A O no hydrogen 3.461 N/A VAL 18.A N GLY 11.A O no hydrogen 2.832 N/A TYR 19.A N LEU 32.A O no hydrogen 2.828 N/A LYS 20.A N GLU 8.A O no hydrogen 2.911 N/A ALA 21.A N VAL 30.A O no hydrogen 3.036 N/A ASN 23.A N GLU 28.A O no hydrogen 2.942 N/A LYS 24.A N ASN 3.A O no hydrogen 2.853 N/A THR 26.A N ASN 23.A OD1 no hydrogen 3.205 N/A GLY 27.A N ASN 23.A O no hydrogen 2.613 N/A VAL 29.A N GLU 28.A OE1 no hydrogen 2.954 N/A VAL 30.A N ALA 21.A O no hydrogen 2.834 N/A ALA 31.A N PHE 73.A O no hydrogen 2.753 N/A LEU 32.A N TYR 19.A O no hydrogen 2.954 N/A LYS 33.A N LEU 71.A O no hydrogen 2.590 N/A LYS 34.A N VAL 17.A O no hydrogen 2.934 N/A ILE 35.A N LEU 69.A O no hydrogen 3.105 N/A ARG 36.A N TYR 15.A O no hydrogen 2.764 N/A ARG 43.A N SER 39.A O no hydrogen 3.236 N/A GLU 44.A N THR 40.A O no hydrogen 2.802 N/A ILE 45.A N ALA 41.A O no hydrogen 2.859 N/A SER 46.A N ILE 42.A O no hydrogen 2.921 N/A SER 46.A OG ILE 42.A O no hydrogen 2.865 N/A LEU 47.A N ARG 43.A O no hydrogen 3.195 N/A LEU 47.A N GLU 44.A O no hydrogen 3.153 N/A LEU 48.A N GLU 44.A O no hydrogen 3.482 N/A LYS 49.A N ILE 45.A O no hydrogen 3.312 N/A LYS 49.A NZ ASP 61.A OD2 no hydrogen 3.523 N/A GLU 50.A N LEU 47.A O no hydrogen 3.120 N/A LEU 51.A N LEU 48.A O no hydrogen 3.164 N/A HIS 53.A NE2 ASN 55.A OD1 no hydrogen 3.000 N/A ASN 55.A ND2 GLN 103.A OE1 no hydrogen 3.369 N/A ASN 55.A ND2 ILE 134.A O no hydrogen 3.157 N/A ILE 56.A N HIS 53.A O no hydrogen 3.090 N/A VAL 57.A N LEU 136.A O no hydrogen 2.940 N/A LYS 58.A N GLU 74.A OE2 no hydrogen 2.905 N/A LYS 58.A NZ LYS 49.A O no hydrogen 2.948 N/A LYS 58.A NZ ASN 52.A OD1 no hydrogen 2.816 N/A LYS 58.A NZ LEU 59.A O no hydrogen 2.807 N/A LEU 60.A N VAL 72.A O no hydrogen 2.674 N/A ASP 61.A N VAL 72.A O no hydrogen 3.157 N/A ILE 63.A N TYR 70.A O no hydrogen 2.904 N/A THR 65.A N LYS 68.A O no hydrogen 2.864 N/A LYS 68.A N THR 65.A O no hydrogen 2.857 N/A TYR 70.A N ILE 63.A O no hydrogen 2.738 N/A LEU 71.A N LYS 33.A O no hydrogen 2.529 N/A VAL 72.A N ASP 61.A O no hydrogen 2.931 N/A PHE 73.A N ALA 31.A O no hydrogen 2.718 N/A GLU 74.A N LYS 58.A O no hydrogen 2.981 N/A GLN 78.A NE2 ARG 280.A O no hydrogen 3.332 N/A LEU 80.A N LEU 126.A O no hydrogen 2.747 N/A LYS 82.A N ASP 79.A OD2 no hydrogen 2.819 N/A PHE 83.A N ASP 79.A O no hydrogen 3.259 N/A MET 84.A N LEU 80.A O no hydrogen 2.843 N/A ASP 85.A N LYS 81.A O no hydrogen 2.922 N/A ALA 86.A N LYS 82.A O no hydrogen 2.958 N/A SER 87.A N PHE 83.A O no hydrogen 3.066 N/A SER 87.A N MET 84.A O no hydrogen 3.093 N/A SER 87.A OG PHE 83.A O no hydrogen 2.977 N/A ALA 88.A N ASP 85.A O no hydrogen 3.100 N/A THR 90.A OG1 GLY 91.A O no hydrogen 3.400 N/A GLY 91.A N SER 87.A O no hydrogen 2.602 N/A LEU 96.A N PRO 93.A O no hydrogen 2.871 N/A ILE 97.A N PRO 93.A O no hydrogen 3.093 N/A LYS 98.A N LEU 94.A O no hydrogen 2.889 N/A LYS 98.A NZ PHE 268.A O no hydrogen 2.778 N/A LYS 98.A NZ ASP 271.A OD1 no hydrogen 2.649 N/A SER 99.A N PRO 95.A O no hydrogen 3.312 N/A TYR 100.A N LEU 96.A O no hydrogen 2.883 N/A LEU 101.A N ILE 97.A O no hydrogen 2.949 N/A PHE 102.A N LYS 98.A O no hydrogen 3.151 N/A GLN 103.A N SER 99.A O no hydrogen 3.030 N/A GLN 103.A NE2 SER 99.A O no hydrogen 3.395 N/A GLN 103.A NE2 SER 99.A OG no hydrogen 3.054 N/A GLN 103.A NE2 GLY 132.A O no hydrogen 2.948 N/A LEU 104.A N TYR 100.A O no hydrogen 3.000 N/A LEU 105.A N LEU 101.A O no hydrogen 3.092 N/A GLN 106.A N PHE 102.A O no hydrogen 3.210 N/A GLN 106.A NE2 PHE 102.A O no hydrogen 3.329 N/A GLY 107.A N GLN 103.A O no hydrogen 3.017 N/A LEU 108.A N LEU 104.A O no hydrogen 2.855 N/A ALA 109.A N LEU 105.A O no hydrogen 2.858 N/A PHE 110.A N GLN 106.A O no hydrogen 3.075 N/A CYS 111.A N GLY 107.A O no hydrogen 3.018 N/A CYS 111.A SG GLY 107.A O no hydrogen 3.598 N/A HIS 112.A N LEU 108.A O no hydrogen 2.733 N/A HIS 112.A ND1 VAL 116.A O no hydrogen 3.295 N/A SER 113.A N ALA 109.A O no hydrogen 3.147 N/A SER 113.A OG ALA 109.A O no hydrogen 3.351 N/A SER 113.A OG PHE 110.A O no hydrogen 2.703 N/A HIS 114.A N CYS 111.A O no hydrogen 2.852 N/A HIS 114.A ND1 PHE 110.A O no hydrogen 3.139 N/A ARG 115.A N HIS 112.A O no hydrogen 3.188 N/A VAL 116.A N CYS 111.A O no hydrogen 2.974 N/A HIS 118.A N ASP 168.A OD2 no hydrogen 2.838 N/A ARG 119.A N ASP 168.A OD1 no hydrogen 2.763 N/A LYS 122.A NZ ASP 120.A O no hydrogen 3.515 N/A LYS 122.A NZ ASP 120.A OD2 no hydrogen 2.443 N/A LYS 122.A NZ ASN 125.A OD1 no hydrogen 3.222 N/A ASN 125.A N LYS 122.A O no hydrogen 2.907 N/A LEU 126.A N PRO 123.A O no hydrogen 3.253 N/A LEU 127.A N LYS 135.A O no hydrogen 2.948 N/A ILE 128.A N GLN 78.A O no hydrogen 2.975 N/A ASN 129.A N ALA 133.A O no hydrogen 3.263 N/A THR 130.A OG1 GLU 131.A OE1 no hydrogen 3.141 N/A THR 130.A OG1 GLU 131.A OE2 no hydrogen 3.093 N/A GLU 131.A N GLU 131.A OE2 no hydrogen 2.499 N/A ALA 133.A N ASN 129.A OD1 no hydrogen 2.972 N/A ILE 134.A N GLN 103.A OE1 no hydrogen 3.234 N/A LYS 135.A N LEU 127.A O no hydrogen 2.735 N/A LYS 135.A NZ GLU 74.A OE1 no hydrogen 2.894 N/A LYS 135.A NZ GLU 74.A OE2 no hydrogen 3.164 N/A LEU 136.A N ASN 55.A O no hydrogen 2.867 N/A ALA 137.A N ASN 125.A O no hydrogen 2.917 N/A LEU 141.A N ASP 138.A O no hydrogen 3.138 N/A ALA 144.A N GLY 140.A O no hydrogen 3.506 N/A PHE 145.A N LEU 141.A O no hydrogen 2.985 N/A TRP 150.A NE1 GLY 188.A O no hydrogen 3.107 N/A TYR 151.A OH GLU 178.A OE1 no hydrogen 3.422 N/A TYR 151.A OH GLU 178.A OE2 no hydrogen 2.684 N/A ARG 152.A N LEU 149.A O no hydrogen 3.092 N/A GLU 155.A N GLU 155.A OE1 no hydrogen 2.789 N/A ILE 156.A N ALA 153.A O no hydrogen 3.175 N/A LEU 157.A N ALA 153.A O no hydrogen 3.303 N/A LEU 158.A N PRO 154.A O no hydrogen 2.908 N/A GLY 159.A N ILE 156.A O no hydrogen 2.986 N/A CYS 160.A N GLU 155.A O no hydrogen 2.937 N/A ALA 166.A N SER 164.A OG no hydrogen 3.346 N/A VAL 167.A N SER 164.A O no hydrogen 3.043 N/A ASP 168.A N THR 165.A O no hydrogen 3.159 N/A TRP 170.A N ALA 166.A O no hydrogen 3.223 N/A SER 171.A N VAL 167.A O no hydrogen 3.249 N/A SER 171.A OG TYR 151.A O no hydrogen 2.597 N/A SER 171.A OG VAL 167.A O no hydrogen 3.235 N/A LEU 172.A N ASP 168.A O no hydrogen 3.034 N/A GLY 173.A N ILE 169.A O no hydrogen 2.860 N/A CYS 174.A N TRP 170.A O no hydrogen 3.039 N/A CYS 174.A SG TRP 170.A O no hydrogen 3.552 N/A ILE 175.A N SER 171.A O no hydrogen 3.118 N/A PHE 176.A N LEU 172.A O no hydrogen 2.816 N/A ALA 177.A N GLY 173.A O no hydrogen 3.202 N/A GLU 178.A N CYS 174.A O no hydrogen 3.256 N/A MET 179.A N ILE 175.A O no hydrogen 3.047 N/A VAL 180.A N PHE 176.A O no hydrogen 3.350 N/A THR 181.A N ALA 177.A O no hydrogen 3.009 N/A THR 181.A OG1 ALA 177.A O no hydrogen 3.032 N/A THR 181.A OG1 ARG 183.A O no hydrogen 3.068 N/A ARG 182.A N GLU 178.A O no hydrogen 2.789 N/A ARG 182.A NH2 ALA 88.A O no hydrogen 2.858 N/A GLY 188.A N PHE 186.A O no hydrogen 3.006 N/A GLY 188.A N GLN 194.A OE1 no hydrogen 2.797 N/A ASP 189.A N ASP 193.A OD2 no hydrogen 2.891 N/A SER 190.A OG ASP 189.A OD1 no hydrogen 3.394 N/A GLN 194.A N SER 190.A O no hydrogen 2.864 N/A GLN 194.A NE2 TRP 150.A O no hydrogen 3.457 N/A GLN 194.A NE2 PHE 186.A O no hydrogen 3.037 N/A LEU 195.A N GLU 191.A O no hydrogen 2.992 N/A PHE 196.A N ILE 192.A O no hydrogen 2.934 N/A ARG 197.A N ASP 193.A O no hydrogen 2.906 N/A ARG 197.A NH1 ASP 193.A OD2 no hydrogen 2.990 N/A ILE 198.A N GLN 194.A O no hydrogen 3.161 N/A PHE 199.A N LEU 195.A O no hydrogen 2.957 N/A ARG 200.A N PHE 196.A O no hydrogen 2.929 N/A THR 201.A OG1 ARG 197.A O no hydrogen 3.125 N/A LEU 202.A N ILE 198.A O no hydrogen 2.924 N/A THR 204.A N TRP 226.A O no hydrogen 3.059 N/A THR 204.A OG1 PRO 224.A O no hydrogen 2.801 N/A VAL 208.A N ASP 206.A OD1 no hydrogen 3.173 N/A VAL 209.A N ASP 206.A OD1 no hydrogen 3.103 N/A TRP 210.A N ASP 206.A O no hydrogen 2.784 N/A GLY 212.A N GLU 207.A OE1 no hydrogen 2.870 N/A GLY 212.A N GLU 207.A OE2 no hydrogen 3.146 N/A VAL 213.A N TRP 210.A O no hydrogen 3.142 N/A THR 214.A N GLU 207.A OE2 no hydrogen 3.197 N/A THR 214.A OG1 GLU 207.A OE2 no hydrogen 2.842 N/A SER 215.A N GLY 212.A O no hydrogen 3.161 N/A MET 216.A N VAL 213.A O no hydrogen 3.323 N/A ASP 218.A N LEU 158.A O no hydrogen 3.150 N/A TYR 219.A N MET 216.A O no hydrogen 3.367 N/A PHE 223.A N LYS 220.A O no hydrogen 2.985 N/A TRP 226.A N THR 204.A OG1 no hydrogen 2.969 N/A ARG 228.A NH2 LEU 202.A O no hydrogen 3.059 N/A GLN 229.A N THR 201.A O no hydrogen 2.864 N/A LYS 233.A N ASP 230.A O no hydrogen 3.202 N/A VAL 234.A N PHE 231.A O no hydrogen 2.981 N/A VAL 235.A N PHE 231.A O no hydrogen 2.861 N/A LEU 238.A N VAL 235.A O no hydrogen 3.145 N/A GLY 242.A N ASP 239.A OD2 no hydrogen 3.024 N/A ARG 243.A N ASP 239.A O no hydrogen 3.032 N/A SER 244.A N GLU 240.A O no hydrogen 2.881 N/A SER 244.A OG ASP 241.A O no hydrogen 3.076 N/A SER 244.A OG HIS 266.A NE2 no hydrogen 2.900 N/A LEU 245.A N ASP 241.A O no hydrogen 3.013 N/A LEU 246.A N GLY 242.A O no hydrogen 2.879 N/A SER 247.A N ARG 243.A O no hydrogen 2.964 N/A SER 247.A OG ARG 243.A O no hydrogen 3.472 N/A SER 247.A OG SER 244.A O no hydrogen 2.739 N/A GLN 248.A N SER 244.A O no hydrogen 3.254 N/A MET 249.A N LEU 245.A O no hydrogen 3.121 N/A MET 249.A N LEU 246.A O no hydrogen 3.118 N/A LEU 250.A N LEU 246.A O no hydrogen 3.045 N/A TYR 252.A OH GLY 203.A O no hydrogen 2.585 N/A ASN 255.A N ASP 253.A OD1 no hydrogen 2.900 N/A ASN 255.A ND2 ASP 253.A OD1 no hydrogen 3.264 N/A LYS 256.A N ASP 253.A O no hydrogen 2.922 N/A ARG 257.A N ASP 253.A O no hydrogen 3.061 N/A ARG 257.A NE HIS 251.A O no hydrogen 2.929 N/A ARG 257.A NH1 GLU 155.A OE1 no hydrogen 2.965 N/A ARG 257.A NH1 HIS 251.A O no hydrogen 3.091 N/A ARG 257.A NH2 GLU 155.A OE1 no hydrogen 3.485 N/A ARG 257.A NH2 GLU 155.A OE2 no hydrogen 2.873 N/A ARG 257.A NH2 ALA 166.A O no hydrogen 2.849 N/A ILE 258.A N GLN 248.A O no hydrogen 2.912 N/A ALA 262.A N SER 259.A OG no hydrogen 3.287 N/A ALA 263.A N SER 259.A O no hydrogen 2.881 N/A LEU 264.A N ALA 260.A O no hydrogen 3.201 N/A ALA 265.A N ALA 262.A O no hydrogen 3.006 N/A HIS 266.A N ALA 263.A O no hydrogen 3.159 N/A HIS 266.A NE2 SER 244.A OG no hydrogen 2.900 N/A PHE 268.A N HIS 266.A ND1 no hydrogen 3.034 N/A PHE 269.A N HIS 266.A O no hydrogen 3.067 N/A GLN 270.A N PRO 267.A O no hydrogen 3.024 N/A ARG 280.A NE LEU 281.A O no hydrogen 3.198 N/A