Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5k0w_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 6.A N VAL 127.A O no hydrogen 2.815 N/A LYS 6.A NZ GLU 9.A OE2 no hydrogen 2.911 N/A TRP 15.A N PRO 12.A O no hydrogen 3.212 N/A GLU 20.A N GLU 237.A OE1 no hydrogen 3.208 N/A PHE 22.A N TYR 30.A O no hydrogen 3.292 N/A ARG 23.A NE GLY 26.A O no hydrogen 2.693 N/A ARG 23.A NH2 GLY 26.A O no hydrogen 3.368 N/A ARG 23.A NH2 GLU 173.A OE2 no hydrogen 3.553 N/A ILE 24.A N LEU 28.A O no hydrogen 2.800 N/A ALA 25.A N LEU 28.A O no hydrogen 3.436 N/A GLY 26.A N TYR 241.A OH no hydrogen 2.858 N/A ASN 27.A N THR 170.A OG1 no hydrogen 3.001 N/A LEU 28.A N ALA 25.A O no hydrogen 2.968 N/A TYR 29.A N LEU 40.A O no hydrogen 2.881 N/A TYR 30.A N PHE 22.A O no hydrogen 2.839 N/A TYR 30.A OH THR 33.A O no hydrogen 2.722 N/A VAL 31.A N SER 38.A O no hydrogen 2.803 N/A THR 33.A N LEU 36.A O no hydrogen 2.942 N/A THR 33.A OG1 TRP 15.A O no hydrogen 2.744 N/A TYR 34.A N GLN 17.A O no hydrogen 2.733 N/A ASP 35.A N GLU 14.A O no hydrogen 3.024 N/A LEU 36.A N THR 33.A OG1 no hydrogen 3.007 N/A ALA 37.A N SER 224.A O no hydrogen 3.154 N/A SER 38.A OG ASN 51.A O no hydrogen 2.656 N/A TYR 39.A N ILE 50.A O no hydrogen 2.768 N/A TYR 39.A OH ALA 223.A O no hydrogen 2.646 N/A LEU 40.A N TYR 29.A O no hydrogen 2.896 N/A ILE 41.A N ILE 48.A O no hydrogen 2.901 N/A VAL 42.A N ASN 27.A O no hydrogen 3.101 N/A THR 43.A N GLY 46.A O no hydrogen 2.842 N/A THR 43.A OG1 GLY 46.A O no hydrogen 2.593 N/A LYS 45.A N THR 43.A OG1 no hydrogen 3.035 N/A GLY 46.A N THR 43.A O no hydrogen 3.388 N/A ASN 47.A N ASP 74.A O no hydrogen 2.735 N/A ILE 48.A N ILE 41.A O no hydrogen 2.913 N/A LEU 49.A N ILE 77.A O no hydrogen 2.955 N/A ILE 50.A N TYR 39.A O no hydrogen 2.814 N/A ASN 51.A N LEU 79.A O no hydrogen 2.929 N/A ASN 51.A ND2 THR 81.A OG1 no hydrogen 2.721 N/A THR 52.A N HIS 87.A O no hydrogen 2.879 N/A THR 52.A OG1 GLY 53.A O no hydrogen 3.356 N/A THR 52.A OG1 HIS 87.A O no hydrogen 3.131 N/A THR 54.A OG1 ASN 16.A OD1 no hydrogen 2.711 N/A THR 54.A OG1 GLU 56.A OE2 no hydrogen 2.993 N/A THR 54.A OG1 SER 57.A OG.A no hydrogen 3.331 N/A ALA 55.A N GLU 7.A OE2 no hydrogen 2.802 N/A GLU 56.A N GLU 56.A OE2 no hydrogen 2.721 N/A SER 57.A N THR 54.A O no hydrogen 3.201 N/A SER 57.A OG.A THR 54.A OG1 no hydrogen 3.331 N/A SER 57.A OG.B THR 52.A O no hydrogen 2.291 N/A SER 57.A OG.B THR 54.A O no hydrogen 2.734 N/A PHE 58.A N ALA 55.A O no hydrogen 3.367 N/A ILE 61.A N SER 57.A O no hydrogen 2.842 N/A LYS 62.A N PHE 58.A O no hydrogen 3.175 N/A LYS 62.A NZ GLU 97.A OE1 no hydrogen 3.189 N/A ALA 63.A N PRO 59.A O no hydrogen 2.924 N/A ASN 64.A N ILE 60.A O no hydrogen 2.851 N/A ASN 64.A ND2 TYR 19.A O no hydrogen 3.295 N/A ASN 64.A ND2 VAL 31.A O no hydrogen 2.758 N/A ILE 65.A N ILE 61.A O no hydrogen 2.882 N/A GLN 66.A N LYS 62.A O no hydrogen 3.203 N/A LYS 67.A N ALA 63.A O no hydrogen 2.952 N/A LEU 68.A N ASN 64.A O no hydrogen 3.282 N/A GLY 69.A N GLN 66.A O no hydrogen 2.810 N/A PHE 70.A N ILE 65.A O no hydrogen 3.128 N/A TYR 72.A OH GLU 97.A OE1 no hydrogen 3.037 N/A LYS 73.A N ASN 71.A OD1 no hydrogen 3.188 N/A LYS 73.A NZ TYR 72.A OH no hydrogen 3.420 N/A ASP 74.A N ASN 71.A O no hydrogen 3.092 N/A ILE 75.A N TYR 72.A O no hydrogen 3.094 N/A LYS 76.A N ASN 47.A O no hydrogen 2.615 N/A ILE 77.A N ASN 47.A O no hydrogen 3.338 N/A LEU 78.A N LYS 101.A O no hydrogen 2.839 N/A LEU 79.A N LEU 49.A O no hydrogen 2.796 N/A THR 81.A N ASN 51.A OD1 no hydrogen 2.868 N/A THR 81.A OG1 ASN 183.A OD1 no hydrogen 3.510 N/A THR 81.A OG1 SER 224.A OG no hydrogen 2.739 N/A GLN 82.A NE2 ASN 183.A OD1 no hydrogen 2.763 N/A HIS 84.A ND1 GLN 82.A OE1 no hydrogen 2.920 N/A HIS 87.A N HIS 84.A O no hydrogen 2.857 N/A THR 88.A N HIS 84.A O no hydrogen 3.061 N/A THR 88.A OG1 HIS 84.A O no hydrogen 3.106 N/A GLY 89.A N TYR 85.A O no hydrogen 2.881 N/A ALA 90.A N THR 52.A OG1 no hydrogen 3.023 N/A LEU 91.A N THR 88.A O no hydrogen 3.137 N/A PHE 94.A N ALA 90.A O no hydrogen 2.892 N/A LYS 95.A N LEU 91.A O no hydrogen 2.951 N/A LYS 95.A NZ THR 133.A O no hydrogen 2.858 N/A THR 96.A N GLN 92.A O no hydrogen 2.951 N/A THR 96.A OG1 GLN 92.A O no hydrogen 3.420 N/A THR 96.A OG1 ASP 93.A O no hydrogen 3.466 N/A GLU 97.A N ASP 93.A O no hydrogen 3.195 N/A THR 98.A N PHE 94.A O no hydrogen 3.010 N/A THR 98.A OG1 PHE 94.A O no hydrogen 2.698 N/A ALA 99.A N LYS 95.A O no hydrogen 3.029 N/A LYS 101.A N LYS 76.A O no hydrogen 3.051 N/A PHE 102.A N ASP 135.A OD1 no hydrogen 2.763 N/A TYR 103.A N LEU 78.A O no hydrogen 3.199 N/A VAL 104.A N LYS 136.A O no hydrogen 3.305 N/A LYS 106.A N LEU 138.A O no hydrogen 2.844 N/A ALA 107.A N ASP 105.A OD1 no hydrogen 3.298 N/A ASP 108.A N ASP 105.A O no hydrogen 3.097 N/A VAL 109.A N LYS 106.A O no hydrogen 3.248 N/A LEU 112.A N ASP 108.A O no hydrogen 3.244 N/A ARG 113.A N VAL 109.A O no hydrogen 3.037 N/A THR 114.A N ASP 110.A O no hydrogen 3.026 N/A THR 114.A OG1 ASP 110.A O no hydrogen 3.055 N/A THR 114.A OG1 VAL 111.A O no hydrogen 3.502 N/A THR 114.A OG1 SER 118.A OG no hydrogen 3.252 N/A GLY 115.A N LEU 112.A O no hydrogen 3.461 N/A GLY 116.A N VAL 111.A O no hydrogen 2.861 N/A LYS 117.A N THR 114.A O no hydrogen 3.217 N/A LYS 117.A NZ GLN 3.A OE1 no hydrogen 3.260 N/A SER 118.A N THR 114.A OG1 no hydrogen 3.055 N/A SER 118.A OG THR 114.A OG1 no hydrogen 3.252 N/A ASP 119.A N GLY 116.A O no hydrogen 3.052 N/A TYR 120.A OH HIS 159.A O no hydrogen 2.923 N/A GLU 121.A N ASP 119.A OD1 no hydrogen 2.872 N/A MET 122.A N ASP 119.A OD1 no hydrogen 2.713 N/A GLY 123.A N ASP 119.A O no hydrogen 2.971 N/A LYS 124.A NZ GLU 121.A OE2 no hydrogen 2.979 N/A TYR 125.A N MET 122.A O no hydrogen 3.243 N/A GLY 126.A N GLY 123.A O no hydrogen 2.836 N/A THR 128.A N GLY 115.A O no hydrogen 3.071 N/A PHE 129.A N GLY 115.A O no hydrogen 3.463 N/A LYS 130.A NZ ASP 93.A OD1 no hydrogen 2.762 N/A VAL 132.A N LEU 112.A O no hydrogen 2.838 N/A ASP 135.A N PHE 102.A O no hydrogen 2.785 N/A LYS 136.A N PHE 102.A O no hydrogen 3.426 N/A LEU 138.A N VAL 104.A O no hydrogen 2.712 N/A LYS 139.A N ASP 142.A OD2 no hydrogen 2.704 N/A GLN 141.A N LEU 153.A O no hydrogen 2.857 N/A ASP 142.A N LYS 139.A O no hydrogen 3.213 N/A LYS 143.A NZ THR 152.A OG1 no hydrogen 3.021 N/A ILE 144.A N LEU 151.A O no hydrogen 2.814 N/A LEU 146.A N ILE 149.A O no hydrogen 3.259 N/A LEU 151.A N ILE 144.A O no hydrogen 2.848 N/A THR 152.A N ILE 167.A O no hydrogen 2.952 N/A LEU 153.A N ASP 142.A O no hydrogen 3.030 N/A LEU 154.A N SER 165.A O no hydrogen 2.796 N/A HIS 155.A N ASP 140.A OD1 no hydrogen 2.725 N/A HIS 155.A ND1 ASP 105.A OD2 no hydrogen 2.743 N/A HIS 156.A N SER 163.A O no hydrogen 2.976 N/A HIS 156.A ND1 SER 165.A OG no hydrogen 2.715 N/A GLY 158.A N THR 160.A O no hydrogen 2.931 N/A THR 160.A N SER 163.A OG no hydrogen 3.244 N/A THR 160.A OG1 ASP 108.A OD2 no hydrogen 2.864 N/A LYS 161.A NZ ALA 198.A O no hydrogen 2.856 N/A GLY 162.A N ASP 108.A OD1 no hydrogen 3.196 N/A SER 163.A N THR 160.A O no hydrogen 3.379 N/A SER 163.A OG HIS 156.A O no hydrogen 2.854 N/A SER 163.A OG THR 160.A O no hydrogen 2.897 N/A CYS 164.A N THR 81.A O no hydrogen 2.796 N/A CYS 164.A SG LEU 80.A O no hydrogen 3.168 N/A CYS 164.A SG GLY 162.A O no hydrogen 4.001 N/A SER 165.A N LEU 154.A O no hydrogen 2.886 N/A SER 165.A OG HIS 156.A ND1 no hydrogen 2.715 N/A PHE 166.A N ILE 181.A O no hydrogen 3.011 N/A ILE 167.A N THR 152.A O no hydrogen 3.074 N/A PHE 168.A N VAL 179.A O no hydrogen 2.974 N/A THR 170.A N TYR 177.A O no hydrogen 3.019 N/A ASP 172.A N ARG 175.A O no hydrogen 3.025 N/A LYS 174.A N ASP 172.A OD1 no hydrogen 3.113 N/A ARG 175.A N ASP 172.A OD1 no hydrogen 2.865 N/A ARG 175.A NE LYS 176.A O no hydrogen 2.873 N/A ARG 175.A NH1 LYS 176.A O no hydrogen 3.032 N/A TYR 177.A N THR 170.A O no hydrogen 2.769 N/A TYR 177.A OH ASP 172.A OD1 no hydrogen 3.409 N/A TYR 177.A OH ASP 172.A OD2 no hydrogen 2.544 N/A ARG 178.A N ASP 219.A OD2 no hydrogen 2.943 N/A ARG 178.A NE ASP 217.A O no hydrogen 2.823 N/A VAL 179.A N PHE 168.A O no hydrogen 2.631 N/A LEU 180.A N ILE 220.A O no hydrogen 2.801 N/A ILE 181.A N PHE 166.A O no hydrogen 2.817 N/A ALA 182.A N VAL 222.A O no hydrogen 2.877 N/A ASN 183.A N SER 165.A OG no hydrogen 3.025 N/A SER 186.A N MET 184.A O no hydrogen 2.940 N/A SER 186.A OG HIS 159.A ND1 no hydrogen 3.214 N/A LYS 191.A NZ GLU 195.A O no hydrogen 3.205 N/A LYS 192.A N GLU 195.A OE1 no hydrogen 3.192 N/A LYS 192.A NZ LYS 269.A O no hydrogen 3.520 N/A SER 194.A OG ASP 270.A O no hydrogen 3.375 N/A GLU 195.A N LYS 192.A O no hydrogen 2.793 N/A VAL 196.A N PHE 193.A O no hydrogen 3.187 N/A THR 197.A N GLU 195.A O no hydrogen 2.777 N/A TYR 199.A N VAL 196.A O no hydrogen 3.331 N/A TYR 199.A OH ASP 205.A OD2 no hydrogen 2.630 N/A ILE 202.A N TYR 199.A O no hydrogen 3.389 N/A SER 204.A OG ASN 201.A O no hydrogen 3.164 N/A ASP 205.A N ASN 201.A O no hydrogen 2.866 N/A TYR 206.A N ILE 202.A O no hydrogen 3.262 N/A TYR 206.A OH SER 186.A O no hydrogen 2.558 N/A ALA 207.A N GLN 203.A O no hydrogen 3.109 N/A TYR 208.A N SER 204.A O no hydrogen 2.982 N/A THR 209.A N ASP 205.A O no hydrogen 2.993 N/A THR 209.A OG1 PRO 157.A O no hydrogen 2.810 N/A THR 209.A OG1 ASP 205.A O no hydrogen 3.057 N/A PHE 210.A N TYR 206.A O no hydrogen 2.863 N/A GLY 211.A N ALA 207.A O no hydrogen 3.351 N/A VAL 212.A N TYR 208.A O no hydrogen 2.959 N/A MET 213.A N THR 209.A O no hydrogen 2.996 N/A LYS 214.A N PHE 210.A O no hydrogen 3.311 N/A LYS 214.A NZ GLU 260.A OE1 no hydrogen 3.520 N/A LYS 215.A N VAL 212.A O no hydrogen 3.413 N/A ASP 219.A N ARG 178.A O no hydrogen 2.602 N/A ILE 220.A N ARG 178.A O no hydrogen 3.030 N/A TRP 221.A N PHE 246.A O no hydrogen 3.029 N/A TRP 221.A NE1 ASP 248.A O no hydrogen 3.152 N/A VAL 222.A N LEU 180.A O no hydrogen 3.060 N/A SER 224.A OG THR 81.A OG1 no hydrogen 2.739 N/A SER 224.A OG ASN 183.A OD1 no hydrogen 2.618 N/A HIS 225.A N GLN 228.A OE1 no hydrogen 3.097 N/A HIS 225.A ND1 ASP 35.A OD2 no hydrogen 2.903 N/A ALA 226.A N ASP 35.A O no hydrogen 2.903 N/A SER 227.A N ASP 35.A OD1 no hydrogen 3.195 N/A SER 227.A OG ASP 35.A OD1 no hydrogen 3.452 N/A GLN 228.A N HIS 225.A O no hydrogen 3.162 N/A PHE 229.A N ALA 226.A O no hydrogen 3.341 N/A ASP 230.A N SER 227.A O no hydrogen 3.298 N/A LEU 231.A N ALA 226.A O no hydrogen 3.106 N/A HIS 232.A NE2 TYR 34.A O no hydrogen 2.724 N/A GLU 233.A N ASP 230.A O no hydrogen 3.366 N/A LYS 234.A N ASP 230.A O no hydrogen 3.139 N/A LYS 234.A NZ PHE 229.A O no hydrogen 2.867 N/A LYS 234.A NZ LEU 245.A O no hydrogen 3.062 N/A LYS 234.A NZ ASP 248.A OD1 no hydrogen 2.769 N/A LYS 234.A NZ ASP 248.A OD2 no hydrogen 3.022 N/A ARG 235.A N LEU 231.A O no hydrogen 2.959 N/A ARG 235.A NH1 ASP 239.A O no hydrogen 2.822 N/A LYS 236.A N ASP 239.A OD2 no hydrogen 2.987 N/A ASP 239.A N LYS 236.A O no hydrogen 3.303 N/A TYR 241.A OH ASP 172.A OD2 no hydrogen 2.829 N/A GLN 244.A N GLN 244.A OE1 no hydrogen 2.980 N/A LEU 245.A N ASN 242.A O no hydrogen 3.179 N/A PHE 246.A N PRO 243.A O no hydrogen 2.991 N/A ASP 248.A N ASP 248.A OD1 no hydrogen 2.739 N/A LYS 249.A NZ PHE 218.A O no hydrogen 2.987 N/A SER 251.A N ASP 248.A O no hydrogen 3.151 N/A TYR 252.A N LYS 249.A O no hydrogen 3.020 N/A TYR 252.A OH MET 213.A O no hydrogen 2.688 N/A PHE 253.A N LYS 249.A O no hydrogen 3.285 N/A GLN 254.A N GLN 250.A O no hydrogen 2.953 N/A ASN 255.A N SER 251.A O no hydrogen 3.072 N/A LEU 256.A N TYR 252.A O no hydrogen 2.990 N/A ASN 257.A N PHE 253.A O no hydrogen 2.950 N/A ASP 258.A N GLN 254.A O no hydrogen 2.982 N/A LEU 259.A N ASN 255.A O no hydrogen 3.080 N/A GLU 260.A N LEU 256.A O no hydrogen 3.028 N/A LYS 261.A N ASN 257.A O no hydrogen 2.837 N/A LYS 261.A NZ ASN 257.A OD1 no hydrogen 3.351 N/A SER 262.A N ASP 258.A O no hydrogen 3.234 N/A SER 262.A OG ASP 258.A O no hydrogen 3.297 N/A SER 262.A OG LEU 259.A O no hydrogen 3.350 N/A TYR 263.A N LEU 259.A O no hydrogen 2.969 N/A TYR 263.A OH GLN 203.A O no hydrogen 2.557 N/A LEU 264.A N GLU 260.A O no hydrogen 2.815 N/A ASN 265.A N LYS 261.A O no hydrogen 3.065 N/A LYS 266.A N SER 262.A O no hydrogen 2.953 N/A LYS 266.A NZ ASP 190.A O no hydrogen 3.470 N/A LYS 266.A NZ LYS 191.A O no hydrogen 2.754 N/A ILE 267.A N TYR 263.A O no hydrogen 3.111 N/A LYS 268.A N LEU 264.A O no hydrogen 3.099 N/A LYS 268.A NZ ASN 265.A OD1 no hydrogen 3.138 N/A LYS 269.A N LYS 266.A O no hydrogen 3.292 N/A LYS 269.A NZ LYS 266.A O no hydrogen 3.364 N/A ASP 270.A N ILE 267.A O no hydrogen 2.982 N/A